| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 35.3 | Very low | 37.2 | Very low | 205 Ų | 205 | 151.7 Ų | 151.7 | 100% | 1.01 | 80% | 0.795 | S | S | * | * | 0 | 110 | 0 | -86.4 | 71.7 | -176.9 | 0 | 0 | 107.3 | |||||
| 2 | E | 40.2 | Very low | 36.8 | Very low | 157 Ų | 157 | 152.2 Ų | 152.2 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | 73.7 | 99.5 | 97.4 | -66.7 | 159.6 | -174.1 | 0 | 0 | 108.9 | |||||
| 3 | I | 42.4 | Very low | 37 | Very low | 153 Ų | 153 | 159.2 Ų | 159.2 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | cis | 57.9 | 126.4 | 44 | -41.9 | -178.8 | 0 | 0 | 0 | 113.1 | ||||
| 4 | L | 38 | Very low | 36.9 | Very low | 160 Ų | 160 | 154.1 Ų | 154.1 | 84% | 0.838 | 78% | 0.776 | S | S | * | * | trans | 108.1 | 138.8 | 169.7 | -62.6 | 160.1 | 0 | 0 | 0 | 114.2 | ||||
| 5 | D | 37.4 | Very low | 37.3 | Very low | 129 Ų | 129 | 158.3 Ų | 158.3 | 69% | 0.69 | 78% | 0.779 | S | S | * | * | cis | -170.4 | 164 | -23.2 | -169.7 | 28.7 | 0 | 0 | 0 | 110 | ||||
| 6 | S | 35.5 | Very low | 37.4 | Very low | 87 Ų | 87 | 155.7 Ų | 155.7 | 61% | 0.608 | 77% | 0.769 | S | S | * | * | trans | 64.2 | 147 | 152.9 | -77.6 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 7 | T | 34.3 | Very low | 37.4 | Very low | 121 Ų | 121 | 155.1 Ų | 155.1 | 74% | 0.742 | 77% | 0.769 | S | S | * | * | cis | -160.2 | 135.5 | 4.5 | -1.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 8 | E | 33.6 | Very low | 37.5 | Very low | 188 Ų | 188 | 152.3 Ų | 152.3 | 88% | 0.879 | 77% | 0.767 | S | S | * | * | trans | -166 | 130 | 139.1 | -117.8 | 178.8 | -176.9 | 0 | 0 | 111.3 | ||||
| 9 | S | 38.3 | Very low | 37.6 | Very low | 104 Ų | 104 | 153.3 Ų | 153.3 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | trans | -98.5 | 103.9 | -163.9 | -55.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 10 | F | 35.9 | Very low | 37.6 | Very low | 206 Ų | 206 | 154.2 Ų | 154.2 | 90% | 0.904 | 78% | 0.775 | S | S | * | * | trans | -101.5 | 105.2 | 162.3 | -92.5 | -88.9 | 0 | 0 | 0 | 110.7 | H12 | F10-H12 PolarHBondContact O-N 3.3Š| ||
| 11 | L | 38.5 | Very low | 37.5 | Very low | 159 Ų | 159 | 151.8 Ų | 151.8 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | trans | -69.6 | 116.7 | -177.7 | -70.5 | 165.7 | 0 | 0 | 0 | 111.2 | W13 | L11-W13 PolarHBondContact O-N 3.04Š| ||
| 12 | H | 32.7 | Very low | 37.6 | Very low | 157 Ų | 157 | 151.2 Ų | 151.2 | 73% | 0.727 | 77% | 0.768 | S | S | * | * | trans | -60.7 | 123.7 | 163.1 | 159 | -80.3 | 0 | 0 | 0 | 109.7 | F10 D14 | F10-H12 PolarHBondContact O-N 3.3Å; H12-D14 PolarHBondContact O-N 2.77Å; H12-D14 VanDerWaalsContact O-N 3.11Å | ||
| 13 | W | 38.8 | Very low | 37.7 | Very low | 243 Ų | 243 | 149.2 Ų | 149.2 | 92% | 0.92 | 77% | 0.768 | S | S | * | * | trans | -66.9 | 108.3 | 174.5 | -78 | 90 | 0 | 0 | 0 | 110.2 | L11 R15 | L11-W13 PolarHBondContact O-N 3.04Å; W13-R15 PolarHBondContact O-N 3.1Å | ||
| 14 | D | 36.2 | Very low | 37.2 | Very low | 88 Ų | 88 | 145.3 Ų | 145.3 | 47% | 0.471 | 77% | 0.766 | S | S | . | * | trans | -67.8 | 123.2 | 177.7 | -162.4 | -18.1 | 0 | 0 | 0 | 110.9 | H12 N16 | H12-D14 PolarHBondContact O-N 2.77Å; H12-D14 VanDerWaalsContact O-N 3.11Å; D14-N16 VanDerWaalsContact C-N 3.31Å; D14-N16 WeakPolarHBondContact OD1-CB 3.32Å; D14-N16 PolarHBondContact OD1-N 3.45Å; D14-N16 PolarHBondContact OD1-ND2 3.26Å | ||
| 15 | R | 43 | Very low | 37.5 | Very low | 217 Ų | 217 | 146.6 Ų | 146.6 | 82% | 0.819 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | -9.7 | -179.3 | -177 | 63 | 76.3 | 153.9 | 5.2 | 112.4 | W13 | W13-R15 PolarHBondContact O-N 3.1Š|
| 16 | N | 38.8 | Very low | 37.7 | Very low | 117 Ų | 117 | 147.9 Ų | 147.9 | 63% | 0.626 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | 4.1 | -169.2 | -58.9 | -81.4 | 0 | 0 | 0 | 115.3 | D14 S18 | D14-N16 VanDerWaalsContact C-N 3.31Å; D14-N16 WeakPolarHBondContact OD1-CB 3.32Å; D14-N16 PolarHBondContact OD1-N 3.45Å; D14-N16 PolarHBondContact OD1-ND2 3.26Å; N16-S18 VanDerWaalsContact C-N 3.26Å; N16-S18 PolarHBondContact O-N 3.49Å |
| 17 | L | 37.7 | Very low | 37.9 | Very low | 146 Ų | 146 | 152.1 Ų | 152.1 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84 | 9.9 | 177.6 | -70.2 | 174.3 | 0 | 0 | 0 | 114.5 | ||
| 18 | S | 38.7 | Very low | 38.1 | Very low | 105 Ų | 105 | 155 Ų | 155 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | 3.2 | 179.3 | -60 | 0 | 0 | 0 | 0 | 115 | N16 | N16-S18 VanDerWaalsContact C-N 3.26Å; N16-S18 PolarHBondContact O-N 3.49Å |
| 19 | E | 38.3 | Very low | 38.7 | Very low | 171 Ų | 171 | 152 Ų | 152 | 80% | 0.799 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -110.4 | 17.1 | -177.9 | -64.2 | -167 | 154 | 0 | 0 | 114.3 | ||
| 20 | L | 39.1 | Very low | 39.2 | Very low | 171 Ų | 171 | 154.5 Ų | 154.5 | 90% | 0.895 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -121.4 | 50.3 | 174.8 | -73.1 | 177.2 | 0 | 0 | 0 | 113 | ||
| 21 | S | 35.9 | Very low | 39.5 | Very low | 104 Ų | 104 | 155.2 Ų | 155.2 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | trans | -152.6 | 61.2 | 163.1 | 68.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 22 | E | 36.6 | Very low | 39.7 | Very low | 193 Ų | 193 | 151.8 Ų | 151.8 | 90% | 0.902 | 78% | 0.775 | S | S | * | * | trans | -66.9 | 136.9 | 151.4 | -96.4 | -156.3 | 129.9 | 0 | 0 | 108.8 | G24 | E22-G24 PolarHBondContact O-N 3.18Š| ||
| 23 | P | 41.2 | Very low | 40.3 | Very low | 115 Ų | 115 | 150.1 Ų | 150.1 | 75% | 0.747 | 78% | 0.776 | S | S | * | * | trans | -74.3 | 120 | 176.8 | 29.9 | -32 | 0 | 0 | 0 | 109.8 | E25 | P23-E25 PolarHBondContact O-N 3.38Š| ||
| 24 | G | 33.1 | Very low | 40.5 | Very low | 71 Ų | 71 | 143.9 Ų | 143.9 | 73% | 0.732 | 76% | 0.757 | S | S | * | * | trans | -57.6 | 111.9 | 164.6 | 0 | 0 | 0 | 0 | 0 | 110 | E22 N26 | E22-G24 PolarHBondContact O-N 3.18Å; G24-N26 PolarHBondContact O-N 3.32Å | ||
| 25 | E | 44.7 | Very low | 40.9 | Very low | 187 Ų | 187 | 147.4 Ų | 147.4 | 87% | 0.874 | 77% | 0.769 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | 67.1 | -178.7 | 48.9 | 179.3 | 145.6 | 0 | 0 | 113.2 | P23 | P23-E25 PolarHBondContact O-N 3.38Š|
| 26 | N | 41.8 | Very low | 41.4 | Very low | 155 Ų | 155 | 141.3 Ų | 141.3 | 83% | 0.829 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -157.4 | -5.5 | 171.7 | -100.9 | -50.6 | 0 | 0 | 0 | 118.1 | G24 | G24-N26 PolarHBondContact O-N 3.32Š|
| 27 | E | 38.2 | Very low | 42 | Very low | 176 Ų | 176 | 139.9 Ų | 139.9 | 82% | 0.822 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -100.3 | -0.4 | 179.3 | -68.3 | -152.7 | 130.8 | 0 | 0 | 115.4 | V29 | E27-V29 PolarHBondContact O-N 3.27Å; E27-V29 VanDerWaalsContact O-N 3.1Å |
| 28 | H | 38.3 | Very low | 43 | Very low | 181 Ų | 181 | 138.2 Ų | 138.2 | 84% | 0.838 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | 5.9 | -171.7 | -134.5 | -66.9 | 0 | 0 | 0 | 115.7 | ||
| 29 | V | 46.5 | Very low | 43.9 | Very low | 125 Ų | 125 | 137.9 Ų | 137.9 | 76% | 0.758 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104 | -14.2 | -170.8 | -171.4 | 0 | 0 | 0 | 0 | 113.5 | E27 | E27-V29 PolarHBondContact O-N 3.27Å; E27-V29 VanDerWaalsContact O-N 3.1Å |
| 30 | L | 48.5 | Very low | 44.7 | Very low | 158 Ų | 158 | 134.1 Ų | 134.1 | 83% | 0.827 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -114.2 | 1.5 | -174 | -68.3 | 178 | 0 | 0 | 0 | 115.9 | ||
| 31 | Y | 43.7 | Very low | 45.3 | Very low | 221 Ų | 221 | 131 Ų | 131 | 87% | 0.867 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -118.1 | 19.7 | -178 | -105.5 | -78 | 0 | 0 | 0 | 115.1 | ||
| 32 | S | 42.6 | Very low | 46 | Very low | 86 Ų | 86 | 132.7 Ų | 132.7 | 60% | 0.601 | 69% | 0.693 | S | S | * | * | trans | -107.2 | 44.1 | 178.6 | -157.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 33 | T | 44.7 | Very low | 46.6 | Very low | 122 Ų | 122 | 126.7 Ų | 126.7 | 75% | 0.748 | 67% | 0.672 | S | S | * | * | trans | -103.4 | 117.8 | 159.6 | 49.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 34 | H | 43.3 | Very low | 47.1 | Very low | 113 Ų | 113 | 127.6 Ų | 127.6 | 52% | 0.523 | 67% | 0.667 | S | S | . | * | trans | -78.3 | 143.7 | -168.5 | -67.4 | -97.7 | 0 | 0 | 0 | 110.1 | T36 D37 | H34-T36 PolarHBondContact O-N 3.25Å; H34-D37 PolarHBondContact N-OD2 3.43Å; H34-D37 WeakPolarHBondContact O-CB 3.24Å; H34-D37 PolarHBondContact O-N 3.43Å | ||
| 35 | F | 43.6 | Very low | 47.7 | Very low | 161 Ų | 161 | 129.7 Ų | 129.7 | 71% | 0.706 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -54.9 | -24.1 | 174.4 | -178.8 | -103.1 | 0 | 0 | 0 | 112.7 | L39 | F35-L39 HydrophobicContact CD1-CD1 4.04Å; F35-L39 HydrophobicContact CE1-CD1 3.79Å; F35-L39 HydrophobicContact CE1-CG 4.4Å; F35-L39 PolarHBondContact O-N 3.48Å |
| 36 | T | 54.2 | Low | 48.3 | Very low | 90 Ų | 90 | 124.9 Ų | 124.9 | 55% | 0.552 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -61 | -43.6 | 170.8 | -42.7 | 0 | 0 | 0 | 0 | 113.1 | H34 L38 L39 D40 | H34-T36 PolarHBondContact O-N 3.25Å; T36-L38 VanDerWaalsContact C-N 3.28Å; T36-L38 PolarHBondContact O-N 3.09Å; T36-L39 PolarHBondContact O-N 3.29Å; T36-L39 VanDerWaalsContact O-N 3.08Å; T36-D40 PolarHBondContact O-N 3.37Å |
| 37 | D | 50.7 | Low | 48.9 | Very low | 86 Ų | 86 | 124.8 Ų | 124.8 | 46% | 0.46 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -64.7 | -36.7 | -177 | -52.4 | -42.1 | 0 | 0 | 0 | 110.7 | H34 L39 D40 D41 | H34-D37 PolarHBondContact N-OD2 3.43Å; H34-D37 WeakPolarHBondContact O-CB 3.24Å; H34-D37 PolarHBondContact O-N 3.43Å; D37-L39 VanDerWaalsContact C-N 3.3Å; D37-L39 PolarHBondContact O-N 3.35Å; D37-D40 PolarHBondContact O-N 3.32Å; D37-D41 PolarHBondContact O-N 3.47Å |
| 38 | L | 59.4 | Low | 49.6 | Very low | 111 Ų | 111 | 120.5 Ų | 120.5 | 58% | 0.581 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -69.5 | -27.7 | 176.8 | -156.4 | 76.6 | 0 | 0 | 0 | 112.4 | T36 F42 | T36-L38 VanDerWaalsContact C-N 3.28Å; T36-L38 PolarHBondContact O-N 3.09Å; L38-F42 WeakPolarHBondContact O-CD2 3.47Å |
| 39 | L | 58.2 | Low | 50.2 | Low | 98 Ų | 98 | 114.3 Ų | 114.3 | 51% | 0.513 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -78.1 | -33.5 | 174.2 | -70.7 | 171.9 | 0 | 0 | 0 | 111.9 | F35 T36 D37 F42 S43 | F35-L39 HydrophobicContact CD1-CD1 4.04Å; F35-L39 HydrophobicContact CE1-CD1 3.79Å; F35-L39 HydrophobicContact CE1-CG 4.4Å; F35-L39 PolarHBondContact O-N 3.48Å; T36-L39 PolarHBondContact O-N 3.29Å; T36-L39 VanDerWaalsContact O-N 3.08Å; D37-L39 VanDerWaalsContact C-N 3.3Å; D37-L39 PolarHBondContact O-N 3.35Å; L39-F42 PolarHBondContact O-N 3.15Å; L39-S43 PolarHBondContact O-N 3.2Å |
| 40 | D | 53.8 | Low | 50.6 | Low | 92 Ų | 92 | 116 Ų | 116 | 49% | 0.492 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -67.7 | -33.7 | 174.8 | -95.9 | 1.7 | 0 | 0 | 0 | 112.4 | T36 D37 F42 S43 Q44 | T36-D40 PolarHBondContact O-N 3.37Å; D37-D40 PolarHBondContact O-N 3.32Å; D40-F42 VanDerWaalsContact C-N 3.35Å; D40-F42 PolarHBondContact O-N 3.36Å; D40-S43 PolarHBondContact O-N 3.48Å; D40-S43 VanDerWaalsContact O-N 3.16Å; D40-S43 PolarHBondContact O-OG 3.33Å; D40-Q44 WeakPolarHBondContact O-CG 3.4Å; D40-Q44 PolarHBondContact O-N 3.46Å; D40-Q44 PolarHBondContact O-NE2 3.41Å |
| 41 | D | 52.9 | Low | 50.6 | Low | 105 Ų | 105 | 115.2 Ų | 115.2 | 56% | 0.561 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -64.1 | -37.8 | 171.3 | -94.9 | 4.2 | 0 | 0 | 0 | 112.2 | D37 S43 Q44 | D37-D41 PolarHBondContact O-N 3.47Å; D41-S43 VanDerWaalsContact C-N 3.3Å; D41-S43 PolarHBondContact O-N 3.27Å; D41-Q44 PolarHBondContact O-N 3.16Å; D41-Q44 PolarHBondContact OD1-NE2 3.29Å |
| 42 | F | 49.7 | Very low | 50.9 | Low | 140 Ų | 140 | 111 Ų | 111 | 61% | 0.614 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -73.1 | -17.9 | 172.7 | -86.5 | -79.7 | 0 | 0 | 0 | 113.8 | L38 L39 D40 | L38-F42 WeakPolarHBondContact O-CD2 3.47Å; L39-F42 PolarHBondContact O-N 3.15Å; D40-F42 VanDerWaalsContact C-N 3.35Å; D40-F42 PolarHBondContact O-N 3.36Å |
| 43 | S | 49.5 | Very low | 51.2 | Low | 67 Ų | 67 | 110.6 Ų | 110.6 | 47% | 0.469 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -83.7 | -29.4 | 175 | 88.8 | 0 | 0 | 0 | 0 | 112.4 | L39 D40 D41 | L39-S43 PolarHBondContact O-N 3.2Å; D40-S43 PolarHBondContact O-N 3.48Å; D40-S43 VanDerWaalsContact O-N 3.16Å; D40-S43 PolarHBondContact O-OG 3.33Å; D41-S43 VanDerWaalsContact C-N 3.3Å; D41-S43 PolarHBondContact O-N 3.27Å |
| 44 | Q | 50.8 | Low | 51.2 | Low | 135 Ų | 135 | 108.5 Ų | 108.5 | 63% | 0.631 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -72.2 | -28 | 177.5 | -74.8 | 169.1 | 81.8 | 0 | 0 | 113.4 | D40 D41 A46 | D40-Q44 WeakPolarHBondContact O-CG 3.4Å; D40-Q44 PolarHBondContact O-N 3.46Å; D40-Q44 PolarHBondContact O-NE2 3.41Å; D41-Q44 PolarHBondContact O-N 3.16Å; D41-Q44 PolarHBondContact OD1-NE2 3.29Å; Q44-A46 PolarHBondContact O-N 3.41Å; Q44-A46 VanDerWaalsContact O-N 3.07Å |
| 45 | D | 47.3 | Very low | 51.6 | Low | 115 Ų | 115 | 108.4 Ų | 108.4 | 62% | 0.615 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -67.6 | 105.4 | 167.6 | -99.4 | -19.4 | 0 | 0 | 0 | 109.5 | L47 | D45-L47 PolarHBondContact O-N 3.22Š|
| 46 | A | 56 | Low | 51.7 | Low | 85 Ų | 85 | 109.7 Ų | 109.7 | 70% | 0.702 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.4 | 20.8 | -164.1 | 0 | 0 | 0 | 0 | 0 | 117.3 | Q44 | Q44-A46 PolarHBondContact O-N 3.41Å; Q44-A46 VanDerWaalsContact O-N 3.07Å |
| 47 | L | 54 | Low | 51.3 | Low | 153 Ų | 153 | 112.1 Ų | 112.1 | 80% | 0.801 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | -25.1 | 175.8 | -73.4 | 165 | 0 | 0 | 0 | 113.3 | D45 | D45-L47 PolarHBondContact O-N 3.22Š|
| 48 | L | 53.4 | Low | 51.1 | Low | 87 Ų | 87 | 113.2 Ų | 113.2 | 46% | 0.455 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -84.6 | -34 | 179.5 | -96.5 | 158.5 | 0 | 0 | 0 | 113.5 | Q50 L51 L52 | L48-Q50 VanDerWaalsContact C-N 3.26Å; L48-Q50 PolarHBondContact O-N 3.04Å; L48-L51 PolarHBondContact O-N 2.86Å; L48-L51 VanDerWaalsContact O-N 3.09Å; L48-L52 PolarHBondContact O-N 2.98Å |
| 49 | G | 50.7 | Low | 50.2 | Low | 50 Ų | 50 | 111.4 Ų | 111.4 | 52% | 0.515 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -60.2 | -34.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | L51 S53 | G49-L51 VanDerWaalsContact C-N 3.29Å; G49-L51 PolarHBondContact O-N 2.8Å; G49-S53 PolarHBondContact O-N 2.98Å; G49-S53 PolarHBondContact O-OG 3.27Å |
| 50 | Q | 54.7 | Low | 49.6 | Very low | 161 Ų | 161 | 117.9 Ų | 117.9 | 75% | 0.752 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -73.2 | -19.1 | 178 | -157 | 76.1 | 29.4 | 0 | 0 | 113.3 | L48 S53 | L48-Q50 VanDerWaalsContact C-N 3.26Å; L48-Q50 PolarHBondContact O-N 3.04Å; Q50-S53 PolarHBondContact O-OG 2.75Å |
| 51 | L | 50.2 | Low | 48.9 | Very low | 141 Ų | 141 | 123.3 Ų | 123.3 | 74% | 0.738 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -89.6 | -26.6 | -179.5 | -167.7 | 68.9 | 0 | 0 | 0 | 112.3 | L48 G49 | L48-L51 PolarHBondContact O-N 2.86Å; L48-L51 VanDerWaalsContact O-N 3.09Å; G49-L51 VanDerWaalsContact C-N 3.29Å; G49-L51 PolarHBondContact O-N 2.8Å |
| 52 | L | 49.8 | Very low | 48.2 | Very low | 134 Ų | 134 | 122 Ų | 122 | 70% | 0.702 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -94 | -9.1 | -179.8 | -66.7 | 171.6 | 0 | 0 | 0 | 113.5 | L48 D54 | L48-L52 PolarHBondContact O-N 2.98Å; L52-D54 PolarHBondContact O-N 3.38Å |
| 53 | S | 48.6 | Very low | 47.4 | Very low | 76 Ų | 76 | 125.2 Ų | 125.2 | 53% | 0.531 | 70% | 0.702 | S | S | . | * | trans | -77.5 | 65.7 | 174.3 | 49.6 | 0 | 0 | 0 | 0 | 112.3 | G49 Q50 | G49-S53 PolarHBondContact O-N 2.98Å; G49-S53 PolarHBondContact O-OG 3.27Å; Q50-S53 PolarHBondContact O-OG 2.75Å | ||
| 54 | D | 44.2 | Very low | 46.9 | Very low | 79 Ų | 79 | 126.5 Ų | 126.5 | 42% | 0.422 | 72% | 0.717 | S | S | . | * | trans | -79.4 | 120.6 | 170 | -173.8 | -13.4 | 0 | 0 | 0 | 110.3 | L52 F56 L57 | L52-D54 PolarHBondContact O-N 3.38Å; D54-F56 PolarHBondContact O-N 3.28Å; D54-F56 WeakPolarHBondContact OD1-CD2 3.48Å; D54-F56 PolarHBondContact OD1-N 3.48Å; D54-L57 HydrophobicContact CB-CD1 4.46Å; D54-L57 PolarHBondContact O-N 2.75Å; D54-L57 VanDerWaalsContact O-N 3.17Å | ||
| 55 | P | 51.3 | Low | 46.5 | Very low | 110 Ų | 110 | 129 Ų | 129 | 71% | 0.714 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.9 | -21.7 | 178.3 | -26.9 | 35.7 | 0 | 0 | 0 | 115.2 | ||
| 56 | F | 46.6 | Very low | 45.9 | Very low | 188 Ų | 188 | 130.8 Ų | 130.8 | 83% | 0.825 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.4 | -10.2 | -178.3 | -68.1 | -76.3 | 0 | 0 | 0 | 114.9 | D54 | D54-F56 PolarHBondContact O-N 3.28Å; D54-F56 WeakPolarHBondContact OD1-CD2 3.48Å; D54-F56 PolarHBondContact OD1-N 3.48Å |
| 57 | L | 45.5 | Very low | 45 | Very low | 142 Ų | 142 | 135.6 Ų | 135.6 | 74% | 0.743 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | -13.9 | 179.7 | -62.9 | 178.6 | 0 | 0 | 0 | 114 | D54 G59 | D54-L57 HydrophobicContact CB-CD1 4.46Å; D54-L57 PolarHBondContact O-N 2.75Å; D54-L57 VanDerWaalsContact O-N 3.17Å; L57-G59 PolarHBondContact O-N 2.79Å |
| 58 | S | 45.7 | Very low | 44.3 | Very low | 109 Ų | 109 | 131.6 Ų | 131.6 | 76% | 0.762 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.9 | 2.7 | -179.1 | -175.8 | 0 | 0 | 0 | 0 | 114.9 | ||
| 59 | G | 41.5 | Very low | 43.6 | Very low | 73 Ų | 73 | 136.3 Ų | 136.3 | 75% | 0.753 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | 6.4 | -162.1 | 0 | 0 | 0 | 0 | 0 | 117.7 | L57 | L57-G59 PolarHBondContact O-N 2.79Š|
| 60 | R | 44.7 | Very low | 43.3 | Very low | 234 Ų | 234 | 141.2 Ų | 141.2 | 88% | 0.883 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -151.3 | 12.4 | -168 | -139.6 | -159.9 | 166.2 | -176.5 | -5.3 | 120.8 | ||
| 61 | E | 40.4 | Very low | 42.4 | Very low | 205 Ų | 205 | 143.7 Ų | 143.7 | 96% | 0.958 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -136.5 | 98.2 | 175.7 | -66.9 | -169.6 | -144.3 | 0 | 0 | 111.8 | ||
| 62 | G | 36.7 | Very low | 41.9 | Very low | 78 Ų | 78 | 143.4 Ų | 143.4 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | 147.8 | 61.2 | 167 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 63 | E | 33 | Very low | 41.6 | Very low | 207 Ų | 207 | 142.7 Ų | 142.7 | 97% | 0.967 | 80% | 0.795 | S | S | * | * | trans | -137.1 | 140.9 | 145.9 | -74.8 | -161.1 | 130 | 0 | 0 | 109.4 | ||||
| 64 | A | 40.6 | Very low | 40.9 | Very low | 94 Ų | 94 | 144.7 Ų | 144.7 | 78% | 0.777 | 81% | 0.809 | S | S | * | * | trans | -121.2 | 144.2 | -175.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 65 | M | 40.7 | Very low | 40.3 | Very low | 188 Ų | 188 | 146.7 Ų | 146.7 | 93% | 0.926 | 83% | 0.828 | S | S | * | * | trans | 64.5 | 98.2 | 159.4 | -155.7 | 96.6 | 171.1 | 0 | 0 | 116.8 | ||||
| 66 | D | 34.6 | Very low | 39.8 | Very low | 153 Ų | 153 | 147.3 Ų | 147.3 | 82% | 0.818 | 83% | 0.832 | S | S | * | * | -160.5 | 172.7 | 128 | -142.8 | -4.4 | 0 | 0 | 0 | 113.6 | |||||
| 67 | E | 37.5 | Very low | 39.8 | Very low | 185 Ų | 185 | 146.1 Ų | 146.1 | 86% | 0.864 | 83% | 0.834 | S | S | * | * | trans | -73.8 | 165.6 | -174.2 | -58.3 | 177.4 | 153.9 | 0 | 0 | 116 | ||||
| 68 | G | 39 | Very low | 40 | Very low | 69 Ų | 69 | 144.4 Ų | 144.4 | 71% | 0.711 | 83% | 0.831 | S | S | * | * | trans | 107.6 | 119.6 | 139.8 | 0 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 69 | E | 39.5 | Very low | 40 | Very low | 187 Ų | 187 | 145.3 Ų | 145.3 | 87% | 0.874 | 83% | 0.834 | S | S | * | * | trans | 48.7 | 112.4 | 143.6 | -58.5 | -169.7 | 140.2 | 0 | 0 | 122.6 | ||||
| 70 | D | 45.1 | Very low | 40.1 | Very low | 152 Ų | 152 | 149.6 Ų | 149.6 | 81% | 0.813 | 84% | 0.835 | S | S | * | * | trans | 27 | 99.4 | 135.9 | -67.1 | -24.5 | 0 | 0 | 0 | 121 | ||||
| 71 | F | 34.2 | Very low | 40.2 | Very low | 214 Ų | 214 | 145.8 Ų | 145.8 | 94% | 0.939 | 83% | 0.83 | S | S | * | * | trans | -145.4 | 118.6 | 143.9 | -87.4 | -74.4 | 0 | 0 | 0 | 112.7 | ||||
| 72 | T | 41.6 | Very low | 40.3 | Very low | 134 Ų | 134 | 142.3 Ų | 142.3 | 82% | 0.822 | 81% | 0.814 | S | S | * | * | trans | -110.9 | 147.5 | 168.2 | 56.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 73 | P | 42.4 | Very low | 41.2 | Very low | 120 Ų | 120 | 143.4 Ų | 143.4 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | -149.6 | 134.3 | 114.4 | 32.7 | -13.9 | 0 | 0 | 0 | 117.5 | |||||
| 74 | S | 33.9 | Very low | 42.1 | Very low | 118 Ų | 118 | 139.7 Ų | 139.7 | 83% | 0.825 | 80% | 0.798 | S | S | * | * | trans | 58.1 | 97.2 | 138.6 | -59.3 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 75 | S | 32.4 | Very low | 42.3 | Very low | 120 Ų | 120 | 143 Ų | 143 | 84% | 0.839 | 80% | 0.797 | S | S | * | * | trans | -158.5 | 163.5 | 130.2 | -110.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 76 | P | 40.8 | Very low | 42.6 | Very low | 123 Ų | 123 | 139.7 Ų | 139.7 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 146.9 | -140.1 | 29.8 | -37.2 | 0 | 0 | 0 | 116.5 | ||
| 77 | L | 45.6 | Very low | 43.3 | Very low | 163 Ų | 163 | 142.4 Ų | 142.4 | 85% | 0.853 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -73 | 148.2 | 174.4 | -118 | 74.4 | 0 | 0 | 0 | 112.4 | ||
| 78 | P | 49.3 | Very low | 44 | Very low | 106 Ų | 106 | 138.8 Ų | 138.8 | 69% | 0.688 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 151.3 | 167.1 | -17.5 | 31.5 | 0 | 0 | 0 | 111.9 | H80 | P78-H80 PolarHBondContact O-N 2.9Š|
| 79 | P | 47.2 | Very low | 44.2 | Very low | 128 Ų | 128 | 144.3 Ų | 144.3 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 129.8 | -178.4 | 25 | -33.5 | 0 | 0 | 0 | 112.5 | I81 | P79-I81 PolarHBondContact O-N 3.36Š|
| 80 | H | 43.7 | Very low | 44.5 | Very low | 163 Ų | 163 | 141 Ų | 141 | 76% | 0.755 | 80% | 0.796 | S | S | * | * | trans | -70.2 | 113.4 | 179.5 | 179.4 | 68.9 | 0 | 0 | 0 | 111.1 | P78 Q82 | P78-H80 PolarHBondContact O-N 2.9Å; H80-Q82 PolarHBondContact O-N 2.9Å | ||
| 81 | I | 46.6 | Very low | 44.1 | Very low | 154 Ų | 154 | 137 Ų | 137 | 79% | 0.79 | 79% | 0.791 | S | S | * | * | trans | -79.2 | 107.4 | 171.6 | -62 | 174.7 | 0 | 0 | 0 | 108.1 | P79 A83 | P79-I81 PolarHBondContact O-N 3.36Å; I81-A83 PolarHBondContact O-N 3.02Å | ||
| 82 | Q | 41.8 | Very low | 44.8 | Very low | 133 Ų | 133 | 133.9 Ų | 133.9 | 62% | 0.621 | 78% | 0.784 | S | S | * | * | trans | -68.7 | 107.2 | 175.3 | -73.5 | 174.6 | -87.4 | 0 | 0 | 110.5 | H80 E84 | H80-Q82 PolarHBondContact O-N 2.9Å; Q82-E84 HydrophobicContact CB-CG 4.23Å; Q82-E84 WeakPolarHBondContact CB-OE1 3.37Å; Q82-E84 PolarHBondContact NE2-OE1 3.17Å; Q82-E84 PolarHBondContact O-N 3.33Å; Q82-E84 VanDerWaalsContact O-N 3.13Å | ||
| 83 | A | 55 | Low | 44.8 | Very low | 101 Ų | 101 | 132.8 Ų | 132.8 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | trans | -86.2 | 49.2 | 180 | 0 | 0 | 0 | 0 | 0 | 112.5 | I81 | I81-A83 PolarHBondContact O-N 3.02Š| ||
| 84 | E | 52.1 | Low | 45.1 | Very low | 129 Ų | 129 | 137.6 Ų | 137.6 | 60% | 0.603 | 79% | 0.785 | S | S | * | * | trans | -110.2 | 46.2 | -172.7 | 64.6 | -167.2 | 116.4 | 0 | 0 | 114.4 | Q82 | Q82-E84 HydrophobicContact CB-CG 4.23Å; Q82-E84 WeakPolarHBondContact CB-OE1 3.37Å; Q82-E84 PolarHBondContact NE2-OE1 3.17Å; Q82-E84 PolarHBondContact O-N 3.33Å; Q82-E84 VanDerWaalsContact O-N 3.13Å | ||
| 85 | H | 45.8 | Very low | 45.7 | Very low | 163 Ų | 163 | 138.2 Ų | 138.2 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | trans | -123.5 | 64.8 | 167.2 | -69.4 | -17.1 | 0 | 0 | 0 | 111.5 | Y87 | H85-Y87 PolarHBondContact O-N 3.45Å; H85-Y87 VanDerWaalsContact O-N 3.11Å | ||
| 86 | S | 46.8 | Very low | 46.1 | Very low | 118 Ų | 118 | 141.4 Ų | 141.4 | 83% | 0.825 | 79% | 0.787 | S | S | * | * | trans | -67.8 | 99.8 | 166.3 | -62.7 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 87 | Y | 48.5 | Very low | 46 | Very low | 211 Ų | 211 | 140.7 Ų | 140.7 | 83% | 0.827 | 79% | 0.786 | S | S | * | * | trans | -96.2 | 117.8 | 162.6 | -80.9 | -84 | 0 | 0 | 0 | 109.8 | H85 L89 | H85-Y87 PolarHBondContact O-N 3.45Å; H85-Y87 VanDerWaalsContact O-N 3.11Å; Y87-L89 PolarHBondContact O-N 3.19Å | ||
| 88 | S | 52.8 | Low | 45.7 | Very low | 108 Ų | 108 | 139.2 Ų | 139.2 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | trans | -61.8 | 131.2 | -178.1 | -57 | 0 | 0 | 0 | 0 | 112.4 | C90 | S88-C90 PolarHBondContact O-N 3.02Š| ||
| 89 | L | 43.6 | Very low | 45 | Very low | 186 Ų | 186 | 139.7 Ų | 139.7 | 97% | 0.974 | 79% | 0.787 | S | S | * | * | trans | -66.7 | 96.8 | 164.6 | -84.5 | 154.4 | 0 | 0 | 0 | 109.8 | Y87 | Y87-L89 PolarHBondContact O-N 3.19Š| ||
| 90 | C | 44.5 | Very low | 44.5 | Very low | 116 Ų | 116 | 139.2 Ų | 139.2 | 78% | 0.784 | 79% | 0.786 | S | S | * | * | trans | -100.1 | 114.7 | 165.9 | -78.3 | 0 | 0 | 0 | 0 | 110.5 | S88 | S88-C90 PolarHBondContact O-N 3.02Š| ||
| 91 | G | 37.8 | Very low | 44.1 | Very low | 70 Ų | 70 | 139.4 Ų | 139.4 | 72% | 0.722 | 79% | 0.787 | S | S | * | * | trans | 58.5 | 105.8 | 141 | 0 | 0 | 0 | 0 | 0 | 118.7 | S93 | G91-S93 PolarHBondContact O-N 3.16Š| ||
| 92 | D | 49.1 | Very low | 43.6 | Very low | 147 Ų | 147 | 139.8 Ų | 139.8 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | trans | -40.1 | 131.3 | 151.6 | 177.4 | 22.3 | 0 | 0 | 0 | 112.3 | ||||
| 93 | S | 41.4 | Very low | 43.8 | Very low | 111 Ų | 111 | 139.1 Ų | 139.1 | 78% | 0.776 | 80% | 0.797 | S | S | * | * | trans | -160.3 | 86.5 | 169.8 | -78.9 | 0 | 0 | 0 | 0 | 110.4 | G91 | G91-S93 PolarHBondContact O-N 3.16Š| ||
| 94 | R | 49.4 | Very low | 42.8 | Very low | 222 Ų | 222 | 138 Ų | 138 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | trans | -56.4 | 135.4 | 163.6 | -74.7 | 174.6 | 166.5 | 170.7 | -4.2 | 110.6 | Q96 | R94-Q96 PolarHBondContact O-N 3.5Å; R94-Q96 VanDerWaalsContact O-N 3.16Å | ||
| 95 | P | 44.7 | Very low | 41.9 | Very low | 130 Ų | 130 | 140.7 Ų | 140.7 | 84% | 0.844 | 81% | 0.808 | S | S | * | * | trans | -73.2 | 106.3 | 168.7 | 28.9 | -32.1 | 0 | 0 | 0 | 110.6 | ||||
| 96 | Q | 42.1 | Very low | 41.4 | Very low | 187 Ų | 187 | 142.2 Ų | 142.2 | 87% | 0.874 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 144.2 | 162.5 | -85.3 | -178.3 | -47.7 | 0 | 0 | 110.4 | R94 | R94-Q96 PolarHBondContact O-N 3.5Å; R94-Q96 VanDerWaalsContact O-N 3.16Å |
| 97 | S | 37.3 | Very low | 40.7 | Very low | 109 Ų | 109 | 139.7 Ų | 139.7 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 146 | 173.7 | -62.1 | 0 | 0 | 0 | 0 | 111.7 | V99 | S97-V99 PolarHBondContact O-N 2.96Š|
| 98 | P | 40.8 | Very low | 39.9 | Very low | 132 Ų | 132 | 135.6 Ų | 135.6 | 86% | 0.857 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 121.1 | -178.6 | 28.9 | -31 | 0 | 0 | 0 | 111.3 | ||
| 99 | V | 34 | Very low | 39.1 | Very low | 116 Ų | 116 | 138.3 Ų | 138.3 | 70% | 0.703 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -90.8 | 128.2 | 169.8 | -170.2 | 0 | 0 | 0 | 0 | 108.7 | S97 H101 | S97-V99 PolarHBondContact O-N 2.96Å; V99-H101 PolarHBondContact O-N 3.06Å |
| 100 | S | 36.8 | Very low | 38.8 | Very low | 118 Ų | 118 | 134.2 Ų | 134.2 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -74.5 | 115.4 | 177.1 | -58.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 101 | H | 35.4 | Very low | 38.4 | Very low | 167 Ų | 167 | 138 Ų | 138 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | trans | -108.4 | 118.9 | 166.5 | -73.1 | -82.3 | 0 | 0 | 0 | 110.3 | V99 | V99-H101 PolarHBondContact O-N 3.06Š| ||
| 102 | L | 36.3 | Very low | 38.4 | Very low | 161 Ų | 161 | 140 Ų | 140 | 84% | 0.843 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 151.6 | 160.6 | -66 | 172.3 | 0 | 0 | 0 | 108.7 | ||
| 103 | P | 46 | Very low | 37.7 | Very low | 119 Ų | 119 | 140.1 Ų | 140.1 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 140.5 | 178.5 | 30.1 | -34.3 | 0 | 0 | 0 | 110.6 | ||
| 104 | G | 33.2 | Very low | 37.4 | Very low | 77 Ų | 77 | 137.8 Ų | 137.8 | 79% | 0.794 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -92 | 145.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 105 | E | 33.4 | Very low | 36.6 | Very low | 186 Ų | 186 | 135.6 Ų | 135.6 | 87% | 0.869 | 81% | 0.812 | S | S | * | * | trans | -131 | 122.7 | 172.5 | -57.4 | -165.9 | 168.5 | 0 | 0 | 110 | ||||
| 106 | Q | 34.7 | Very low | 35.9 | Very low | 196 Ų | 196 | 135.8 Ų | 135.8 | 92% | 0.916 | 81% | 0.805 | S | S | * | * | trans | 15.8 | 120.9 | 160.1 | -130.5 | 74.3 | 21.1 | 0 | 0 | 121.8 | ||||
| 107 | G | 32.5 | Very low | 35.3 | Very low | 65 Ų | 65 | 136.9 Ų | 136.9 | 67% | 0.67 | 80% | 0.802 | S | S | * | * | 114.4 | 142.6 | 114.2 | 0 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 108 | S | 31.6 | Very low | 34.8 | Very low | 124 Ų | 124 | 136.7 Ų | 136.7 | 87% | 0.867 | 80% | 0.801 | S | S | * | * | trans | 74.5 | 141.4 | 155.1 | 53.2 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 109 | D | 36.3 | Very low | 34.2 | Very low | 165 Ų | 165 | 137 Ų | 137 | 88% | 0.882 | 79% | 0.794 | S | S | * | * | trans | -76.9 | 151.7 | -178 | -41.4 | -96.1 | 0 | 0 | 0 | 113.9 | ||||
| 110 | A | 37.1 | Very low | 34 | Very low | 101 Ų | 101 | 139.5 Ų | 139.5 | 84% | 0.835 | 80% | 0.798 | S | S | * | * | trans | -163.5 | 136.8 | 149.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 111 | E | 37.1 | Very low | 33.6 | Very low | 196 Ų | 196 | 142.3 Ų | 142.3 | 92% | 0.916 | 80% | 0.798 | S | S | * | * | trans | -80.2 | -170.5 | 163.5 | -60.5 | -179.5 | 108.9 | 0 | 0 | 111.2 | ||||
| 112 | S | 37.8 | Very low | 33.4 | Very low | 110 Ų | 110 | 142.1 Ų | 142.1 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | trans | 94 | 100.3 | -179.8 | -156.6 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 113 | D | 33.9 | Very low | 33.1 | Very low | 150 Ų | 150 | 141.9 Ų | 141.9 | 80% | 0.802 | 79% | 0.792 | S | S | * | * | 76.1 | 130 | 64.1 | -163.4 | 25.8 | 0 | 0 | 0 | 112.5 | |||||
| 114 | G | 34.8 | Very low | 32.1 | Very low | 63 Ų | 63 | 143.6 Ų | 143.6 | 65% | 0.649 | 79% | 0.79 | S | S | * | * | trans | 148.1 | 70.5 | -167.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 115 | E | 32.2 | Very low | 31.9 | Very low | 176 Ų | 176 | 147.5 Ų | 147.5 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | 30.4 | 128.9 | 122.9 | -43.7 | 177.9 | 170.4 | 0 | 0 | 116.7 | |||||
| 116 | D | 30.1 | Very low | 31.7 | Very low | 133 Ų | 133 | 145.6 Ų | 145.6 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | -171.2 | 173.9 | 52.6 | -156.6 | 40.9 | 0 | 0 | 0 | 112.6 | |||||
| 117 | W | 29.4 | Very low | 31.3 | Very low | 210 Ų | 210 | 143 Ų | 143 | 80% | 0.795 | 78% | 0.778 | S | S | * | * | trans | -45.6 | 153.9 | -169.1 | -51 | 93.4 | 0 | 0 | 0 | 118.5 | ||||
| 118 | S | 27.2 | Very low | 31.4 | Very low | 106 Ų | 106 | 147 Ų | 147 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | 52.7 | 147.4 | 54.9 | -52.1 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 119 | L | 28.5 | Very low | 31.3 | Very low | 137 Ų | 137 | 149 Ų | 149 | 72% | 0.717 | 78% | 0.783 | S | S | * | * | cis | -157.7 | 155.3 | -1.9 | -176.4 | 75.7 | 0 | 0 | 0 | 105.3 | ||||
| 120 | E | 29.9 | Very low | 31.1 | Very low | 170 Ų | 170 | 147.4 Ų | 147.4 | 79% | 0.794 | 78% | 0.783 | S | S | * | * | trans | 50.5 | 130.9 | 158.5 | -78.6 | 161.3 | 176.2 | 0 | 0 | 121.5 | ||||
| 121 | Q | 28.6 | Very low | 30.8 | Very low | 177 Ų | 177 | 150.1 Ų | 150.1 | 83% | 0.827 | 78% | 0.784 | S | S | * | * | 171.5 | 156.7 | 104.8 | -169.4 | 156.3 | 20.3 | 0 | 0 | 111.8 | |||||
| 122 | E | 30.1 | Very low | 31 | Very low | 162 Ų | 162 | 145.9 Ų | 145.9 | 76% | 0.757 | 77% | 0.773 | S | S | * | * | trans | -54.1 | 158.5 | 170.5 | -57.4 | 144.5 | 124.8 | 0 | 0 | 111.8 | ||||
| 123 | E | 30.1 | Very low | 31.4 | Very low | 156 Ų | 156 | 146.7 Ų | 146.7 | 73% | 0.729 | 78% | 0.776 | S | S | * | * | -176 | 167.8 | 59.8 | -140.9 | -175.4 | 154.6 | 0 | 0 | 112.6 | |||||
| 124 | Q | 26.3 | Very low | 31.2 | Very low | 156 Ų | 156 | 144.1 Ų | 144.1 | 73% | 0.729 | 78% | 0.776 | S | S | * | * | trans | 51.7 | 117.9 | 152.7 | -80.7 | 164.7 | 28.9 | 0 | 0 | 123 | ||||
| 125 | M | 29.3 | Very low | 31.1 | Very low | 158 Ų | 158 | 149.1 Ų | 149.1 | 78% | 0.778 | 79% | 0.786 | S | S | * | * | -151.6 | 91.8 | 127.1 | -168.2 | 90.1 | -86.9 | 0 | 0 | 111.9 | |||||
| 126 | E | 28.3 | Very low | 31.4 | Very low | 147 Ų | 147 | 148.8 Ų | 148.8 | 69% | 0.687 | 79% | 0.789 | S | S | * | * | trans | 26.4 | 109 | 140.6 | -130.3 | 171.3 | 176.2 | 0 | 0 | 120 | ||||
| 127 | V | 27.3 | Very low | 31.7 | Very low | 142 Ų | 142 | 148.2 Ų | 148.2 | 86% | 0.861 | 79% | 0.793 | S | S | * | * | trans | -103.3 | 111.2 | 161.3 | 173.7 | 0 | 0 | 0 | 0 | 108.6 | L129 | V127-L129 PolarHBondContact O-N 3.07Š| ||
| 128 | L | 33.3 | Very low | 31.5 | Very low | 147 Ų | 147 | 143.9 Ų | 143.9 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | trans | -73.7 | 124.6 | -179.4 | -80.9 | 165.8 | 0 | 0 | 0 | 112.4 | ||||
| 129 | L | 31 | Very low | 31.6 | Very low | 168 Ų | 168 | 147.2 Ų | 147.2 | 88% | 0.88 | 80% | 0.799 | S | S | * | * | trans | -71.8 | 139.7 | 167.2 | -78.9 | 149.2 | 0 | 0 | 0 | 111 | V127 | V127-L129 PolarHBondContact O-N 3.07Š| ||
| 130 | C | 30.7 | Very low | 31.6 | Very low | 130 Ų | 130 | 146.6 Ų | 146.6 | 88% | 0.878 | 80% | 0.801 | S | S | * | * | trans | -129.4 | 121.3 | 162.6 | -93.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 131 | D | 31 | Very low | 31.5 | Very low | 159 Ų | 159 | 146.8 Ų | 146.8 | 85% | 0.85 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 139.5 | -172.2 | -145.2 | 3.1 | 0 | 0 | 0 | 111.7 | ||
| 132 | P | 42 | Very low | 31.5 | Very low | 106 Ų | 106 | 143.4 Ų | 143.4 | 69% | 0.688 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -100.5 | 126.8 | 171 | 34.3 | -27.5 | 0 | 0 | 0 | 112.1 | ||
| 133 | P | 45.3 | Very low | 31.4 | Very low | 128 Ų | 128 | 143.3 Ų | 143.3 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 130.3 | 179.9 | 29.6 | -34 | 0 | 0 | 0 | 112.4 | ||
| 134 | A | 30.7 | Very low | 31.6 | Very low | 96 Ų | 96 | 140 Ų | 140 | 79% | 0.793 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -82 | 131.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 135 | L | 32.9 | Very low | 32.6 | Very low | 167 Ų | 167 | 138 Ų | 138 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | trans | -146.6 | 101.3 | 164.6 | -73.8 | 179.8 | 0 | 0 | 0 | 110.5 | ||||
| 136 | L | 37.1 | Very low | 32.6 | Very low | 169 Ų | 169 | 139.2 Ų | 139.2 | 89% | 0.885 | 81% | 0.809 | S | S | * | * | trans | -141.6 | 142.1 | 161.4 | -73.2 | 180 | 0 | 0 | 0 | 109.4 | ||||
| 137 | P | 36.3 | Very low | 32.7 | Very low | 122 Ų | 122 | 135.5 Ų | 135.5 | 79% | 0.792 | 81% | 0.81 | S | S | * | * | trans | -87.7 | 140.8 | -175.7 | 33.8 | -34.1 | 0 | 0 | 0 | 113.4 | ||||
| 138 | T | 25.8 | Very low | 32.8 | Very low | 119 Ų | 119 | 137 Ų | 137 | 73% | 0.73 | 81% | 0.808 | S | S | * | * | trans | -72.3 | 134.7 | 174.4 | -52.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 139 | L | 29.8 | Very low | 32.8 | Very low | 176 Ų | 176 | 136.9 Ų | 136.9 | 92% | 0.921 | 81% | 0.806 | S | S | * | * | trans | -114.2 | 123.9 | 155.3 | -71.2 | 179.6 | 0 | 0 | 0 | 108.9 | ||||
| 140 | T | 28.6 | Very low | 32.7 | Very low | 123 Ų | 123 | 134.6 Ų | 134.6 | 76% | 0.755 | 80% | 0.8 | S | S | * | * | trans | -99.8 | 130.1 | -176.1 | -49.2 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 141 | L | 27.3 | Very low | 32.6 | Very low | 175 Ų | 175 | 137.2 Ų | 137.2 | 92% | 0.916 | 80% | 0.799 | S | S | * | * | trans | -138.8 | 112.8 | 167.7 | -124.4 | 155 | 0 | 0 | 0 | 108.1 | ||||
| 142 | S | 28.2 | Very low | 32.7 | Very low | 105 Ų | 105 | 133.5 Ų | 133.5 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | -108.9 | 147.9 | -174.8 | 179.4 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 143 | L | 27.7 | Very low | 32.8 | Very low | 160 Ų | 160 | 134.8 Ų | 134.8 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | trans | -146.1 | 126.7 | 175.6 | -149.8 | 81.7 | 0 | 0 | 0 | 113.2 | ||||
| 144 | A | 34.5 | Very low | 32.1 | Very low | 86 Ų | 86 | 133 Ų | 133 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | trans | 70.6 | 161 | 157.3 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 145 | P | 47.9 | Very low | 33.4 | Very low | 114 Ų | 114 | 134 Ų | 134 | 74% | 0.74 | 79% | 0.793 | S | S | * | * | cis | -142.6 | -173.7 | 16.1 | 46 | -27.5 | 0 | 0 | 0 | 118.8 | ||||
| 146 | E | 29.4 | Very low | 34.2 | Very low | 185 Ų | 185 | 131.9 Ų | 131.9 | 86% | 0.864 | 79% | 0.789 | S | S | * | * | trans | 76 | 135.3 | 156.7 | -67.9 | -82.6 | 96.6 | 0 | 0 | 121.2 | ||||
| 147 | G | 29.3 | Very low | 34.2 | Very low | 68 Ų | 68 | 128.3 Ų | 128.3 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | trans | 156.5 | 52.6 | 164.8 | 0 | 0 | 0 | 0 | 0 | 123.7 | ||||
| 148 | H | 30.9 | Very low | 34.7 | Very low | 175 Ų | 175 | 128.7 Ų | 128.7 | 81% | 0.81 | 79% | 0.786 | S | S | * | * | trans | 58 | 138.9 | 139.4 | -101.5 | -96.3 | 0 | 0 | 0 | 126 | ||||
| 149 | I | 32 | Very low | 35.1 | Very low | 143 Ų | 143 | 132.5 Ų | 132.5 | 73% | 0.733 | 79% | 0.793 | S | S | * | * | trans | 96.3 | 106 | 144.9 | -62.9 | 160.8 | 0 | 0 | 0 | 121.9 | ||||
| 150 | T | 30 | Very low | 35.8 | Very low | 121 Ų | 121 | 130.3 Ų | 130.3 | 74% | 0.742 | 79% | 0.789 | S | S | * | * | 48.5 | 123.7 | 129.3 | -43.5 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 151 | E | 28.2 | Very low | 35.8 | Very low | 185 Ų | 185 | 131.6 Ų | 131.6 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | 174.3 | 155.9 | 98.8 | -158.8 | 162.6 | 159.5 | 0 | 0 | 112.2 | |||||
| 152 | A | 32.3 | Very low | 36.7 | Very low | 81 Ų | 81 | 127.1 Ų | 127.1 | 67% | 0.669 | 77% | 0.773 | S | S | * | * | trans | -126 | 158 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 153 | P | 44.1 | Very low | 36.8 | Very low | 132 Ų | 132 | 130.1 Ų | 130.1 | 86% | 0.857 | 78% | 0.775 | S | S | * | * | -151.9 | 173.8 | 93.6 | 37 | -17.6 | 0 | 0 | 0 | 116.6 | |||||
| 154 | A | 31.5 | Very low | 36.9 | Very low | 90 Ų | 90 | 128.7 Ų | 128.7 | 74% | 0.744 | 77% | 0.773 | S | S | * | * | trans | -118.2 | -162.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 155 | P | 58.8 | Low | 36.6 | Very low | 118 Ų | 118 | 128.6 Ų | 128.6 | 77% | 0.766 | 77% | 0.772 | S | S | * | * | cis | -120.3 | -145.5 | -25.2 | 40.4 | -20 | 0 | 0 | 0 | 109.3 | ||||
| 156 | P | 48.7 | Very low | 35.7 | Very low | 123 Ų | 123 | 129.4 Ų | 129.4 | 80% | 0.799 | 78% | 0.775 | S | S | * | * | cis | -143.8 | 177.8 | 48.7 | 39.7 | -17.6 | 0 | 0 | 0 | 117.2 | ||||
| 157 | A | 36.3 | Very low | 35.6 | Very low | 93 Ų | 93 | 129.9 Ų | 129.9 | 77% | 0.769 | 78% | 0.778 | S | S | * | * | trans | -133.5 | 160.9 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 158 | P | 47.2 | Very low | 35.5 | Very low | 130 Ų | 130 | 130 Ų | 130 | 84% | 0.844 | 78% | 0.778 | S | S | * | * | -145.1 | 176.2 | 125.6 | 29.6 | -9.1 | 0 | 0 | 0 | 116.9 | |||||
| 159 | K | 35.3 | Very low | 35.4 | Very low | 200 Ų | 200 | 131.5 Ų | 131.5 | 87% | 0.87 | 78% | 0.782 | S | S | * | * | trans | -87.2 | -172.3 | -168.6 | -59.4 | 176.1 | 176.4 | 174.5 | 0 | 112.2 | ||||
| 160 | P | 44.8 | Very low | 35.3 | Very low | 130 Ų | 130 | 129.2 Ų | 129.2 | 84% | 0.844 | 79% | 0.785 | S | S | * | * | cis | -148.5 | -168.1 | 19 | 43 | -18.2 | 0 | 0 | 0 | 120.5 | ||||
| 161 | N | 28.7 | Very low | 35.2 | Very low | 149 Ų | 149 | 129.1 Ų | 129.1 | 80% | 0.797 | 79% | 0.789 | S | S | * | * | trans | -77.7 | -167.3 | -173 | -142.2 | 19.8 | 0 | 0 | 0 | 113.8 | ||||
| 162 | P | 45.3 | Very low | 35.4 | Very low | 82 Ų | 82 | 129.9 Ų | 129.9 | 53% | 0.532 | 79% | 0.79 | S | S | . | * | cis | -147.3 | 173.3 | 3.6 | 43.9 | -22.8 | 0 | 0 | 0 | 121.2 | ||||
| 163 | Q | 31.1 | Very low | 35.3 | Very low | 168 Ų | 168 | 130 Ų | 130 | 79% | 0.785 | 79% | 0.791 | S | S | * | * | trans | 68.3 | 162.7 | 147.8 | -72.1 | 156.8 | -36.8 | 0 | 0 | 120.6 | ||||
| 164 | T | 29.3 | Very low | 34.5 | Very low | 130 Ų | 130 | 132.4 Ų | 132.4 | 80% | 0.798 | 79% | 0.788 | S | S | * | * | cis | -161.6 | 153.7 | -4.3 | 6.7 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 165 | A | 28.4 | Very low | 34.4 | Very low | 83 Ų | 83 | 134.9 Ų | 134.9 | 69% | 0.686 | 78% | 0.784 | S | S | * | * | trans | 57.4 | 126.1 | 139.2 | 0 | 0 | 0 | 0 | 0 | 128.5 | ||||
| 166 | T | 28.4 | Very low | 33.1 | Very low | 132 Ų | 132 | 137.1 Ų | 137.1 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | trans | 74.8 | 132.3 | 132 | 50.6 | 0 | 0 | 0 | 0 | 128.6 | ||||
| 167 | Q | 27.9 | Very low | 32.2 | Very low | 195 Ų | 195 | 134.7 Ų | 134.7 | 91% | 0.911 | 79% | 0.785 | S | S | * | * | trans | 67.1 | 127.9 | 145.4 | -70.5 | -163.8 | 22.7 | 0 | 0 | 125.5 | ||||
| 168 | G | 27.5 | Very low | 31.9 | Very low | 69 Ų | 69 | 139.7 Ų | 139.7 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | 109.6 | 114.4 | 103.9 | 0 | 0 | 0 | 0 | 0 | 123.9 | |||||
| 169 | K | 28.5 | Very low | 31.1 | Very low | 207 Ų | 207 | 140.6 Ų | 140.6 | 90% | 0.9 | 79% | 0.789 | S | S | * | * | trans | 68.8 | 112 | 142.5 | -69.2 | -177.7 | 176.3 | 177.3 | 0 | 124.5 | ||||
| 170 | A | 28.6 | Very low | 30.8 | Very low | 95 Ų | 95 | 140.6 Ų | 140.6 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | 51.2 | 154.1 | 108.9 | 0 | 0 | 0 | 0 | 0 | 125.4 | |||||
| 171 | S | 29.3 | Very low | 30.5 | Very low | 119 Ų | 119 | 141.4 Ų | 141.4 | 83% | 0.832 | 79% | 0.788 | S | S | * | * | trans | 120 | 155.5 | 161.8 | 70.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 172 | K | 31.1 | Very low | 30.6 | Very low | 201 Ų | 201 | 144.2 Ų | 144.2 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | cis | -164.4 | 171.5 | -7.1 | -120 | -169 | 171.1 | -175.5 | 0 | 105.8 | ||||
| 173 | A | 30.5 | Very low | 30.4 | Very low | 85 Ų | 85 | 147.5 Ų | 147.5 | 70% | 0.702 | 81% | 0.805 | S | S | * | * | cis | -175.9 | 144.7 | -37.6 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 174 | K | 28.3 | Very low | 30.6 | Very low | 182 Ų | 182 | 148.3 Ų | 148.3 | 79% | 0.791 | 81% | 0.809 | S | S | * | * | trans | -165.3 | 143.8 | 168.4 | -149.8 | 170.5 | -174.6 | 179.9 | 0 | 111.2 | ||||
| 175 | E | 28 | Very low | 31.2 | Very low | 142 Ų | 142 | 146.8 Ų | 146.8 | 66% | 0.664 | 80% | 0.801 | S | S | * | * | cis | -166.4 | 135.4 | -28 | -175.5 | 159.8 | -88.5 | 0 | 0 | 110.4 | ||||
| 176 | I | 32.7 | Very low | 32 | Very low | 165 Ų | 165 | 150.2 Ų | 150.2 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | 29.3 | 124.4 | 159.7 | -51.1 | 167.1 | 0 | 0 | 0 | 120.8 | ||||
| 177 | G | 29.3 | Very low | 32.7 | Very low | 71 Ų | 71 | 152.5 Ų | 152.5 | 73% | 0.732 | 80% | 0.804 | S | S | * | * | trans | -157.4 | 137.7 | 157.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 178 | E | 28.9 | Very low | 33.4 | Very low | 199 Ų | 199 | 148.2 Ų | 148.2 | 93% | 0.93 | 79% | 0.791 | S | S | * | * | trans | -63.8 | 169.3 | -158.2 | -64.4 | 170.9 | 132.9 | 0 | 0 | 118.9 | ||||
| 179 | I | 31.8 | Very low | 34.1 | Very low | 149 Ų | 149 | 152.4 Ų | 152.4 | 76% | 0.764 | 80% | 0.797 | S | S | * | * | trans | -103.7 | 139.8 | -173.5 | -59.5 | 165.1 | 0 | 0 | 0 | 111.1 | I181 | I179-I181 HydrophobicContact CG2-CG1 4.48Š| ||
| 180 | Q | 28.4 | Very low | 34.7 | Very low | 200 Ų | 200 | 151.4 Ų | 151.4 | 94% | 0.935 | 80% | 0.795 | S | S | * | * | trans | -150.7 | 127.1 | 145 | -115.6 | 174.2 | 32.2 | 0 | 0 | 111.9 | ||||
| 181 | I | 37.6 | Very low | 35.2 | Very low | 147 Ų | 147 | 156 Ų | 156 | 75% | 0.754 | 80% | 0.798 | S | S | * | * | trans | -107.9 | 133 | 174.8 | -63.5 | 169 | 0 | 0 | 0 | 107.5 | I179 | I179-I181 HydrophobicContact CG2-CG1 4.48Š| ||
| 182 | K | 32 | Very low | 35.7 | Very low | 207 Ų | 207 | 157.8 Ų | 157.8 | 90% | 0.9 | 80% | 0.797 | S | S | * | * | trans | -136.7 | 128.2 | 166.2 | -165.5 | 168.4 | -177.9 | -179.8 | 0 | 109.6 | ||||
| 183 | L | 41.2 | Very low | 35.8 | Very low | 151 Ų | 151 | 155.2 Ų | 155.2 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | -101.1 | 171.4 | 176.4 | -77.8 | 162.3 | 0 | 0 | 0 | 110.3 | ||||
| 184 | E | 34.6 | Very low | 36 | Very low | 186 Ų | 186 | 159.4 Ų | 159.4 | 87% | 0.869 | 80% | 0.803 | S | S | * | * | trans | 73.9 | 154.2 | 176.8 | -83.7 | -159.5 | 113.1 | 0 | 0 | 118.9 | ||||
| 185 | P | 42.8 | Very low | 36.1 | Very low | 97 Ų | 97 | 156.1 Ų | 156.1 | 63% | 0.63 | 80% | 0.803 | S | S | * | * | cis | -132.3 | -174.5 | -19.1 | 32.2 | -11.8 | 0 | 0 | 0 | 114.1 | ||||
| 186 | H | 45.8 | Very low | 36.9 | Very low | 156 Ų | 156 | 154.4 Ų | 154.4 | 72% | 0.722 | 80% | 0.804 | S | S | * | * | trans | -84.8 | 123.4 | 173.4 | 170.8 | 82.8 | 0 | 0 | 0 | 110.8 | V188 | H186-V188 WeakPolarHBondContact NE2-CG2 3.29Š| ||
| 187 | E | 41.4 | Very low | 37 | Very low | 179 Ų | 179 | 157 Ų | 157 | 84% | 0.836 | 81% | 0.809 | S | S | * | * | trans | -126.2 | 102 | 169.3 | -75.2 | -171.8 | 172.7 | 0 | 0 | 111 | ||||
| 188 | V | 42.5 | Very low | 37.2 | Very low | 106 Ų | 106 | 157.4 Ų | 157.4 | 64% | 0.642 | 81% | 0.813 | S | S | * | * | trans | -98.9 | 82.5 | 162.6 | -76.8 | 0 | 0 | 0 | 0 | 108.7 | H186 | H186-V188 WeakPolarHBondContact NE2-CG2 3.29Š| ||
| 189 | D | 42.3 | Very low | 37.7 | Very low | 157 Ų | 157 | 156.3 Ų | 156.3 | 84% | 0.84 | 81% | 0.813 | S | S | * | * | trans | -173.2 | 70.6 | 161.3 | -103.3 | -25.9 | 0 | 0 | 0 | 112.6 | ||||
| 190 | Q | 41.2 | Very low | 38 | Very low | 185 Ų | 185 | 158.3 Ų | 158.3 | 86% | 0.864 | 82% | 0.819 | S | S | * | * | trans | -133.1 | 30.4 | 162.9 | -155.1 | 166.9 | 100.2 | 0 | 0 | 112.7 | ||||
| 191 | F | 39.4 | Very low | 38.5 | Very low | 191 Ų | 191 | 154.1 Ų | 154.1 | 84% | 0.838 | 81% | 0.812 | S | S | * | * | trans | -120.5 | 85.6 | 167.3 | -63.9 | -81.2 | 0 | 0 | 0 | 108.6 | ||||
| 192 | L | 39.4 | Very low | 38.5 | Very low | 157 Ų | 157 | 155.6 Ų | 155.6 | 82% | 0.822 | 82% | 0.82 | S | S | * | * | S | Bend | trans | 166.1 | 135.4 | 148.5 | -90 | 158.7 | 0 | 0 | 0 | 110.8 | ||
| 193 | N | 32.7 | Very low | 39.1 | Very low | 148 Ų | 148 | 154.5 Ų | 154.5 | 79% | 0.791 | 82% | 0.818 | S | S | * | * | trans | 74.1 | 129.1 | -178.8 | -47.8 | -77.9 | 0 | 0 | 0 | 114.2 | ||||
| 194 | L | 34.7 | Very low | 39.4 | Very low | 173 Ų | 173 | 154.8 Ų | 154.8 | 91% | 0.906 | 82% | 0.817 | S | S | * | * | cis | -129.8 | 159.9 | 33.3 | -69.6 | 163.3 | 0 | 0 | 0 | 114.7 | ||||
| 195 | S | 30.4 | Very low | 39.9 | Very low | 112 Ų | 112 | 150.8 Ų | 150.8 | 78% | 0.783 | 81% | 0.808 | S | S | * | * | trans | -94.1 | -171.7 | 178.8 | -150.1 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 196 | P | 45.6 | Very low | 40.3 | Very low | 106 Ų | 106 | 152.2 Ų | 152.2 | 69% | 0.688 | 82% | 0.817 | S | S | * | * | -113.1 | 154.3 | -112.9 | 34 | -16.6 | 0 | 0 | 0 | 114.4 | |||||
| 197 | K | 35.8 | Very low | 40.2 | Very low | 220 Ų | 220 | 151.1 Ų | 151.1 | 96% | 0.957 | 82% | 0.821 | S | S | * | * | trans | -173.2 | 133.7 | 160.2 | -100 | 137.9 | -171.9 | 178.8 | 0 | 111.2 | ||||
| 198 | G | 32.2 | Very low | 40.6 | Very low | 79 Ų | 79 | 148 Ų | 148 | 81% | 0.814 | 82% | 0.817 | S | S | * | * | trans | 130.3 | 102.4 | 166.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 199 | L | 40 | Very low | 41 | Very low | 176 Ų | 176 | 148.7 Ų | 148.7 | 92% | 0.921 | 82% | 0.823 | S | S | * | * | trans | -65.3 | 131.1 | 164.8 | -79.7 | 146.6 | 0 | 0 | 0 | 110.1 | ||||
| 200 | E | 37.2 | Very low | 40.6 | Very low | 192 Ų | 192 | 146.9 Ų | 146.9 | 90% | 0.897 | 82% | 0.823 | S | S | * | * | -164.8 | 129 | 118.7 | -108.6 | -179.7 | 172.7 | 0 | 0 | 110.7 | |||||
| 201 | S | 39.1 | Very low | 40.5 | Very low | 111 Ų | 111 | 143.8 Ų | 143.8 | 78% | 0.776 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 119 | -179.4 | 52.5 | 0 | 0 | 0 | 0 | 110.8 | Q203 | S201-Q203 PolarHBondContact O-N 3.41Å; S201-Q203 VanDerWaalsContact O-N 3.16Å |
| 202 | L | 38.5 | Very low | 40.5 | Very low | 178 Ų | 178 | 143 Ų | 143 | 93% | 0.932 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -59 | 118.2 | 170.9 | -76.2 | 165.9 | 0 | 0 | 0 | 110.2 | ||
| 203 | Q | 43.4 | Very low | 40.4 | Very low | 184 Ų | 184 | 138.3 Ų | 138.3 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -86.7 | 119.4 | -168 | -176.4 | 169 | -11.4 | 0 | 0 | 111.8 | S201 | S201-Q203 PolarHBondContact O-N 3.41Å; S201-Q203 VanDerWaalsContact O-N 3.16Å |
| 204 | M | 49 | Very low | 41.1 | Very low | 157 Ų | 157 | 136.3 Ų | 136.3 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 151.1 | 172 | -74.2 | -69 | -74.8 | 0 | 0 | 111.8 | ||
| 205 | P | 44.8 | Very low | 41.5 | Very low | 103 Ų | 103 | 135.7 Ų | 135.7 | 67% | 0.669 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 144.8 | 179 | 27.5 | -35.2 | 0 | 0 | 0 | 112.1 | T207 | P205-T207 PolarHBondContact O-N 2.88Š|
| 206 | P | 51 | Low | 42.3 | Very low | 127 Ų | 127 | 135.9 Ų | 135.9 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -71.2 | 126.6 | -177.4 | 28.1 | -34.3 | 0 | 0 | 0 | 112.2 | ||
| 207 | T | 43.9 | Very low | 42.4 | Very low | 132 Ų | 132 | 140.5 Ų | 140.5 | 81% | 0.81 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -71 | 144.4 | 169.2 | 27.7 | 0 | 0 | 0 | 0 | 111.8 | P205 | P205-T207 PolarHBondContact O-N 2.88Š|
| 208 | P | 49.1 | Very low | 42.6 | Very low | 114 Ų | 114 | 133.6 Ų | 133.6 | 74% | 0.74 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 145.1 | 176.9 | 30.5 | -34.6 | 0 | 0 | 0 | 111.8 | ||
| 209 | P | 52.1 | Low | 43.1 | Very low | 121 Ų | 121 | 135 Ų | 135 | 79% | 0.786 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 133.3 | 179.4 | 28.9 | -34 | 0 | 0 | 0 | 112.4 | ||
| 210 | S | 33.3 | Very low | 43 | Very low | 118 Ų | 118 | 135 Ų | 135 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -75.9 | 134.8 | 173.2 | -172.3 | 0 | 0 | 0 | 0 | 111.2 | H212 | S210-H212 PolarHBondContact O-N 3.37Š|
| 211 | S | 38.6 | Very low | 42.9 | Very low | 120 Ų | 120 | 130.9 Ų | 130.9 | 84% | 0.839 | 80% | 0.795 | S | S | * | * | trans | -91.5 | 96 | 174.7 | -39.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 212 | H | 40.3 | Very low | 43.5 | Very low | 175 Ų | 175 | 131.3 Ų | 131.3 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | -94.4 | 98.8 | 167.1 | -159.3 | 34.4 | 0 | 0 | 0 | 109.1 | S210 | S210-H212 PolarHBondContact O-N 3.37Š| ||
| 213 | G | 36.6 | Very low | 43.4 | Very low | 58 Ų | 58 | 128.4 Ų | 128.4 | 60% | 0.598 | 78% | 0.784 | S | S | * | * | trans | -71.5 | 124.7 | 167.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 214 | S | 46.9 | Very low | 43 | Very low | 107 Ų | 107 | 128.3 Ų | 128.3 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | -116.7 | 98.4 | 175 | -165.8 | 0 | 0 | 0 | 0 | 107.8 | S216 | S214-S216 PolarHBondContact O-N 2.98Š| ||
| 215 | D | 43.1 | Very low | 42.2 | Very low | 159 Ų | 159 | 124.6 Ų | 124.6 | 85% | 0.85 | 78% | 0.778 | S | S | * | * | trans | -86.3 | 108.6 | -176.6 | -54.2 | -35.3 | 0 | 0 | 0 | 108.8 | ||||
| 216 | S | 47.5 | Very low | 41.7 | Very low | 116 Ų | 116 | 125 Ų | 125 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | trans | -109.1 | 113.1 | 175.7 | -165.5 | 0 | 0 | 0 | 0 | 109.7 | S214 G218 | S214-S216 PolarHBondContact O-N 2.98Å; S216-G218 PolarHBondContact O-N 2.89Å; S216-G218 VanDerWaalsContact O-N 3.08Å | ||
| 217 | E | 47.2 | Very low | 41.1 | Very low | 204 Ų | 204 | 125.2 Ų | 125.2 | 95% | 0.953 | 78% | 0.782 | S | S | * | * | trans | -73.6 | 98.6 | 179.8 | -67.9 | -159.4 | 116.2 | 0 | 0 | 111.1 | ||||
| 218 | G | 40.3 | Very low | 41.7 | Very low | 74 Ų | 74 | 124.3 Ų | 124.3 | 76% | 0.763 | 78% | 0.779 | S | S | * | * | trans | -111 | 100.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S216 | S216-G218 PolarHBondContact O-N 2.89Å; S216-G218 VanDerWaalsContact O-N 3.08Å | ||
| 219 | S | 44.1 | Very low | 40.9 | Very low | 109 Ų | 109 | 128.1 Ų | 128.1 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | -67 | 139.2 | 177.9 | 53.6 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 220 | Q | 37.1 | Very low | 39.8 | Very low | 177 Ų | 177 | 127.7 Ų | 127.7 | 83% | 0.827 | 79% | 0.786 | S | S | * | * | 172.2 | 143.9 | 128.9 | -87.6 | -53.8 | -16.2 | 0 | 0 | 110.7 | |||||
| 221 | S | 34.2 | Very low | 40.9 | Very low | 105 Ų | 105 | 127.5 Ų | 127.5 | 73% | 0.734 | 78% | 0.782 | S | S | * | * | trans | -107 | 179.2 | 164.2 | -76.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 222 | P | 53.1 | Low | 40.5 | Very low | 119 Ų | 119 | 127.7 Ų | 127.7 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | cis | -145.1 | -163.9 | 17.3 | 28.9 | -0.8 | 0 | 0 | 0 | 116.6 | ||||
| 223 | V | 36.5 | Very low | 40.2 | Very low | 117 Ų | 117 | 125.6 Ų | 125.6 | 71% | 0.709 | 78% | 0.783 | S | S | * | * | trans | 107.5 | 107.8 | 149.1 | -177 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 224 | H | 35.5 | Very low | 40.6 | Very low | 182 Ų | 182 | 128.4 Ų | 128.4 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | trans | 40.8 | 148 | 136.3 | -65.5 | -96.2 | 0 | 0 | 0 | 121.8 | ||||
| 225 | A | 32.3 | Very low | 39.8 | Very low | 80 Ų | 80 | 129 Ų | 129 | 66% | 0.661 | 80% | 0.795 | S | S | * | * | cis | -162 | 169.9 | 10.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 226 | S | 33.1 | Very low | 39.3 | Very low | 110 Ų | 110 | 127 Ų | 127 | 77% | 0.769 | 79% | 0.793 | S | S | * | * | trans | 48.1 | 141.7 | 144.3 | -59.9 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 227 | T | 39.4 | Very low | 39.6 | Very low | 133 Ų | 133 | 127 Ų | 127 | 82% | 0.816 | 79% | 0.791 | S | S | * | * | cis | -167.1 | 174.4 | 12.2 | 9.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 228 | P | 55.7 | Low | 38.8 | Very low | 113 Ų | 113 | 125.3 Ų | 125.3 | 73% | 0.734 | 79% | 0.788 | S | S | * | * | trans | -114.9 | 170.3 | -157.3 | 42.7 | -36.9 | 0 | 0 | 0 | 117.6 | ||||
| 229 | Q | 31.3 | Very low | 38.5 | Very low | 194 Ų | 194 | 126.9 Ų | 126.9 | 91% | 0.907 | 79% | 0.787 | S | S | * | * | trans | -168.8 | 155 | 139.7 | -112.6 | 170 | 6.5 | 0 | 0 | 115.2 | ||||
| 230 | S | 29.9 | Very low | 38.8 | Very low | 111 Ų | 111 | 127.8 Ų | 127.8 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -125.2 | -163.2 | 175.6 | -32.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 231 | P | 57.1 | Low | 38.6 | Very low | 115 Ų | 115 | 123.7 Ų | 123.7 | 75% | 0.747 | 79% | 0.786 | S | S | * | * | cis | -123 | -174.1 | -49.9 | 37.3 | -21.9 | 0 | 0 | 0 | 111.4 | ||||
| 232 | S | 29.2 | Very low | 39.3 | Very low | 123 Ų | 123 | 124 Ų | 124 | 86% | 0.86 | 79% | 0.786 | S | S | * | * | trans | 178.6 | 140.2 | 140 | -82 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 233 | T | 33.8 | Very low | 38.3 | Very low | 132 Ų | 132 | 123.1 Ų | 123.1 | 81% | 0.81 | 78% | 0.782 | S | S | * | * | trans | -111 | 165.1 | 162.8 | 58.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 234 | P | 45 | Very low | 38.3 | Very low | 117 Ų | 117 | 126.2 Ų | 126.2 | 76% | 0.76 | 79% | 0.789 | S | S | * | * | -156.3 | 153.6 | 87.5 | 38.4 | -17.5 | 0 | 0 | 0 | 119 | |||||
| 235 | S | 30.2 | Very low | 38.1 | Very low | 120 Ų | 120 | 122.4 Ų | 122.4 | 84% | 0.839 | 79% | 0.789 | S | S | * | * | trans | 36.3 | 141.2 | 138.2 | -51.8 | 0 | 0 | 0 | 0 | 126.9 | ||||
| 236 | S | 32.2 | Very low | 38.1 | Very low | 115 Ų | 115 | 121.6 Ų | 121.6 | 80% | 0.804 | 79% | 0.788 | S | S | * | * | trans | -53.1 | -169.6 | 169.8 | -32.4 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 237 | P | 54.5 | Low | 38.1 | Very low | 118 Ų | 118 | 123.7 Ų | 123.7 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | cis | -143 | -173.7 | 5.9 | 43.8 | -23.7 | 0 | 0 | 0 | 117.8 | ||||
| 238 | L | 30.7 | Very low | 37.9 | Very low | 168 Ų | 168 | 125.8 Ų | 125.8 | 88% | 0.88 | 79% | 0.788 | S | S | * | * | 150.5 | 144.1 | 127.3 | -160 | 66.5 | 0 | 0 | 0 | 113.9 | |||||
| 239 | S | 34.3 | Very low | 37 | Very low | 106 Ų | 106 | 127.5 Ų | 127.5 | 74% | 0.741 | 80% | 0.796 | S | S | * | * | trans | -106.9 | 171.1 | 176.9 | -41.1 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 240 | P | 49.2 | Very low | 37.1 | Very low | 129 Ų | 129 | 123.8 Ų | 123.8 | 84% | 0.838 | 79% | 0.791 | S | S | * | * | -149.3 | -177.7 | 69.9 | 37 | -14.6 | 0 | 0 | 0 | 116.7 | |||||
| 241 | A | 32.7 | Very low | 37.3 | Very low | 90 Ų | 90 | 127.1 Ų | 127.1 | 74% | 0.744 | 80% | 0.795 | S | S | * | * | trans | -96.4 | -179.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 242 | P | 48.7 | Very low | 36.3 | Very low | 112 Ų | 112 | 132.8 Ų | 132.8 | 73% | 0.727 | 80% | 0.801 | S | S | * | * | -157.7 | 175.8 | 78.8 | 40.4 | -19.4 | 0 | 0 | 0 | 119.1 | |||||
| 243 | S | 32.7 | Very low | 36.9 | Very low | 100 Ų | 100 | 133 Ų | 133 | 70% | 0.699 | 80% | 0.798 | S | S | * | * | trans | 66.7 | 147.6 | 148.7 | 56.8 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 244 | Q | 37.3 | Very low | 37.1 | Very low | 183 Ų | 183 | 133 Ų | 133 | 86% | 0.855 | 80% | 0.799 | S | S | * | * | cis | -164.4 | 155.8 | -10.7 | -116.3 | -164.1 | 90.5 | 0 | 0 | 110.9 | ||||
| 245 | A | 31.3 | Very low | 36.7 | Very low | 101 Ų | 101 | 132.9 Ų | 132.9 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | 54.5 | 148.9 | 157.8 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 246 | G | 31.1 | Very low | 37.3 | Very low | 63 Ų | 63 | 132.3 Ų | 132.3 | 65% | 0.649 | 80% | 0.798 | S | S | * | * | cis | 159.6 | 153.6 | -9.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 247 | L | 34 | Very low | 37.7 | Very low | 155 Ų | 155 | 135 Ų | 135 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | trans | 71 | 142.3 | 160.9 | -50.3 | 176.4 | 0 | 0 | 0 | 117.1 | ||||
| 248 | K | 34.8 | Very low | 37 | Very low | 177 Ų | 177 | 135 Ų | 135 | 77% | 0.77 | 81% | 0.805 | S | S | * | * | cis | -155.1 | 143.6 | -18.2 | -76.9 | 142.9 | -162.4 | -68.1 | 0 | 105.8 | ||||
| 249 | V | 36.5 | Very low | 37.5 | Very low | 148 Ų | 148 | 134.1 Ų | 134.1 | 90% | 0.897 | 80% | 0.801 | S | S | * | * | trans | -131.1 | 135.7 | 160 | 170.8 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 250 | S | 33.7 | Very low | 37.5 | Very low | 116 Ų | 116 | 133.8 Ų | 133.8 | 81% | 0.811 | 80% | 0.799 | S | S | * | * | trans | -82.2 | 146.5 | -171.5 | -163.7 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 251 | Q | 34.6 | Very low | 37.2 | Very low | 181 Ų | 181 | 133.8 Ų | 133.8 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | trans | -85.8 | 137.8 | 178.3 | -59.3 | 169.8 | -41.7 | 0 | 0 | 111.1 | ||||
| 252 | R | 35.6 | Very low | 37.9 | Very low | 235 Ų | 235 | 136.5 Ų | 136.5 | 89% | 0.887 | 80% | 0.8 | S | S | * | * | trans | -148.4 | 112.1 | 144.2 | -82.4 | -159.5 | -77.3 | -175.9 | -1.5 | 111.6 | ||||
| 253 | T | 42 | Very low | 37.9 | Very low | 127 Ų | 127 | 138.6 Ų | 138.6 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | trans | 30.6 | 127.6 | 148.4 | 57.8 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 254 | P | 38.2 | Very low | 38.6 | Very low | 131 Ų | 131 | 140.4 Ų | 140.4 | 85% | 0.851 | 81% | 0.811 | S | S | * | * | -105.2 | 156.9 | 117.6 | 31.7 | -34.3 | 0 | 0 | 0 | 112.3 | |||||
| 255 | S | 36.8 | Very low | 38.3 | Very low | 116 Ų | 116 | 136 Ų | 136 | 81% | 0.811 | 81% | 0.806 | S | S | * | * | trans | -62.2 | 145 | -171.4 | 35.1 | 0 | 0 | 0 | 0 | 115.1 | L257 | S255-L257 PolarHBondContact O-N 3.3Š| ||
| 256 | S | 42.3 | Very low | 39 | Very low | 107 Ų | 107 | 137.3 Ų | 137.3 | 75% | 0.748 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -52 | 129.2 | 169.4 | -175.2 | 0 | 0 | 0 | 0 | 112.2 | ||
| 257 | L | 40.6 | Very low | 39.5 | Very low | 171 Ų | 171 | 141.8 Ų | 141.8 | 90% | 0.895 | 81% | 0.81 | S | S | * | * | trans | -177.5 | -4.7 | 148.9 | -100.8 | -177.6 | 0 | 0 | 0 | 113.2 | S255 | S255-L257 PolarHBondContact O-N 3.3Š| ||
| 258 | S | 40.1 | Very low | 39.7 | Very low | 118 Ų | 118 | 142.5 Ų | 142.5 | 83% | 0.825 | 81% | 0.806 | S | S | * | * | trans | -100.1 | 39.5 | -177.7 | -172.7 | 0 | 0 | 0 | 0 | 115 | ||||
| 259 | N | 40.2 | Very low | 40.4 | Very low | 151 Ų | 151 | 141.9 Ų | 141.9 | 81% | 0.807 | 81% | 0.811 | S | S | * | * | trans | -103.5 | 72.1 | 172.9 | -78.4 | -12.3 | 0 | 0 | 0 | 111.6 | ||||
| 260 | S | 36 | Very low | 41 | Very low | 99 Ų | 99 | 143.8 Ų | 143.8 | 69% | 0.692 | 81% | 0.81 | S | S | * | * | trans | -115 | 96.2 | 162.1 | -78.5 | 0 | 0 | 0 | 0 | 109 | L262 | S260-L262 PolarHBondContact O-N 3.36Š| ||
| 261 | P | 41.5 | Very low | 41 | Very low | 128 Ų | 128 | 141.1 Ų | 141.1 | 83% | 0.831 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.3 | 30.7 | -169.2 | 34.2 | -37.7 | 0 | 0 | 0 | 113.9 | ||
| 262 | L | 48.7 | Very low | 41.6 | Very low | 148 Ų | 148 | 138 Ų | 138 | 78% | 0.775 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.4 | -1.9 | -169.6 | -81.8 | 168.5 | 0 | 0 | 0 | 115.4 | S260 | S260-L262 PolarHBondContact O-N 3.36Š|
| 263 | L | 47.6 | Very low | 42.1 | Very low | 156 Ų | 156 | 128.2 Ų | 128.2 | 82% | 0.817 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -108.9 | 7.1 | -174.4 | -62.6 | -176.1 | 0 | 0 | 0 | 115.8 | ||
| 264 | T | 47.6 | Very low | 42.2 | Very low | 138 Ų | 138 | 127 Ų | 127 | 85% | 0.847 | 76% | 0.764 | S | S | * | * | trans | -135.6 | 79.1 | 178.7 | -48.2 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 265 | A | 31.5 | Very low | 42.8 | Very low | 89 Ų | 89 | 123.2 Ų | 123.2 | 74% | 0.736 | 74% | 0.737 | S | S | * | * | trans | -154.3 | 98.3 | 164.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | H267 | A265-H267 VanDerWaalsContact C-N 3.33Å; A265-H267 PolarHBondContact O-N 3.38Å | ||
| 266 | P | 45.6 | Very low | 43.3 | Very low | 129 Ų | 129 | 125.4 Ų | 125.4 | 84% | 0.838 | 74% | 0.736 | S | S | * | * | trans | -91 | 54.1 | 178.5 | 37 | -35 | 0 | 0 | 0 | 112.1 | ||||
| 267 | H | 41.8 | Very low | 43.9 | Very low | 158 Ų | 158 | 121.5 Ų | 121.5 | 73% | 0.731 | 71% | 0.707 | S | S | * | * | trans | -159 | 157.5 | 170.5 | -146.2 | -136.7 | 0 | 0 | 0 | 113.4 | A265 | A265-H267 VanDerWaalsContact C-N 3.33Å; A265-H267 PolarHBondContact O-N 3.38Å | ||
| 268 | K | 38.2 | Very low | 44.9 | Very low | 170 Ų | 170 | 117.9 Ų | 117.9 | 74% | 0.739 | 69% | 0.692 | S | S | * | * | trans | 80.3 | 56.3 | 177.5 | -51.4 | -62.4 | -172.8 | 175.7 | 0 | 117.6 | Q270 | K268-Q270 PolarHBondContact O-N 2.85Š| ||
| 269 | L | 48.9 | Very low | 45.9 | Very low | 164 Ų | 164 | 115.9 Ų | 115.9 | 86% | 0.859 | 67% | 0.67 | S | S | * | * | trans | -70.7 | 73.9 | 148.2 | -77.1 | 173.5 | 0 | 0 | 0 | 110.5 | ||||
| 270 | Q | 48.6 | Very low | 46.7 | Very low | 188 Ų | 188 | 113.3 Ų | 113.3 | 88% | 0.879 | 65% | 0.653 | S | S | * | * | trans | -156.4 | 81.3 | 167.1 | -152.9 | 163.2 | 4.2 | 0 | 0 | 111.4 | K268 | K268-Q270 PolarHBondContact O-N 2.85Š| ||
| 271 | G | 34.3 | Very low | 48.1 | Very low | 59 Ų | 59 | 109.6 Ų | 109.6 | 61% | 0.608 | 62% | 0.624 | S | S | * | * | trans | 177.2 | 122.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | G273 | G271-G273 PolarHBondContact O-N 3.44Å; G271-G273 VanDerWaalsContact O-N 3.15Å | ||
| 272 | S | 46.6 | Very low | 49.2 | Very low | 117 Ų | 117 | 108.6 Ų | 108.6 | 82% | 0.818 | 60% | 0.604 | S | S | * | * | trans | -69.7 | 104.4 | 166.6 | 178.1 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 273 | G | 47.5 | Very low | 50 | Low | 28 Ų | 28 | 109.3 Ų | 109.3 | 29% | 0.289 | 60% | 0.597 | S | S | . | * | trans | -147.1 | 156.6 | 178 | 0 | 0 | 0 | 0 | 0 | 111 | G271 | G271-G273 PolarHBondContact O-N 3.44Å; G271-G273 VanDerWaalsContact O-N 3.15Å | ||
| 274 | P | 44.6 | Very low | 50.8 | Low | 101 Ų | 101 | 103.5 Ų | 103.5 | 66% | 0.656 | 57% | 0.568 | S | S | * | * | trans | -60.7 | 136.8 | 176.8 | -21.4 | 33.4 | 0 | 0 | 0 | 111.3 | M276 | P274-M276 PolarHBondContact O-N 3.45Š| ||
| 275 | L | 50.3 | Low | 51.8 | Low | 52 Ų | 52 | 97.1 Ų | 97.1 | 27% | 0.272 | 53% | 0.528 | S | S | . | . | trans | -70.5 | 113.8 | 173.2 | -162.7 | 76.7 | 0 | 0 | 0 | 108.7 | L277 L296 L298 L306 | L275-L277 HydrophobicContact CD2-CD1 4.21Å; L275-L277 HydrophobicContact CD2-CD2 4.04Å; L275-L277 HydrophobicContact CD2-CG 3.89Å; L275-L277 HydrophobicContact CG-CG 4.4Å; L275-L277 PolarHBondContact O-N 3.49Å; L275-L296 HydrophobicContact CD1-CD2 4.18Å; L275-L298 HydrophobicContact CB-CD1 4.48Å; L275-L298 HydrophobicContact CD1-CD1 3.92Å; L275-L298 HydrophobicContact CD2-CD1 3.61Å; L275-L298 HydrophobicContact CD2-CD2 3.93Å; L275-L298 HydrophobicContact CD2-CG 4.4Å; L275-L298 HydrophobicContact CG-CD1 4.2Å; L275-L306 HydrophobicContact CD2-CD2 4.32Å | ||
| 276 | M | 46.3 | Very low | 53.4 | Low | 162 Ų | 162 | 96.9 Ų | 96.9 | 80% | 0.798 | 52% | 0.518 | S | S | * | . | trans | -72.2 | 76.9 | 174.4 | -68.7 | -64.6 | -68.2 | 0 | 0 | 110.2 | P274 | P274-M276 PolarHBondContact O-N 3.45Š| ||
| 277 | L | 55.6 | Low | 54.7 | Low | 26 Ų | 26 | 95 Ų | 95 | 14% | 0.136 | 51% | 0.513 | C | S | . | . | trans | -74.5 | 129.6 | 161.9 | -70.8 | 167.9 | 0 | 0 | 0 | 108.3 | L275 E281 V292 L306 | L275-L277 HydrophobicContact CD2-CD1 4.21Å; L275-L277 HydrophobicContact CD2-CD2 4.04Å; L275-L277 HydrophobicContact CD2-CG 3.89Å; L275-L277 HydrophobicContact CG-CG 4.4Å; L275-L277 PolarHBondContact O-N 3.49Å; L277-E281 HydrophobicContact CB-CB 4.36Å; L277-E281 HydrophobicContact CD2-CB 4.1Å; L277-V292 HydrophobicContact CD1-CG1 4.38Å; L277-L306 HydrophobicContact CD2-CD1 3.43Å; L277-L306 VanDerWaalsContact CD2-CD1 3.43Å; L277-L306 HydrophobicContact CD2-CD2 3.79Å; L277-L306 HydrophobicContact CD2-CG 4.27Å | ||
| 278 | T | 62.1 | Low | 55.8 | Low | 95 Ų | 95 | 91.3 Ų | 91.3 | 58% | 0.583 | 50% | 0.496 | S | S | * | . | trans | -60.9 | 147.2 | 170.9 | -27.7 | 0 | 0 | 0 | 0 | 108.8 | E280 E281 R282 | T278-E280 PolarHBondContact O-N 3.4Å; T278-E281 PolarHBondContact N-OE2 2.97Å; T278-E281 WeakPolarHBondContact O-CA 3.41Å; T278-E281 WeakPolarHBondContact O-CB 3.4Å; T278-E281 PolarHBondContact O-N 3.49Å; T278-E281 PolarHBondContact OG1-OE2 2.9Å; T278-R282 PolarHBondContact O-N 3.49Å | ||
| 279 | E | 59.5 | Low | 56.7 | Low | 76 Ų | 76 | 86.4 Ų | 86.4 | 36% | 0.355 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -55.4 | -31.5 | -175.1 | 175.2 | 60.7 | -175 | 0 | 0 | 113 | R282 R283 | E279-R282 VanDerWaalsContact CD-NH2 3.31Å; E279-R282 PolarHBondContact O-N 3.36Å; E279-R282 IonicContact OE1-CZ 2.86Å; E279-R282 IonicContact OE1-NH2 2.63Å; E279-R282 PolarHBondContact OE1-NH2 3.05Å; E279-R282 IonicContact OE2-CZ 3.25Å; E279-R282 VanDerWaalsContact OE2-CZ 3.27Å; E279-R282 IonicContact OE2-NE 2.75Å; E279-R282 PolarHBondContact OE2-NE 2.81Å; E279-R282 IonicContact OE2-NH2 2.63Å; E279-R282 PolarHBondContact OE2-NH2 3.04Å; E279-R283 VanDerWaalsContact O-CG 3.29Å; E279-R283 WeakPolarHBondContact O-CG 3.12Å; E279-R283 PolarHBondContact O-N 3.46Å; E279-R283 IonicContact OE1-CZ 3.01Å; E279-R283 VanDerWaalsContact OE1-CZ 3.25Å; E279-R283 IonicContact OE1-NE 2.76Å; E279-R283 PolarHBondContact OE1-NE 2.89Å; E279-R283 IonicContact OE1-NH2 4Å; E279-R283 PolarHBondContact OE1-NH2 3.49Å |
| 280 | E | 57.1 | Low | 57.1 | Low | 97 Ų | 97 | 83.1 Ų | 83.1 | 45% | 0.453 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -69.5 | -37.3 | 172.8 | -171.9 | 175.3 | -162.3 | 0 | 0 | 113.6 | T278 T284 | T278-E280 PolarHBondContact O-N 3.4Å; E280-T284 WeakPolarHBondContact O-CB 3.47Å; E280-T284 PolarHBondContact O-N 2.71Å; E280-T284 PolarHBondContact O-OG1 3.11Å |
| 281 | E | 66 | Low | 57.4 | Low | 20 Ų | 20 | 78.9 Ų | 78.9 | 9% | 0.093 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -65.1 | -43.8 | 173 | -59.3 | -175.9 | 119.2 | 0 | 0 | 110.2 | L277 T278 T284 L285 R310 I313 | L277-E281 HydrophobicContact CB-CB 4.36Å; L277-E281 HydrophobicContact CD2-CB 4.1Å; T278-E281 PolarHBondContact N-OE2 2.97Å; T278-E281 WeakPolarHBondContact O-CA 3.41Å; T278-E281 WeakPolarHBondContact O-CB 3.4Å; T278-E281 PolarHBondContact O-N 3.49Å; T278-E281 PolarHBondContact OG1-OE2 2.9Å; E281-T284 PolarHBondContact O-N 3.34Å; E281-L285 VanDerWaalsContact O-CB 3.25Å; E281-L285 WeakPolarHBondContact O-CB 3.46Å; E281-L285 PolarHBondContact O-N 2.79Å; E281-R310 WeakPolarHBondContact OE1-CG 3.45Å; E281-R310 IonicContact OE1-CZ 3.32Å; E281-R310 VanDerWaalsContact OE1-CZ 3.32Å; E281-R310 IonicContact OE1-NE 2.69Å; E281-R310 PolarHBondContact OE1-NE 3.42Å; E281-R310 IonicContact OE1-NH2 3.05Å; E281-R310 PolarHBondContact OE1-NH2 3.08Å; E281-R310 IonicContact OE2-NH2 3.53Å; E281-I313 HydrophobicContact CG-CD1 4.28Å |
| 282 | R | 65.6 | Low | 58.4 | Low | 108 Ų | 108 | 78.2 Ų | 78.2 | 41% | 0.408 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60 | -48.7 | 177.4 | -168.6 | -178.7 | 72.6 | 95.6 | 2 | 111.7 | T278 E279 L285 V286 V292 | T278-R282 PolarHBondContact O-N 3.49Å; E279-R282 VanDerWaalsContact CD-NH2 3.31Å; E279-R282 PolarHBondContact O-N 3.36Å; E279-R282 IonicContact OE1-CZ 2.86Å; E279-R282 IonicContact OE1-NH2 2.63Å; E279-R282 PolarHBondContact OE1-NH2 3.05Å; E279-R282 IonicContact OE2-CZ 3.25Å; E279-R282 VanDerWaalsContact OE2-CZ 3.27Å; E279-R282 IonicContact OE2-NE 2.75Å; E279-R282 PolarHBondContact OE2-NE 2.81Å; E279-R282 IonicContact OE2-NH2 2.63Å; E279-R282 PolarHBondContact OE2-NH2 3.04Å; R282-L285 PolarHBondContact O-N 2.92Å; R282-V286 WeakPolarHBondContact O-CG2 3.33Å; R282-V286 PolarHBondContact O-N 3.3Å; R282-V286 VanDerWaalsContact O-N 3.12Å; R282-V292 HydrophobicContact CG-CG1 3.92Å; R282-V292 HydrophobicContact CG-CG2 4.11Å |
| 283 | R | 64.1 | Low | 58.9 | Low | 163 Ų | 163 | 73.1 Ų | 73.1 | 62% | 0.615 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -61.1 | -44 | 177.3 | -73.2 | 175 | -170.2 | -166.1 | 4.1 | 112.4 | E279 L285 A287 | E279-R283 VanDerWaalsContact O-CG 3.29Å; E279-R283 WeakPolarHBondContact O-CG 3.12Å; E279-R283 PolarHBondContact O-N 3.46Å; E279-R283 IonicContact OE1-CZ 3.01Å; E279-R283 VanDerWaalsContact OE1-CZ 3.25Å; E279-R283 IonicContact OE1-NE 2.76Å; E279-R283 PolarHBondContact OE1-NE 2.89Å; E279-R283 IonicContact OE1-NH2 4Å; E279-R283 PolarHBondContact OE1-NH2 3.49Å; R283-L285 VanDerWaalsContact C-N 3.31Å; R283-L285 PolarHBondContact O-N 3.28Å; R283-A287 WeakPolarHBondContact O-CB 3.46Å; R283-A287 PolarHBondContact O-N 3.3Å |
| 284 | T | 66 | Low | 59.3 | Low | 34 Ų | 34 | 76.6 Ų | 76.6 | 21% | 0.209 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -66.4 | -34.8 | 179 | -51.3 | 0 | 0 | 0 | 0 | 111.8 | E280 E281 E288 I309 I313 | E280-T284 WeakPolarHBondContact O-CB 3.47Å; E280-T284 PolarHBondContact O-N 2.71Å; E280-T284 PolarHBondContact O-OG1 3.11Å; E281-T284 PolarHBondContact O-N 3.34Å; T284-E288 WeakPolarHBondContact O-CB 3.4Å; T284-E288 VanDerWaalsContact O-CG 3.27Å; T284-E288 WeakPolarHBondContact O-CG 3.4Å; T284-E288 PolarHBondContact O-N 2.99Å; T284-I309 HydrophobicContact CG2-CG2 3.78Å; T284-I313 HydrophobicContact CG2-CD1 4.38Å; T284-I313 HydrophobicContact CG2-CG1 4.15Å |
| 285 | L | 66.8 | Low | 59.4 | Low | 4 Ų | 4 | 79.8 Ų | 79.8 | 2% | 0.021 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -71 | -40.2 | -179.4 | -163.1 | 148 | 0 | 0 | 0 | 112.1 | E281 R282 R283 Y290 P291 V292 L306 I309 | E281-L285 VanDerWaalsContact O-CB 3.25Å; E281-L285 WeakPolarHBondContact O-CB 3.46Å; E281-L285 PolarHBondContact O-N 2.79Å; R282-L285 PolarHBondContact O-N 2.92Å; R283-L285 VanDerWaalsContact C-N 3.31Å; R283-L285 PolarHBondContact O-N 3.28Å; L285-Y290 WeakPolarHBondContact CD2-O 3.48Å; L285-Y290 PolarHBondContact O-N 3.42Å; L285-Y290 VanDerWaalsContact O-N 3.11Å; L285-P291 WeakPolarHBondContact CD2-O 3.43Å; L285-V292 HydrophobicContact CD2-CG2 4.22Å; L285-L306 HydrophobicContact CD1-CD1 4.45Å; L285-I309 HydrophobicContact CB-CD1 3.68Å; L285-I309 HydrophobicContact CD1-CD1 3.66Å; L285-I309 HydrophobicContact CG-CD1 3.45Å; L285-I309 VanDerWaalsContact CG-CD1 3.45Å |
| 286 | V | 67.1 | Low | 59.5 | Low | 84 Ų | 84 | 80.1 Ų | 80.1 | 51% | 0.509 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -64 | -46.4 | 171.5 | 175 | 0 | 0 | 0 | 0 | 111.6 | R282 E288 G289 V292 | R282-V286 WeakPolarHBondContact O-CG2 3.33Å; R282-V286 PolarHBondContact O-N 3.3Å; R282-V286 VanDerWaalsContact O-N 3.12Å; V286-E288 PolarHBondContact O-N 2.88Å; V286-G289 PolarHBondContact O-N 3.19Å; V286-V292 HydrophobicContact CG2-CG2 3.33Å |
| 287 | A | 71.9 | Confident | 59.9 | Low | 89 Ų | 89 | 78.1 Ų | 78.1 | 74% | 0.736 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -63.9 | -25.7 | -178 | 0 | 0 | 0 | 0 | 0 | 113.6 | R283 G289 | R283-A287 WeakPolarHBondContact O-CB 3.46Å; R283-A287 PolarHBondContact O-N 3.3Å; A287-G289 VanDerWaalsContact C-N 3.31Å |
| 288 | E | 64.9 | Low | 60.1 | Low | 81 Ų | 81 | 78.1 Ų | 78.1 | 38% | 0.379 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.3 | 6.3 | 174.9 | -69.5 | -91.7 | 157.7 | 0 | 0 | 113.2 | T284 V286 Y290 K312 | T284-E288 WeakPolarHBondContact O-CB 3.4Å; T284-E288 VanDerWaalsContact O-CG 3.27Å; T284-E288 WeakPolarHBondContact O-CG 3.4Å; T284-E288 PolarHBondContact O-N 2.99Å; V286-E288 PolarHBondContact O-N 2.88Å; E288-Y290 VanDerWaalsContact C-N 3.35Å; E288-Y290 HydrophobicContact CB-CD2 3.82Å; E288-Y290 HydrophobicContact CB-CE2 4.08Å; E288-Y290 PolarHBondContact O-N 3.36Å; E288-K312 WeakPolarHBondContact OE1-CD 3.33Å; E288-K312 IonicContact OE1-NZ 2.95Å; E288-K312 PolarHBondContact OE1-NZ 2.94Å; E288-K312 IonicContact OE2-NZ 2.87Å; E288-K312 PolarHBondContact OE2-NZ 3.44Å |
| 289 | G | 56.5 | Low | 60.5 | Low | 67 Ų | 67 | 76.7 Ų | 76.7 | 69% | 0.691 | 42% | 0.421 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 76.7 | 14.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | V286 A287 | V286-G289 PolarHBondContact O-N 3.19Å; A287-G289 VanDerWaalsContact C-N 3.31Å |
| 290 | Y | 58.8 | Low | 61.3 | Low | 94 Ų | 94 | 81 Ų | 81 | 37% | 0.369 | 44% | 0.439 | S | S | . | . | trans | -89.6 | 140.6 | 175.4 | -66.6 | -71.5 | 0 | 0 | 0 | 110.8 | L285 E288 A305 I309 | L285-Y290 WeakPolarHBondContact CD2-O 3.48Å; L285-Y290 PolarHBondContact O-N 3.42Å; L285-Y290 VanDerWaalsContact O-N 3.11Å; E288-Y290 VanDerWaalsContact C-N 3.35Å; E288-Y290 HydrophobicContact CB-CD2 3.82Å; E288-Y290 HydrophobicContact CB-CE2 4.08Å; E288-Y290 PolarHBondContact O-N 3.36Å; Y290-A305 HydrophobicContact CD1-CB 4.19Å; Y290-A305 HydrophobicContact CE1-CB 4.32Å; Y290-A305 HydrophobicContact CG-CB 4.32Å; Y290-I309 HydrophobicContact CD2-CD1 4.25Å | ||
| 291 | P | 54.1 | Low | 62.2 | Low | 99 Ų | 99 | 79.4 Ų | 79.4 | 64% | 0.643 | 44% | 0.443 | S | S | * | . | trans | -68.9 | 136.5 | 174.2 | 28.8 | -33.9 | 0 | 0 | 0 | 110.2 | L285 P293 | L285-P291 WeakPolarHBondContact CD2-O 3.43Å; P291-P293 WeakPolarHBondContact O-CD 3.31Å | ||
| 292 | V | 55.8 | Low | 62.7 | Low | 45 Ų | 45 | 81.1 Ų | 81.1 | 27% | 0.273 | 45% | 0.45 | S | S | . | . | trans | -70.5 | 113.3 | -179.3 | 178.8 | 0 | 0 | 0 | 0 | 110.3 | L277 R282 L285 V286 T294 | L277-V292 HydrophobicContact CD1-CG1 4.38Å; R282-V292 HydrophobicContact CG-CG1 3.92Å; R282-V292 HydrophobicContact CG-CG2 4.11Å; L285-V292 HydrophobicContact CD2-CG2 4.22Å; V286-V292 HydrophobicContact CG2-CG2 3.33Å; V292-T294 PolarHBondContact O-N 2.87Å; V292-T294 PolarHBondContact O-OG1 3.32Å | ||
| 293 | P | 57.2 | Low | 63.4 | Low | 11 Ų | 11 | 81.1 Ų | 81.1 | 7% | 0.071 | 46% | 0.455 | C | S | . | . | trans | -75.3 | 99.5 | -176.4 | -17 | 33.8 | 0 | 0 | 0 | 110.9 | P291 L298 E302 | P291-P293 WeakPolarHBondContact O-CD 3.31Å; P293-L298 HydrophobicContact CB-CD1 4.05Å; P293-L298 HydrophobicContact CB-CG 4.25Å; P293-E302 HydrophobicContact CG-CB 4.08Å; P293-E302 HydrophobicContact CG-CG 4.01Å | ||
| 294 | T | 56 | Low | 64.4 | Low | 101 Ų | 101 | 80.4 Ų | 80.4 | 62% | 0.62 | 46% | 0.456 | S | S | * | . | trans | -88.9 | -8.5 | -175.1 | -16.4 | 0 | 0 | 0 | 0 | 114.4 | V292 | V292-T294 PolarHBondContact O-N 2.87Å; V292-T294 PolarHBondContact O-OG1 3.32Å | ||
| 295 | K | 46.3 | Very low | 65.1 | Low | 168 Ų | 168 | 79.2 Ų | 79.2 | 73% | 0.73 | 45% | 0.45 | S | S | * | . | S | Bend | trans | -140.6 | 134.2 | -178.2 | -63.2 | -173.7 | -178.7 | 179.7 | 0 | 111.5 | ||
| 296 | L | 51.5 | Low | 65.7 | Low | 58 Ų | 58 | 79.7 Ų | 79.7 | 30% | 0.304 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -70.6 | 154 | 167.9 | -77.5 | 163.2 | 0 | 0 | 0 | 111.1 | L275 L298 | L275-L296 HydrophobicContact CD1-CD2 4.18Å; L296-L298 HydrophobicContact CD2-CD1 4.08Å |
| 297 | P | 55.3 | Low | 66.7 | Low | 120 Ų | 120 | 83.5 Ų | 83.5 | 78% | 0.779 | 46% | 0.463 | S | S | * | . | S | Bend | cis | -80.4 | 141.1 | 0.1 | 32.6 | -33.9 | 0 | 0 | 0 | 112.3 | S299 | P297-S299 PolarHBondContact O-N 3.18Š|
| 298 | L | 59.2 | Low | 67.5 | Low | 26 Ų | 26 | 84.9 Ų | 84.9 | 14% | 0.136 | 45% | 0.452 | C | S | . | . | P | Polyproline II helix | trans | -63.5 | 135.8 | 169.9 | -102.7 | 69.9 | 0 | 0 | 0 | 109.9 | L275 P293 L296 E302 E303 | L275-L298 HydrophobicContact CB-CD1 4.48Å; L275-L298 HydrophobicContact CD1-CD1 3.92Å; L275-L298 HydrophobicContact CD2-CD1 3.61Å; L275-L298 HydrophobicContact CD2-CD2 3.93Å; L275-L298 HydrophobicContact CD2-CG 4.4Å; L275-L298 HydrophobicContact CG-CD1 4.2Å; P293-L298 HydrophobicContact CB-CD1 4.05Å; P293-L298 HydrophobicContact CB-CG 4.25Å; L296-L298 HydrophobicContact CD2-CD1 4.08Å; L298-E302 WeakPolarHBondContact CA-OE2 3.44Å; L298-E302 HydrophobicContact CB-CB 4.31Å; L298-E302 HydrophobicContact CD2-CB 3.88Å; L298-E302 HydrophobicContact CG-CB 3.81Å; L298-E303 HydrophobicContact CB-CG 3.88Å; L298-E303 HydrophobicContact CD2-CG 4.1Å |
| 299 | S | 70.7 | Confident | 68.6 | Low | 65 Ų | 65 | 81.1 Ų | 81.1 | 46% | 0.455 | 43% | 0.434 | S | S | . | . | P | Polyproline II helix | trans | -62.7 | 145.8 | 164.2 | 175.6 | 0 | 0 | 0 | 0 | 110 | P297 A301 E302 E303 | P297-S299 PolarHBondContact O-N 3.18Å; S299-A301 PolarHBondContact O-N 2.89Å; S299-A301 PolarHBondContact OG-N 2.89Å; S299-E302 PolarHBondContact N-OE2 2.79Å; S299-E302 WeakPolarHBondContact O-CB 3.46Å; S299-E302 PolarHBondContact O-N 3.28Å; S299-E303 PolarHBondContact O-N 3.5Å; S299-E303 VanDerWaalsContact O-N 3.14Å |
| 300 | K | 76.4 | Confident | 70.1 | Confident | 167 Ų | 167 | 83.7 Ų | 83.7 | 73% | 0.726 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -54.2 | -19.6 | 171.9 | -74.3 | -178.8 | 176.6 | 175.3 | 0 | 113.1 | K304 | K300-K304 WeakPolarHBondContact O-CD 3.39Å; K300-K304 VanDerWaalsContact O-CG 3.28Å; K300-K304 WeakPolarHBondContact O-CG 3.42Å |
| 301 | A | 75.8 | Confident | 71.7 | Confident | 64 Ų | 64 | 87.3 Ų | 87.3 | 53% | 0.529 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -74.1 | -43.1 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S299 K304 A305 | S299-A301 PolarHBondContact O-N 2.89Å; S299-A301 PolarHBondContact OG-N 2.89Å; A301-K304 PolarHBondContact O-N 3.33Å; A301-A305 PolarHBondContact O-N 3.32Å |
| 302 | E | 76.3 | Confident | 73.5 | Confident | 55 Ų | 55 | 87.4 Ų | 87.4 | 26% | 0.257 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -69.1 | -39.4 | -179.5 | -63.7 | 169.9 | 136.4 | 0 | 0 | 111.2 | P293 L298 S299 K304 A305 L306 | P293-E302 HydrophobicContact CG-CB 4.08Å; P293-E302 HydrophobicContact CG-CG 4.01Å; L298-E302 WeakPolarHBondContact CA-OE2 3.44Å; L298-E302 HydrophobicContact CB-CB 4.31Å; L298-E302 HydrophobicContact CD2-CB 3.88Å; L298-E302 HydrophobicContact CG-CB 3.81Å; S299-E302 PolarHBondContact N-OE2 2.79Å; S299-E302 WeakPolarHBondContact O-CB 3.46Å; S299-E302 PolarHBondContact O-N 3.28Å; E302-K304 VanDerWaalsContact C-N 3.31Å; E302-K304 PolarHBondContact O-N 2.94Å; E302-A305 PolarHBondContact O-N 3.08Å; E302-L306 WeakPolarHBondContact O-CB 3.38Å; E302-L306 PolarHBondContact O-N 3.32Å |
| 303 | E | 80.8 | Confident | 75 | Confident | 108 Ų | 108 | 86.2 Ų | 86.2 | 51% | 0.505 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60.1 | -41.4 | 173.3 | -61.3 | -173.8 | 138.5 | 0 | 0 | 111.8 | L298 S299 K307 | L298-E303 HydrophobicContact CB-CG 3.88Å; L298-E303 HydrophobicContact CD2-CG 4.1Å; S299-E303 PolarHBondContact O-N 3.5Å; S299-E303 VanDerWaalsContact O-N 3.14Å; E303-K307 WeakPolarHBondContact O-CB 3.49Å; E303-K307 PolarHBondContact O-N 3.09Å |
| 304 | K | 84.5 | Confident | 76.8 | Confident | 148 Ų | 148 | 93.1 Ų | 93.1 | 64% | 0.643 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -66.9 | -38.1 | 175.4 | -75 | 176.3 | -178.8 | -177.1 | 0 | 111.8 | K300 A301 E302 K308 | K300-K304 WeakPolarHBondContact O-CD 3.39Å; K300-K304 VanDerWaalsContact O-CG 3.28Å; K300-K304 WeakPolarHBondContact O-CG 3.42Å; A301-K304 PolarHBondContact O-N 3.33Å; E302-K304 VanDerWaalsContact C-N 3.31Å; E302-K304 PolarHBondContact O-N 2.94Å; K304-K308 WeakPolarHBondContact O-CG 3.37Å; K304-K308 PolarHBondContact O-N 3.35Å |
| 305 | A | 80.8 | Confident | 78.7 | Confident | 10 Ų | 10 | 92.9 Ų | 92.9 | 8% | 0.083 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -65.3 | -49.3 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y290 A301 E302 K307 K308 I309 | Y290-A305 HydrophobicContact CD1-CB 4.19Å; Y290-A305 HydrophobicContact CE1-CB 4.32Å; Y290-A305 HydrophobicContact CG-CB 4.32Å; A301-A305 PolarHBondContact O-N 3.32Å; E302-A305 PolarHBondContact O-N 3.08Å; A305-K307 VanDerWaalsContact C-N 3.31Å; A305-K307 PolarHBondContact O-N 3.33Å; A305-K308 WeakPolarHBondContact O-CA 3.2Å; A305-K308 WeakPolarHBondContact O-CB 3.36Å; A305-K308 PolarHBondContact O-N 3.42Å; A305-I309 PolarHBondContact O-N 3.38Å |
| 306 | L | 81 | Confident | 81.1 | Confident | 14 Ų | 14 | 91.3 Ų | 91.3 | 7% | 0.073 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -60.7 | -38.7 | 178.2 | -175.5 | 57.4 | 0 | 0 | 0 | 112.1 | L275 L277 L285 E302 K308 I309 R310 | L275-L306 HydrophobicContact CD2-CD2 4.32Å; L277-L306 HydrophobicContact CD2-CD1 3.43Å; L277-L306 VanDerWaalsContact CD2-CD1 3.43Å; L277-L306 HydrophobicContact CD2-CD2 3.79Å; L277-L306 HydrophobicContact CD2-CG 4.27Å; L285-L306 HydrophobicContact CD1-CD1 4.45Å; E302-L306 WeakPolarHBondContact O-CB 3.38Å; E302-L306 PolarHBondContact O-N 3.32Å; L306-K308 PolarHBondContact O-N 2.99Å; L306-I309 PolarHBondContact O-N 3.3Å; L306-R310 HydrophobicContact CD1-CG 4.37Å; L306-R310 WeakPolarHBondContact O-CB 3.2Å; L306-R310 WeakPolarHBondContact O-CG 3.25Å; L306-R310 PolarHBondContact O-N 3.19Å |
| 307 | K | 87.2 | Confident | 83 | Confident | 164 Ų | 164 | 92.7 Ų | 92.7 | 71% | 0.713 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -61.6 | -39.9 | 172.8 | -173.6 | 173.7 | -178.3 | 175.4 | 0 | 112.5 | E303 A305 R311 | E303-K307 WeakPolarHBondContact O-CB 3.49Å; E303-K307 PolarHBondContact O-N 3.09Å; A305-K307 VanDerWaalsContact C-N 3.31Å; A305-K307 PolarHBondContact O-N 3.33Å; K307-R311 PolarHBondContact O-N 2.91Å |
| 308 | K | 89.2 | Confident | 85 | Confident | 118 Ų | 118 | 90.7 Ų | 90.7 | 51% | 0.513 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.1 | -43.3 | 174.2 | -72.5 | 175.4 | 177.8 | -176.9 | 0 | 111.4 | K304 A305 L306 R311 K312 | K304-K308 WeakPolarHBondContact O-CG 3.37Å; K304-K308 PolarHBondContact O-N 3.35Å; A305-K308 WeakPolarHBondContact O-CA 3.2Å; A305-K308 WeakPolarHBondContact O-CB 3.36Å; A305-K308 PolarHBondContact O-N 3.42Å; L306-K308 PolarHBondContact O-N 2.99Å; K308-R311 WeakPolarHBondContact O-CB 3.39Å; K308-R311 PolarHBondContact O-N 3.31Å; K308-K312 PolarHBondContact O-N 3.28Å |
| 309 | I | 87.1 | Confident | 86.8 | Confident | 2 Ų | 2 | 91.7 Ų | 91.7 | 1% | 0.01 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -65.7 | -47.3 | -179.5 | -72.5 | 157.6 | 0 | 0 | 0 | 111.4 | T284 L285 Y290 A305 L306 R311 K312 I313 | T284-I309 HydrophobicContact CG2-CG2 3.78Å; L285-I309 HydrophobicContact CB-CD1 3.68Å; L285-I309 HydrophobicContact CD1-CD1 3.66Å; L285-I309 HydrophobicContact CG-CD1 3.45Å; L285-I309 VanDerWaalsContact CG-CD1 3.45Å; Y290-I309 HydrophobicContact CD2-CD1 4.25Å; A305-I309 PolarHBondContact O-N 3.38Å; L306-I309 PolarHBondContact O-N 3.3Å; I309-R311 PolarHBondContact O-N 3.44Å; I309-K312 WeakPolarHBondContact O-CA 3.45Å; I309-K312 WeakPolarHBondContact O-CB 3.5Å; I309-K312 PolarHBondContact O-N 2.94Å; I309-I313 HydrophobicContact CG2-CD1 3.85Å; I309-I313 HydrophobicContact CG2-CG1 4.43Å; I309-I313 WeakPolarHBondContact O-CG1 3.3Å; I309-I313 PolarHBondContact O-N 3.38Å |
| 310 | R | 88.4 | Confident | 88.1 | Confident | 121 Ų | 121 | 93.8 Ų | 93.8 | 46% | 0.457 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -55.5 | -38.7 | 172.8 | -74.5 | 175.7 | 172.1 | 172.6 | -0.5 | 112.4 | E281 L306 K314 | E281-R310 WeakPolarHBondContact OE1-CG 3.45Å; E281-R310 IonicContact OE1-CZ 3.32Å; E281-R310 VanDerWaalsContact OE1-CZ 3.32Å; E281-R310 IonicContact OE1-NE 2.69Å; E281-R310 PolarHBondContact OE1-NE 3.42Å; E281-R310 IonicContact OE1-NH2 3.05Å; E281-R310 PolarHBondContact OE1-NH2 3.08Å; E281-R310 IonicContact OE2-NH2 3.53Å; L306-R310 HydrophobicContact CD1-CG 4.37Å; L306-R310 WeakPolarHBondContact O-CB 3.2Å; L306-R310 WeakPolarHBondContact O-CG 3.25Å; L306-R310 PolarHBondContact O-N 3.19Å; R310-K314 WeakPolarHBondContact O-CB 3.49Å; R310-K314 PolarHBondContact O-N 3.4Å; R310-K314 VanDerWaalsContact O-N 3.08Å |
| 311 | R | 92.2 | Very high | 89.1 | Confident | 169 Ų | 169 | 90.4 Ų | 90.4 | 64% | 0.638 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -67.7 | -43.4 | 173.1 | -170.6 | 177.9 | 70.9 | 167.9 | 4.8 | 112.1 | K307 K308 I309 K314 N315 | K307-R311 PolarHBondContact O-N 2.91Å; K308-R311 WeakPolarHBondContact O-CB 3.39Å; K308-R311 PolarHBondContact O-N 3.31Å; I309-R311 PolarHBondContact O-N 3.44Å; R311-K314 PolarHBondContact O-N 2.79Å; R311-N315 WeakPolarHBondContact O-CB 3.39Å; R311-N315 VanDerWaalsContact O-CG 3.31Å; R311-N315 PolarHBondContact O-N 3.5Å; R311-N315 PolarHBondContact O-OD1 3.29Å |
| 312 | K | 92.6 | Very high | 90.1 | Very high | 101 Ų | 101 | 91.2 Ų | 91.2 | 44% | 0.439 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -59.8 | -46.4 | 176 | -79.1 | -172.5 | 165.1 | -169.6 | 0 | 111.8 | E288 K308 I309 N315 K316 | E288-K312 WeakPolarHBondContact OE1-CD 3.33Å; E288-K312 IonicContact OE1-NZ 2.95Å; E288-K312 PolarHBondContact OE1-NZ 2.94Å; E288-K312 IonicContact OE2-NZ 2.87Å; E288-K312 PolarHBondContact OE2-NZ 3.44Å; K308-K312 PolarHBondContact O-N 3.28Å; I309-K312 WeakPolarHBondContact O-CA 3.45Å; I309-K312 WeakPolarHBondContact O-CB 3.5Å; I309-K312 PolarHBondContact O-N 2.94Å; K312-N315 PolarHBondContact O-N 3.43Å; K312-K316 WeakPolarHBondContact O-CB 3.21Å; K312-K316 PolarHBondContact O-N 2.85Å |
| 313 | I | 87.4 | Confident | 91.2 | Very high | 21 Ų | 21 | 97.8 Ų | 97.8 | 11% | 0.108 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -61.1 | -50.6 | 177 | -64.6 | 167.8 | 0 | 0 | 0 | 110.6 | E281 T284 I309 N315 K316 I317 | E281-I313 HydrophobicContact CG-CD1 4.28Å; T284-I313 HydrophobicContact CG2-CD1 4.38Å; T284-I313 HydrophobicContact CG2-CG1 4.15Å; I309-I313 HydrophobicContact CG2-CD1 3.85Å; I309-I313 HydrophobicContact CG2-CG1 4.43Å; I309-I313 WeakPolarHBondContact O-CG1 3.3Å; I309-I313 PolarHBondContact O-N 3.38Å; I313-N315 VanDerWaalsContact C-N 3.33Å; I313-N315 PolarHBondContact O-N 2.89Å; I313-K316 WeakPolarHBondContact O-CB 3.34Å; I313-K316 PolarHBondContact O-N 3.22Å; I313-I317 HydrophobicContact CG2-CD1 3.86Å; I313-I317 WeakPolarHBondContact O-CG1 3.08Å; I313-I317 PolarHBondContact O-N 3.34Å |
| 314 | K | 94.4 | Very high | 92 | Very high | 155 Ų | 155 | 98.5 Ų | 98.5 | 67% | 0.674 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -58.3 | -42.7 | 177.6 | -177.6 | 174 | -69 | -166.3 | 0 | 112.4 | R310 R311 S318 | R310-K314 WeakPolarHBondContact O-CB 3.49Å; R310-K314 PolarHBondContact O-N 3.4Å; R310-K314 VanDerWaalsContact O-N 3.08Å; R311-K314 PolarHBondContact O-N 2.79Å; K314-S318 WeakPolarHBondContact O-CB 3.33Å; K314-S318 PolarHBondContact O-N 3.3Å |
| 315 | N | 96 | Very high | 92.7 | Very high | 97 Ų | 97 | 98.7 Ų | 98.7 | 52% | 0.519 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -67.6 | -38.8 | 177.8 | -74.8 | 17 | 0 | 0 | 0 | 112.1 | R311 K312 I313 S318 A319 | R311-N315 WeakPolarHBondContact O-CB 3.39Å; R311-N315 VanDerWaalsContact O-CG 3.31Å; R311-N315 PolarHBondContact O-N 3.5Å; R311-N315 PolarHBondContact O-OD1 3.29Å; K312-N315 PolarHBondContact O-N 3.43Å; I313-N315 VanDerWaalsContact C-N 3.33Å; I313-N315 PolarHBondContact O-N 2.89Å; N315-S318 PolarHBondContact O-N 2.97Å; N315-A319 VanDerWaalsContact O-CB 3.3Å; N315-A319 WeakPolarHBondContact O-CB 3.25Å; N315-A319 PolarHBondContact O-N 3.42Å |
| 316 | K | 95.8 | Very high | 93.6 | Very high | 134 Ų | 134 | 105.3 Ų | 105.3 | 58% | 0.583 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -59.7 | -49.5 | 175 | -178.1 | -168.7 | 172 | -161.1 | 0 | 111 | K312 I313 A319 Q320 | K312-K316 WeakPolarHBondContact O-CB 3.21Å; K312-K316 PolarHBondContact O-N 2.85Å; I313-K316 WeakPolarHBondContact O-CB 3.34Å; I313-K316 PolarHBondContact O-N 3.22Å; K316-A319 PolarHBondContact O-N 3.46Å; K316-Q320 WeakPolarHBondContact O-CB 3.36Å; K316-Q320 PolarHBondContact O-N 2.82Å |
| 317 | I | 91.4 | Very high | 94.4 | Very high | 88 Ų | 88 | 111 Ų | 111 | 45% | 0.451 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.5 | -47.8 | 178.4 | -64.4 | 168 | 0 | 0 | 0 | 110.5 | I313 A319 Q320 E321 | I313-I317 HydrophobicContact CG2-CD1 3.86Å; I313-I317 WeakPolarHBondContact O-CG1 3.08Å; I313-I317 PolarHBondContact O-N 3.34Å; I317-A319 PolarHBondContact O-N 3.25Å; I317-Q320 PolarHBondContact O-N 3.28Å; I317-E321 WeakPolarHBondContact O-CB 3.49Å; I317-E321 PolarHBondContact O-N 3.11Å |
| 318 | S | 97.1 | Very high | 94.9 | Very high | 78 Ų | 78 | 107.9 Ų | 107.9 | 55% | 0.545 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60 | -42.6 | 178.7 | -176.8 | 0 | 0 | 0 | 0 | 112.8 | K314 N315 E321 S322 | K314-S318 WeakPolarHBondContact O-CB 3.33Å; K314-S318 PolarHBondContact O-N 3.3Å; N315-S318 PolarHBondContact O-N 2.97Å; S318-E321 PolarHBondContact O-N 3.02Å; S318-S322 WeakPolarHBondContact O-CB 3.44Å; S318-S322 PolarHBondContact O-N 3.02Å |
| 319 | A | 97.6 | Very high | 95.4 | Very high | 46 Ų | 46 | 109.4 Ų | 109.4 | 38% | 0.38 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -67.6 | -37.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | N315 K316 I317 R323 | N315-A319 VanDerWaalsContact O-CB 3.3Å; N315-A319 WeakPolarHBondContact O-CB 3.25Å; N315-A319 PolarHBondContact O-N 3.42Å; K316-A319 PolarHBondContact O-N 3.46Å; I317-A319 PolarHBondContact O-N 3.25Å; A319-R323 VanDerWaalsContact O-CG 3.25Å; A319-R323 WeakPolarHBondContact O-CG 3.44Å; A319-R323 PolarHBondContact O-N 3.45Å; A319-R323 VanDerWaalsContact O-N 3.11Å |
| 320 | Q | 97.9 | Very high | 95.9 | Very high | 110 Ų | 110 | 113.2 Ų | 113.2 | 51% | 0.514 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65 | -44.3 | 174.6 | -177.3 | 175.4 | 1.8 | 0 | 0 | 111.4 | K316 I317 R323 R324 | K316-Q320 WeakPolarHBondContact O-CB 3.36Å; K316-Q320 PolarHBondContact O-N 2.82Å; I317-Q320 PolarHBondContact O-N 3.28Å; Q320-R323 WeakPolarHBondContact O-CB 3.46Å; Q320-R323 PolarHBondContact O-N 3.44Å; Q320-R324 PolarHBondContact O-N 3.02Å |
| 321 | E | 96.8 | Very high | 96.4 | Very high | 95 Ų | 95 | 110.7 Ų | 110.7 | 44% | 0.444 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -69.6 | -37.4 | -179.3 | -166.1 | 59 | -162.6 | 0 | 0 | 112.1 | I317 S318 R323 R324 K325 | I317-E321 WeakPolarHBondContact O-CB 3.49Å; I317-E321 PolarHBondContact O-N 3.11Å; S318-E321 PolarHBondContact O-N 3.02Å; E321-R323 VanDerWaalsContact C-N 3.33Å; E321-R323 PolarHBondContact O-N 3.17Å; E321-R324 PolarHBondContact O-N 3.17Å; E321-R324 IonicContact OE1-NE 3.87Å; E321-R324 WeakPolarHBondContact OE2-CD 3.39Å; E321-R324 IonicContact OE2-NE 2.62Å; E321-R324 PolarHBondContact OE2-NE 3.47Å; E321-K325 WeakPolarHBondContact O-CB 3.26Å; E321-K325 PolarHBondContact O-N 2.99Å |
| 322 | S | 98.5 | Very high | 96.7 | Very high | 82 Ų | 82 | 105 Ų | 105 | 57% | 0.573 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -59.1 | -42.8 | 170 | 176.7 | 0 | 0 | 0 | 0 | 112.1 | S318 K326 | S318-S322 WeakPolarHBondContact O-CB 3.44Å; S318-S322 PolarHBondContact O-N 3.02Å; S322-K326 WeakPolarHBondContact O-CB 3.29Å; S322-K326 PolarHBondContact O-N 2.89Å |
| 323 | R | 98.6 | Very high | 97 | Very high | 192 Ų | 192 | 103.2 Ų | 103.2 | 73% | 0.725 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.7 | -43 | 175.4 | -71 | 169 | -175.8 | -171.5 | 0.3 | 112 | A319 Q320 E321 K326 K327 | A319-R323 VanDerWaalsContact O-CG 3.25Å; A319-R323 WeakPolarHBondContact O-CG 3.44Å; A319-R323 PolarHBondContact O-N 3.45Å; A319-R323 VanDerWaalsContact O-N 3.11Å; Q320-R323 WeakPolarHBondContact O-CB 3.46Å; Q320-R323 PolarHBondContact O-N 3.44Å; E321-R323 VanDerWaalsContact C-N 3.33Å; E321-R323 PolarHBondContact O-N 3.17Å; R323-K326 PolarHBondContact O-N 2.93Å; R323-K327 PolarHBondContact O-N 3.06Å |
| 324 | R | 98.4 | Very high | 97.5 | Very high | 124 Ų | 124 | 107.9 Ų | 107.9 | 47% | 0.468 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -56.5 | -54.4 | 174.7 | -177.1 | -160.5 | -67 | -85.4 | -0.6 | 110.4 | Q320 E321 K326 K327 E328 | Q320-R324 PolarHBondContact O-N 3.02Å; E321-R324 PolarHBondContact O-N 3.17Å; E321-R324 IonicContact OE1-NE 3.87Å; E321-R324 WeakPolarHBondContact OE2-CD 3.39Å; E321-R324 IonicContact OE2-NE 2.62Å; E321-R324 PolarHBondContact OE2-NE 3.47Å; R324-K326 VanDerWaalsContact C-N 3.31Å; R324-K326 PolarHBondContact O-N 3.2Å; R324-K327 WeakPolarHBondContact O-CA 3.44Å; R324-K327 WeakPolarHBondContact O-CB 3.35Å; R324-K327 PolarHBondContact O-N 3.42Å; R324-E328 VanDerWaalsContact CD-OE1 3.25Å; R324-E328 WeakPolarHBondContact CD-OE1 3.5Å; R324-E328 HydrophobicContact CG-CG 4.44Å; R324-E328 VanDerWaalsContact CG-OE1 3.23Å; R324-E328 WeakPolarHBondContact CG-OE1 3.17Å; R324-E328 WeakPolarHBondContact O-CG 3.34Å; R324-E328 PolarHBondContact O-N 3.07Å |
| 325 | K | 98.6 | Very high | 97.7 | Very high | 152 Ų | 152 | 106.8 Ų | 106.8 | 66% | 0.661 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.9 | -34.5 | -179.1 | -171 | 168.2 | -174.9 | 170.7 | 0 | 113.1 | E321 Y329 | E321-K325 WeakPolarHBondContact O-CB 3.26Å; E321-K325 PolarHBondContact O-N 2.99Å; K325-Y329 WeakPolarHBondContact O-CB 3.3Å; K325-Y329 PolarHBondContact O-N 3.39Å |
| 326 | K | 98.5 | Very high | 97.9 | Very high | 148 Ų | 148 | 108.9 Ų | 108.9 | 64% | 0.643 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.5 | -40.7 | 171.5 | -176.1 | 177.3 | 178 | -178.3 | 0 | 111.6 | S322 R323 R324 M330 | S322-K326 WeakPolarHBondContact O-CB 3.29Å; S322-K326 PolarHBondContact O-N 2.89Å; R323-K326 PolarHBondContact O-N 2.93Å; R324-K326 VanDerWaalsContact C-N 3.31Å; R324-K326 PolarHBondContact O-N 3.2Å; K326-M330 PolarHBondContact O-N 2.9Å; K326-M330 VanDerWaalsContact O-N 3.13Å |
| 327 | K | 98.4 | Very high | 98 | Very high | 134 Ų | 134 | 107.4 Ų | 107.4 | 58% | 0.583 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.8 | -54 | 174.5 | -173.9 | -174.6 | 176.8 | -164.2 | 0 | 110.5 | R323 R324 Y329 M330 D331 | R323-K327 PolarHBondContact O-N 3.06Å; R324-K327 WeakPolarHBondContact O-CA 3.44Å; R324-K327 WeakPolarHBondContact O-CB 3.35Å; R324-K327 PolarHBondContact O-N 3.42Å; K327-Y329 PolarHBondContact O-N 3.24Å; K327-Y329 VanDerWaalsContact O-N 3.15Å; K327-M330 CarbonylContact O-C 3.59Å; K327-M330 WeakPolarHBondContact O-CA 3.34Å; K327-M330 WeakPolarHBondContact O-CB 3.26Å; K327-M330 PolarHBondContact O-N 2.92Å; K327-D331 WeakPolarHBondContact CE-OD1 3.03Å; K327-D331 VanDerWaalsContact CE-OD2 3.25Å; K327-D331 WeakPolarHBondContact CE-OD2 3.5Å; K327-D331 WeakPolarHBondContact CG-OD1 3.47Å; K327-D331 IonicContact NZ-OD2 3.28Å; K327-D331 VanDerWaalsContact O-CG 3.29Å; K327-D331 PolarHBondContact O-N 3.34Å |
| 328 | E | 98.6 | Very high | 98.3 | Very high | 99 Ų | 99 | 108.9 Ų | 108.9 | 46% | 0.463 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -55.1 | -36.2 | 179.3 | -70.2 | 167.2 | 179.8 | 0 | 0 | 112.8 | R324 A332 | R324-E328 VanDerWaalsContact CD-OE1 3.25Å; R324-E328 WeakPolarHBondContact CD-OE1 3.5Å; R324-E328 HydrophobicContact CG-CG 4.44Å; R324-E328 VanDerWaalsContact CG-OE1 3.23Å; R324-E328 WeakPolarHBondContact CG-OE1 3.17Å; R324-E328 WeakPolarHBondContact O-CG 3.34Å; R324-E328 PolarHBondContact O-N 3.07Å; E328-A332 WeakPolarHBondContact O-CB 3.34Å; E328-A332 PolarHBondContact O-N 2.94Å |
| 329 | Y | 98.7 | Very high | 98.4 | Very high | 149 Ų | 149 | 109.4 Ų | 109.4 | 58% | 0.584 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -67.1 | -40.2 | 172.5 | 177 | -103.5 | 0 | 0 | 0 | 113 | K325 K327 L333 | K325-Y329 WeakPolarHBondContact O-CB 3.3Å; K325-Y329 PolarHBondContact O-N 3.39Å; K327-Y329 PolarHBondContact O-N 3.24Å; K327-Y329 VanDerWaalsContact O-N 3.15Å; Y329-L333 HydrophobicContact CD1-CD1 4.13Å; Y329-L333 HydrophobicContact CE1-CD1 3.46Å; Y329-L333 VanDerWaalsContact CE1-CD1 3.46Å; Y329-L333 HydrophobicContact CE1-CG 4.12Å; Y329-L333 HydrophobicContact CE2-CD1 4.44Å; Y329-L333 HydrophobicContact CE2-CD2 4.5Å; Y329-L333 HydrophobicContact CE2-CG 4.32Å; Y329-L333 WeakPolarHBondContact O-CG 3.43Å; Y329-L333 PolarHBondContact O-N 2.86Å |
| 330 | M | 98.8 | Very high | 98.4 | Very high | 82 Ų | 82 | 111 Ų | 111 | 40% | 0.404 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -66.1 | -52.3 | 175.5 | -160 | 70.5 | 73 | 0 | 0 | 110.9 | K326 K327 A332 L333 E334 | K326-M330 PolarHBondContact O-N 2.9Å; K326-M330 VanDerWaalsContact O-N 3.13Å; K327-M330 CarbonylContact O-C 3.59Å; K327-M330 WeakPolarHBondContact O-CA 3.34Å; K327-M330 WeakPolarHBondContact O-CB 3.26Å; K327-M330 PolarHBondContact O-N 2.92Å; M330-A332 PolarHBondContact O-N 2.84Å; M330-L333 WeakPolarHBondContact O-CA 3.33Å; M330-L333 WeakPolarHBondContact O-CB 3.45Å; M330-L333 PolarHBondContact O-N 3Å; M330-E334 WeakPolarHBondContact CG-OE1 3.49Å; M330-E334 WeakPolarHBondContact O-CG 3.4Å; M330-E334 PolarHBondContact O-N 3.28Å |
| 331 | D | 98.3 | Very high | 98.5 | Very high | 69 Ų | 69 | 109.3 Ų | 109.3 | 37% | 0.369 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -53.8 | -38.6 | 176.5 | -58.8 | 2.1 | 0 | 0 | 0 | 110.7 | K327 K335 | K327-D331 WeakPolarHBondContact CE-OD1 3.03Å; K327-D331 VanDerWaalsContact CE-OD2 3.25Å; K327-D331 WeakPolarHBondContact CE-OD2 3.5Å; K327-D331 WeakPolarHBondContact CG-OD1 3.47Å; K327-D331 IonicContact NZ-OD2 3.28Å; K327-D331 VanDerWaalsContact O-CG 3.29Å; K327-D331 PolarHBondContact O-N 3.34Å; D331-K335 VanDerWaalsContact O-CB 3.3Å; D331-K335 WeakPolarHBondContact O-CB 3.42Å; D331-K335 PolarHBondContact O-N 3.11Å |
| 332 | A | 98.6 | Very high | 98.6 | Very high | 48 Ų | 48 | 109 Ų | 109 | 40% | 0.397 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -74.1 | -29 | 176 | 0 | 0 | 0 | 0 | 0 | 114.5 | E328 M330 K336 | E328-A332 WeakPolarHBondContact O-CB 3.34Å; E328-A332 PolarHBondContact O-N 2.94Å; M330-A332 PolarHBondContact O-N 2.84Å; A332-K336 WeakPolarHBondContact O-CG 3.43Å; A332-K336 PolarHBondContact O-N 3.38Å |
| 333 | L | 98.7 | Very high | 98.6 | Very high | 65 Ų | 65 | 110.8 Ų | 110.8 | 34% | 0.34 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -72.8 | -46 | 170.9 | -77.2 | -177.8 | 0 | 0 | 0 | 111.1 | Y329 M330 K335 K336 V337 | Y329-L333 HydrophobicContact CD1-CD1 4.13Å; Y329-L333 HydrophobicContact CE1-CD1 3.46Å; Y329-L333 VanDerWaalsContact CE1-CD1 3.46Å; Y329-L333 HydrophobicContact CE1-CG 4.12Å; Y329-L333 HydrophobicContact CE2-CD1 4.44Å; Y329-L333 HydrophobicContact CE2-CD2 4.5Å; Y329-L333 HydrophobicContact CE2-CG 4.32Å; Y329-L333 WeakPolarHBondContact O-CG 3.43Å; Y329-L333 PolarHBondContact O-N 2.86Å; M330-L333 WeakPolarHBondContact O-CA 3.33Å; M330-L333 WeakPolarHBondContact O-CB 3.45Å; M330-L333 PolarHBondContact O-N 3Å; L333-K335 VanDerWaalsContact C-N 3.32Å; L333-K335 PolarHBondContact O-N 3.47Å; L333-K336 WeakPolarHBondContact O-CB 3.24Å; L333-K336 PolarHBondContact O-N 3.47Å; L333-K336 VanDerWaalsContact O-N 3.08Å; L333-V337 WeakPolarHBondContact O-CG2 3.37Å; L333-V337 PolarHBondContact O-N 3.48Å |
| 334 | E | 98.6 | Very high | 98.6 | Very high | 119 Ų | 119 | 105.4 Ų | 105.4 | 56% | 0.556 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -56.2 | -48.3 | 175.9 | -71 | 171.2 | -170.8 | 0 | 0 | 110.3 | M330 K336 V337 E338 | M330-E334 WeakPolarHBondContact CG-OE1 3.49Å; M330-E334 WeakPolarHBondContact O-CG 3.4Å; M330-E334 PolarHBondContact O-N 3.28Å; E334-K336 VanDerWaalsContact C-N 3.34Å; E334-K336 PolarHBondContact O-N 2.84Å; E334-V337 PolarHBondContact O-N 3.23Å; E334-V337 VanDerWaalsContact O-N 3.14Å; E334-E338 PolarHBondContact O-N 3.07Å |
| 335 | K | 98.7 | Very high | 98.6 | Very high | 131 Ų | 131 | 102 Ų | 102 | 57% | 0.57 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59 | -40.4 | 173.5 | -175.3 | 167.9 | -175 | 169.7 | 0 | 113.2 | D331 L333 E338 N339 | D331-K335 VanDerWaalsContact O-CB 3.3Å; D331-K335 WeakPolarHBondContact O-CB 3.42Å; D331-K335 PolarHBondContact O-N 3.11Å; L333-K335 VanDerWaalsContact C-N 3.32Å; L333-K335 PolarHBondContact O-N 3.47Å; K335-E338 PolarHBondContact O-N 3.23Å; K335-N339 WeakPolarHBondContact CG-OD1 3.33Å; K335-N339 WeakPolarHBondContact O-CB 3.46Å; K335-N339 PolarHBondContact O-N 3.08Å; K335-N339 PolarHBondContact O-OD1 2.89Å |
| 336 | K | 98.6 | Very high | 98.6 | Very high | 141 Ų | 141 | 98.9 Ų | 98.9 | 61% | 0.613 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.6 | -40.7 | 175.2 | -80.4 | 176.7 | 178.4 | -173.1 | 0 | 112.1 | A332 L333 E334 N339 C340 | A332-K336 WeakPolarHBondContact O-CG 3.43Å; A332-K336 PolarHBondContact O-N 3.38Å; L333-K336 WeakPolarHBondContact O-CB 3.24Å; L333-K336 PolarHBondContact O-N 3.47Å; L333-K336 VanDerWaalsContact O-N 3.08Å; E334-K336 VanDerWaalsContact C-N 3.34Å; E334-K336 PolarHBondContact O-N 2.84Å; K336-N339 PolarHBondContact O-N 3.46Å; K336-C340 WeakPolarHBondContact O-CB 3.47Å; K336-C340 PolarHBondContact O-N 2.71Å; K336-C340 PolarHBondContact O-SG 2.89Å |
| 337 | V | 98.7 | Very high | 98.6 | Very high | 104 Ų | 104 | 96 Ų | 96 | 63% | 0.63 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.2 | -44 | 176 | 172.9 | 0 | 0 | 0 | 0 | 110.7 | L333 E334 C340 S341 | L333-V337 WeakPolarHBondContact O-CG2 3.37Å; L333-V337 PolarHBondContact O-N 3.48Å; E334-V337 PolarHBondContact O-N 3.23Å; E334-V337 VanDerWaalsContact O-N 3.14Å; V337-C340 PolarHBondContact O-N 3.19Å; V337-S341 VanDerWaalsContact O-CB 3.24Å; V337-S341 WeakPolarHBondContact O-CB 3.25Å; V337-S341 PolarHBondContact O-N 3.22Å |
| 338 | E | 98.6 | Very high | 98.6 | Very high | 118 Ų | 118 | 97.8 Ų | 97.8 | 55% | 0.551 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59.5 | -50.1 | 174.1 | -179.6 | 179.5 | -128.3 | 0 | 0 | 111.7 | E334 K335 C340 S341 N342 | E334-E338 PolarHBondContact O-N 3.07Å; K335-E338 PolarHBondContact O-N 3.23Å; E338-C340 PolarHBondContact O-N 3.34Å; E338-S341 WeakPolarHBondContact O-CB 3.31Å; E338-S341 PolarHBondContact O-N 3.45Å; E338-N342 WeakPolarHBondContact O-CB 3.34Å; E338-N342 VanDerWaalsContact O-CG 3.23Å; E338-N342 PolarHBondContact O-N 3.46Å; E338-N342 PolarHBondContact O-ND2 3.48Å |
| 339 | N | 98.5 | Very high | 98.6 | Very high | 90 Ų | 90 | 99.8 Ų | 99.8 | 48% | 0.481 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -55.9 | -49.7 | 176.1 | -89 | 90.7 | 0 | 0 | 0 | 112.2 | K335 K336 S341 N342 E343 | K335-N339 WeakPolarHBondContact CG-OD1 3.33Å; K335-N339 WeakPolarHBondContact O-CB 3.46Å; K335-N339 PolarHBondContact O-N 3.08Å; K335-N339 PolarHBondContact O-OD1 2.89Å; K336-N339 PolarHBondContact O-N 3.46Å; N339-S341 PolarHBondContact O-N 3.11Å; N339-N342 PolarHBondContact O-N 3.2Å; N339-E343 PolarHBondContact O-N 3.07Å |
| 340 | C | 98.4 | Very high | 98.6 | Very high | 79 Ų | 79 | 97.4 Ų | 97.4 | 53% | 0.534 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67.2 | -33.7 | 178.5 | -69 | 0 | 0 | 0 | 0 | 112.9 | K336 V337 E338 N344 | K336-C340 WeakPolarHBondContact O-CB 3.47Å; K336-C340 PolarHBondContact O-N 2.71Å; K336-C340 PolarHBondContact O-SG 2.89Å; V337-C340 PolarHBondContact O-N 3.19Å; E338-C340 PolarHBondContact O-N 3.34Å; C340-N344 VanDerWaalsContact O-CB 3.26Å; C340-N344 WeakPolarHBondContact O-CB 3.36Å; C340-N344 PolarHBondContact O-N 3.33Å |
| 341 | S | 98.6 | Very high | 98.6 | Very high | 74 Ų | 74 | 98.5 Ų | 98.5 | 52% | 0.517 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.7 | -45.8 | 173.5 | -174 | 0 | 0 | 0 | 0 | 111.4 | V337 E338 N339 N344 S345 | V337-S341 VanDerWaalsContact O-CB 3.24Å; V337-S341 WeakPolarHBondContact O-CB 3.25Å; V337-S341 PolarHBondContact O-N 3.22Å; E338-S341 WeakPolarHBondContact O-CB 3.31Å; E338-S341 PolarHBondContact O-N 3.45Å; N339-S341 PolarHBondContact O-N 3.11Å; S341-N344 PolarHBondContact O-N 2.98Å; S341-S345 PolarHBondContact O-N 3.17Å |
| 342 | N | 98.6 | Very high | 98.6 | Very high | 90 Ų | 90 | 101.4 Ų | 101.4 | 48% | 0.481 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.2 | -47 | 177.3 | -71 | -21.4 | 0 | 0 | 0 | 111.5 | E338 N339 N344 S345 E346 | E338-N342 WeakPolarHBondContact O-CB 3.34Å; E338-N342 VanDerWaalsContact O-CG 3.23Å; E338-N342 PolarHBondContact O-N 3.46Å; E338-N342 PolarHBondContact O-ND2 3.48Å; N339-N342 PolarHBondContact O-N 3.2Å; N342-N344 PolarHBondContact O-N 3.41Å; N342-S345 WeakPolarHBondContact O-CB 3.38Å; N342-S345 PolarHBondContact O-N 2.93Å; N342-S345 PolarHBondContact O-OG 3.41Å; N342-E346 PolarHBondContact O-N 3.46Å |
| 343 | E | 98.6 | Very high | 98.6 | Very high | 118 Ų | 118 | 103.7 Ų | 103.7 | 55% | 0.551 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.7 | -44.9 | 175.2 | -174.7 | 178.5 | 179.7 | 0 | 0 | 111.8 | N339 S345 E346 L347 | N339-E343 PolarHBondContact O-N 3.07Å; E343-S345 VanDerWaalsContact C-N 3.32Å; E343-S345 PolarHBondContact O-N 2.9Å; E343-E346 PolarHBondContact O-N 2.99Å; E343-L347 HydrophobicContact CG-CD1 4.18Å; E343-L347 WeakPolarHBondContact O-CG 3.44Å; E343-L347 PolarHBondContact O-N 3.21Å |
| 344 | N | 98.4 | Very high | 98.6 | Very high | 79 Ų | 79 | 106 Ų | 106 | 42% | 0.422 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.8 | -41.2 | 175.8 | -163.2 | -39.9 | 0 | 0 | 0 | 111.4 | C340 S341 N342 E346 L347 R348 | C340-N344 VanDerWaalsContact O-CB 3.26Å; C340-N344 WeakPolarHBondContact O-CB 3.36Å; C340-N344 PolarHBondContact O-N 3.33Å; S341-N344 PolarHBondContact O-N 2.98Å; N342-N344 PolarHBondContact O-N 3.41Å; N344-E346 VanDerWaalsContact C-N 3.34Å; N344-E346 PolarHBondContact O-N 3.31Å; N344-L347 PolarHBondContact O-N 3.44Å; N344-R348 VanDerWaalsContact O-CG 3.29Å; N344-R348 WeakPolarHBondContact O-CG 3.3Å; N344-R348 PolarHBondContact O-N 2.89Å; N344-R348 PolarHBondContact OD1-NE 3.31Å |
| 345 | S | 98.4 | Very high | 98.6 | Very high | 52 Ų | 52 | 105.3 Ų | 105.3 | 36% | 0.364 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.5 | -37.7 | 175.5 | 85.1 | 0 | 0 | 0 | 0 | 112.7 | S341 N342 E343 R349 | S341-S345 PolarHBondContact O-N 3.17Å; N342-S345 WeakPolarHBondContact O-CB 3.38Å; N342-S345 PolarHBondContact O-N 2.93Å; N342-S345 PolarHBondContact O-OG 3.41Å; E343-S345 VanDerWaalsContact C-N 3.32Å; E343-S345 PolarHBondContact O-N 2.9Å; S345-R349 PolarHBondContact O-N 2.86Å |
| 346 | E | 98.5 | Very high | 98.6 | Very high | 88 Ų | 88 | 102.5 Ų | 102.5 | 41% | 0.411 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -71.9 | -40.4 | 178.1 | -159.2 | -163 | 149.7 | 0 | 0 | 111.4 | N342 E343 N344 R349 K350 | N342-E346 PolarHBondContact O-N 3.46Å; E343-E346 PolarHBondContact O-N 2.99Å; N344-E346 VanDerWaalsContact C-N 3.34Å; N344-E346 PolarHBondContact O-N 3.31Å; E346-R349 PolarHBondContact O-N 3.17Å; E346-K350 VanDerWaalsContact CD-NZ 3.35Å; E346-K350 WeakPolarHBondContact O-CG 3.44Å; E346-K350 PolarHBondContact O-N 3.03Å; E346-K350 WeakPolarHBondContact OE1-CE 3.45Å; E346-K350 IonicContact OE1-NZ 3.38Å; E346-K350 PolarHBondContact OE1-NZ 2.94Å |
| 347 | L | 98.7 | Very high | 98.6 | Very high | 87 Ų | 87 | 99.3 Ų | 99.3 | 46% | 0.455 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63 | -42.2 | 173.9 | -70.7 | 172.2 | 0 | 0 | 0 | 111.7 | E343 N344 K350 L351 | E343-L347 HydrophobicContact CG-CD1 4.18Å; E343-L347 WeakPolarHBondContact O-CG 3.44Å; E343-L347 PolarHBondContact O-N 3.21Å; N344-L347 PolarHBondContact O-N 3.44Å; L347-K350 WeakPolarHBondContact O-CB 3.41Å; L347-K350 PolarHBondContact O-N 3.44Å; L347-L351 WeakPolarHBondContact O-CG 3.47Å; L347-L351 PolarHBondContact O-N 3.34Å |
| 348 | R | 98.6 | Very high | 98.5 | Very high | 171 Ų | 171 | 98.7 Ų | 98.7 | 65% | 0.645 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.1 | -45.5 | 173.2 | -73.3 | 174.2 | -170.5 | -144.7 | -1.2 | 112.1 | N344 K350 L351 E352 | N344-R348 VanDerWaalsContact O-CG 3.29Å; N344-R348 WeakPolarHBondContact O-CG 3.3Å; N344-R348 PolarHBondContact O-N 2.89Å; N344-R348 PolarHBondContact OD1-NE 3.31Å; R348-K350 VanDerWaalsContact C-N 3.31Å; R348-K350 PolarHBondContact O-N 3Å; R348-L351 WeakPolarHBondContact O-CB 3.34Å; R348-L351 PolarHBondContact O-N 3.42Å; R348-E352 WeakPolarHBondContact O-CB 3.1Å; R348-E352 PolarHBondContact O-N 3.05Å |
| 349 | R | 98.7 | Very high | 98.5 | Very high | 142 Ų | 142 | 99.2 Ų | 99.2 | 54% | 0.536 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.2 | -37.4 | 175.7 | -164.8 | -170.8 | -55.8 | 136.8 | 7.3 | 112.1 | S345 E346 N353 | S345-R349 PolarHBondContact O-N 2.86Å; E346-R349 PolarHBondContact O-N 3.17Å; R349-N353 WeakPolarHBondContact O-CB 3.49Å; R349-N353 PolarHBondContact O-N 2.62Å; R349-N353 PolarHBondContact O-ND2 2.98Å |
| 350 | K | 98.6 | Very high | 98.5 | Very high | 99 Ų | 99 | 97.8 Ų | 97.8 | 43% | 0.43 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 173.9 | -74.1 | 168.1 | -175.6 | 165.8 | 0 | 111.8 | E346 L347 R348 L354 | E346-K350 VanDerWaalsContact CD-NZ 3.35Å; E346-K350 WeakPolarHBondContact O-CG 3.44Å; E346-K350 PolarHBondContact O-N 3.03Å; E346-K350 WeakPolarHBondContact OE1-CE 3.45Å; E346-K350 IonicContact OE1-NZ 3.38Å; E346-K350 PolarHBondContact OE1-NZ 2.94Å; L347-K350 WeakPolarHBondContact O-CB 3.41Å; L347-K350 PolarHBondContact O-N 3.44Å; R348-K350 VanDerWaalsContact C-N 3.31Å; R348-K350 PolarHBondContact O-N 3Å; K350-L354 WeakPolarHBondContact O-CB 3.39Å; K350-L354 VanDerWaalsContact O-CG 3.26Å; K350-L354 WeakPolarHBondContact O-CG 3.25Å; K350-L354 PolarHBondContact O-N 3.46Å |
| 351 | L | 98.7 | Very high | 98.5 | Very high | 104 Ų | 104 | 98.6 Ų | 98.6 | 55% | 0.545 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.9 | -49.6 | 174.4 | -73.3 | 170.3 | 0 | 0 | 0 | 111.3 | L347 R348 N353 L354 E355 | L347-L351 WeakPolarHBondContact O-CG 3.47Å; L347-L351 PolarHBondContact O-N 3.34Å; R348-L351 WeakPolarHBondContact O-CB 3.34Å; R348-L351 PolarHBondContact O-N 3.42Å; L351-N353 PolarHBondContact O-N 3.35Å; L351-L354 CarbonylContact O-C 3.57Å; L351-L354 PolarHBondContact O-N 2.86Å; L351-L354 VanDerWaalsContact O-N 3.11Å; L351-E355 WeakPolarHBondContact O-CG 3.47Å; L351-E355 PolarHBondContact O-N 3.23Å |
| 352 | E | 98.6 | Very high | 98.5 | Very high | 131 Ų | 131 | 98.9 Ų | 98.9 | 61% | 0.612 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -57.3 | -45.3 | 177.1 | -179.2 | 175.7 | -146.7 | 0 | 0 | 112.3 | R348 L354 E355 C356 | R348-E352 WeakPolarHBondContact O-CB 3.1Å; R348-E352 PolarHBondContact O-N 3.05Å; E352-L354 PolarHBondContact O-N 2.78Å; E352-E355 PolarHBondContact O-N 3.45Å; E352-C356 WeakPolarHBondContact O-CB 3.35Å; E352-C356 PolarHBondContact O-N 2.86Å |
| 353 | N | 98.6 | Very high | 98.5 | Very high | 95 Ų | 95 | 101.3 Ų | 101.3 | 51% | 0.508 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.4 | -43.9 | 174.3 | -74.5 | -11.5 | 0 | 0 | 0 | 112 | R349 L351 C356 T357 | R349-N353 WeakPolarHBondContact O-CB 3.49Å; R349-N353 PolarHBondContact O-N 2.62Å; R349-N353 PolarHBondContact O-ND2 2.98Å; L351-N353 PolarHBondContact O-N 3.35Å; N353-C356 PolarHBondContact O-N 3.36Å; N353-T357 WeakPolarHBondContact O-CG2 3.33Å; N353-T357 PolarHBondContact O-N 2.88Å; N353-T357 PolarHBondContact O-OG1 3.49Å |
| 354 | L | 98.6 | Very high | 98.4 | Very high | 114 Ų | 114 | 101.4 Ų | 101.4 | 60% | 0.597 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.9 | -41.6 | 177.7 | -74.9 | 171.2 | 0 | 0 | 0 | 111.9 | K350 L351 E352 T357 N358 | K350-L354 WeakPolarHBondContact O-CB 3.39Å; K350-L354 VanDerWaalsContact O-CG 3.26Å; K350-L354 WeakPolarHBondContact O-CG 3.25Å; K350-L354 PolarHBondContact O-N 3.46Å; L351-L354 CarbonylContact O-C 3.57Å; L351-L354 PolarHBondContact O-N 2.86Å; L351-L354 VanDerWaalsContact O-N 3.11Å; E352-L354 PolarHBondContact O-N 2.78Å; L354-T357 WeakPolarHBondContact CA-OG1 3.39Å; L354-T357 PolarHBondContact O-N 3.45Å; L354-T357 PolarHBondContact O-OG1 2.93Å; L354-N358 WeakPolarHBondContact O-CB 3.37Å; L354-N358 PolarHBondContact O-N 2.89Å |
| 355 | E | 98.6 | Very high | 98.3 | Very high | 104 Ų | 104 | 103.1 Ų | 103.1 | 49% | 0.486 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.5 | -43.7 | 173 | -74.8 | -177.6 | -152.2 | 0 | 0 | 112 | L351 E352 N358 K359 | L351-E355 WeakPolarHBondContact O-CG 3.47Å; L351-E355 PolarHBondContact O-N 3.23Å; E352-E355 PolarHBondContact O-N 3.45Å; E355-N358 PolarHBondContact O-N 2.91Å; E355-K359 WeakPolarHBondContact O-CB 3.16Å; E355-K359 WeakPolarHBondContact O-CD 3.46Å; E355-K359 WeakPolarHBondContact O-CG 3.45Å; E355-K359 PolarHBondContact O-N 2.97Å; E355-K359 IonicContact OE2-NZ 3.18Å; E355-K359 PolarHBondContact OE2-NZ 3.06Å |
| 356 | C | 98.4 | Very high | 98.2 | Very high | 73 Ų | 73 | 106.4 Ų | 106.4 | 49% | 0.493 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.8 | -46.7 | 177.1 | -176 | 0 | 0 | 0 | 0 | 111.7 | E352 N353 T360 | E352-C356 WeakPolarHBondContact O-CB 3.35Å; E352-C356 PolarHBondContact O-N 2.86Å; N353-C356 PolarHBondContact O-N 3.36Å; C356-T360 WeakPolarHBondContact O-CB 3.43Å; C356-T360 PolarHBondContact O-N 2.85Å; C356-T360 PolarHBondContact O-OG1 3.48Å |
| 357 | T | 98.4 | Very high | 98.1 | Very high | 74 Ų | 74 | 105.8 Ų | 105.8 | 45% | 0.454 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.4 | -39.9 | 175 | 57.1 | 0 | 0 | 0 | 0 | 112.3 | N353 L354 T360 L361 | N353-T357 WeakPolarHBondContact O-CG2 3.33Å; N353-T357 PolarHBondContact O-N 2.88Å; N353-T357 PolarHBondContact O-OG1 3.49Å; L354-T357 WeakPolarHBondContact CA-OG1 3.39Å; L354-T357 PolarHBondContact O-N 3.45Å; L354-T357 PolarHBondContact O-OG1 2.93Å; T357-T360 WeakPolarHBondContact O-CB 3.32Å; T357-T360 PolarHBondContact O-N 2.99Å; T357-L361 WeakPolarHBondContact O-CB 3.33Å; T357-L361 VanDerWaalsContact O-CG 3.3Å; T357-L361 WeakPolarHBondContact O-CG 3.38Å; T357-L361 PolarHBondContact O-N 3.34Å |
| 358 | N | 98.3 | Very high | 97.9 | Very high | 91 Ų | 91 | 106.8 Ų | 106.8 | 49% | 0.487 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.3 | -47.4 | 177.6 | -172.9 | -84.3 | 0 | 0 | 0 | 111.8 | L354 E355 T360 L361 I362 | L354-N358 WeakPolarHBondContact O-CB 3.37Å; L354-N358 PolarHBondContact O-N 2.89Å; E355-N358 PolarHBondContact O-N 2.91Å; N358-T360 VanDerWaalsContact C-N 3.29Å; N358-T360 PolarHBondContact O-N 3.4Å; N358-L361 PolarHBondContact O-N 3.39Å; N358-I362 WeakPolarHBondContact O-CG1 3.44Å; N358-I362 PolarHBondContact O-N 3.16Å; N358-I362 WeakPolarHBondContact OD1-CD1 3.41Å |
| 359 | K | 98.4 | Very high | 97.6 | Very high | 128 Ų | 128 | 104.8 Ų | 104.8 | 56% | 0.557 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -54.5 | -45.2 | 172.2 | -73.1 | 162.7 | -174.5 | 160 | 0 | 111.1 | E355 I362 Q363 | E355-K359 WeakPolarHBondContact O-CB 3.16Å; E355-K359 WeakPolarHBondContact O-CD 3.46Å; E355-K359 WeakPolarHBondContact O-CG 3.45Å; E355-K359 PolarHBondContact O-N 2.97Å; E355-K359 IonicContact OE2-NZ 3.18Å; E355-K359 PolarHBondContact OE2-NZ 3.06Å; K359-I362 PolarHBondContact O-N 3.42Å; K359-Q363 WeakPolarHBondContact O-CB 3.23Å; K359-Q363 PolarHBondContact O-N 2.68Å |
| 360 | T | 98.4 | Very high | 97.2 | Very high | 60 Ų | 60 | 101.3 Ų | 101.3 | 37% | 0.368 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.9 | -45.1 | 177.4 | -55.8 | 0 | 0 | 0 | 0 | 112.2 | C356 T357 N358 Q363 Q364 | C356-T360 WeakPolarHBondContact O-CB 3.43Å; C356-T360 PolarHBondContact O-N 2.85Å; C356-T360 PolarHBondContact O-OG1 3.48Å; T357-T360 WeakPolarHBondContact O-CB 3.32Å; T357-T360 PolarHBondContact O-N 2.99Å; N358-T360 VanDerWaalsContact C-N 3.29Å; N358-T360 PolarHBondContact O-N 3.4Å; T360-Q363 PolarHBondContact O-N 3.33Å; T360-Q364 WeakPolarHBondContact O-CG 3.25Å; T360-Q364 PolarHBondContact O-N 3.18Å |
| 361 | L | 98.4 | Very high | 96.9 | Very high | 97 Ų | 97 | 99.7 Ų | 99.7 | 51% | 0.508 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.4 | -40.8 | 178.2 | -72.3 | 169.1 | 0 | 0 | 0 | 111.9 | T357 N358 Q364 L365 | T357-L361 WeakPolarHBondContact O-CB 3.33Å; T357-L361 VanDerWaalsContact O-CG 3.3Å; T357-L361 WeakPolarHBondContact O-CG 3.38Å; T357-L361 PolarHBondContact O-N 3.34Å; N358-L361 PolarHBondContact O-N 3.39Å; L361-Q364 PolarHBondContact O-N 3.39Å; L361-L365 WeakPolarHBondContact O-CG 3.4Å; L361-L365 PolarHBondContact O-N 3.36Å |
| 362 | I | 98.1 | Very high | 96.4 | Very high | 80 Ų | 80 | 98.3 Ų | 98.3 | 41% | 0.41 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.1 | -45 | 173.2 | -71.7 | 173.3 | 0 | 0 | 0 | 110.3 | N358 K359 Q364 L365 H366 | N358-I362 WeakPolarHBondContact O-CG1 3.44Å; N358-I362 PolarHBondContact O-N 3.16Å; N358-I362 WeakPolarHBondContact OD1-CD1 3.41Å; K359-I362 PolarHBondContact O-N 3.42Å; I362-Q364 VanDerWaalsContact C-N 3.34Å; I362-Q364 PolarHBondContact O-N 3.01Å; I362-L365 PolarHBondContact O-N 3.44Å; I362-H366 PolarHBondContact O-CD2 3.04Å; I362-H366 PolarHBondContact O-N 2.93Å |
| 363 | Q | 97.8 | Very high | 95.5 | Very high | 141 Ų | 141 | 94.6 Ų | 94.6 | 66% | 0.659 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.9 | -40 | 176.5 | -167.4 | 179.8 | 19.5 | 0 | 0 | 112.3 | K359 T360 H366 S367 | K359-Q363 WeakPolarHBondContact O-CB 3.23Å; K359-Q363 PolarHBondContact O-N 2.68Å; T360-Q363 PolarHBondContact O-N 3.33Å; Q363-H366 PolarHBondContact O-N 3.48Å; Q363-S367 WeakPolarHBondContact O-CB 3.5Å; Q363-S367 PolarHBondContact O-N 3.11Å |
| 364 | Q | 97.5 | Very high | 93.9 | Very high | 119 Ų | 119 | 93.3 Ų | 93.3 | 56% | 0.556 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.1 | -41.6 | 173.2 | -73 | 177.5 | -0.3 | 0 | 0 | 112.2 | T360 L361 I362 S367 L368 | T360-Q364 WeakPolarHBondContact O-CG 3.25Å; T360-Q364 PolarHBondContact O-N 3.18Å; L361-Q364 PolarHBondContact O-N 3.39Å; I362-Q364 VanDerWaalsContact C-N 3.34Å; I362-Q364 PolarHBondContact O-N 3.01Å; Q364-S367 PolarHBondContact O-N 2.85Å; Q364-L368 WeakPolarHBondContact O-CB 3.43Å; Q364-L368 PolarHBondContact O-N 3.32Å |
| 365 | L | 97.1 | Very high | 92.2 | Very high | 115 Ų | 115 | 95.8 Ų | 95.8 | 60% | 0.602 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.7 | -44.7 | 175.5 | -74.3 | 172 | 0 | 0 | 0 | 111.9 | L361 I362 S367 L368 Q369 | L361-L365 WeakPolarHBondContact O-CG 3.4Å; L361-L365 PolarHBondContact O-N 3.36Å; I362-L365 PolarHBondContact O-N 3.44Å; L365-S367 PolarHBondContact O-N 3.17Å; L365-L368 PolarHBondContact O-N 3.32Å; L365-Q369 VanDerWaalsContact O-CB 3.31Å; L365-Q369 WeakPolarHBondContact O-CB 3.47Å; L365-Q369 PolarHBondContact O-N 3.14Å |
| 366 | H | 96.5 | Very high | 90 | Very high | 122 Ų | 122 | 95 Ų | 95 | 57% | 0.565 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -61.4 | -42.8 | 174.4 | -85.7 | -79.1 | 0 | 0 | 0 | 112.2 | I362 Q363 Q369 A370 | I362-H366 PolarHBondContact O-CD2 3.04Å; I362-H366 PolarHBondContact O-N 2.93Å; Q363-H366 PolarHBondContact O-N 3.48Å; H366-Q369 PolarHBondContact O-N 3.38Å; H366-A370 WeakPolarHBondContact O-CB 3.48Å; H366-A370 PolarHBondContact O-N 3.08Å |
| 367 | S | 94.8 | Very high | 87.6 | Confident | 74 Ų | 74 | 96 Ų | 96 | 52% | 0.517 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 175.3 | -176.1 | 0 | 0 | 0 | 0 | 111.8 | Q363 Q364 L365 A370 V371 | Q363-S367 WeakPolarHBondContact O-CB 3.5Å; Q363-S367 PolarHBondContact O-N 3.11Å; Q364-S367 PolarHBondContact O-N 2.85Å; L365-S367 PolarHBondContact O-N 3.17Å; S367-A370 PolarHBondContact O-N 3.45Å; S367-V371 WeakPolarHBondContact O-CG2 3.25Å; S367-V371 PolarHBondContact O-N 3.1Å |
| 368 | L | 95.1 | Very high | 85.3 | Confident | 108 Ų | 108 | 103.4 Ų | 103.4 | 57% | 0.565 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.2 | -43.1 | 176.6 | -167.7 | 72.2 | 0 | 0 | 0 | 111.6 | Q364 L365 A370 V371 V372 | Q364-L368 WeakPolarHBondContact O-CB 3.43Å; Q364-L368 PolarHBondContact O-N 3.32Å; L365-L368 PolarHBondContact O-N 3.32Å; L368-A370 VanDerWaalsContact C-N 3.33Å; L368-A370 PolarHBondContact O-N 3.17Å; L368-V371 PolarHBondContact O-N 3.38Å; L368-V372 HydrophobicContact CG-CG2 4.47Å; L368-V372 WeakPolarHBondContact O-CB 3.39Å; L368-V372 WeakPolarHBondContact O-CG2 3.3Å; L368-V372 PolarHBondContact O-N 3.44Å |
| 369 | Q | 92.9 | Very high | 83 | Confident | 130 Ų | 130 | 103.9 Ų | 103.9 | 61% | 0.607 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -61.2 | -40.9 | 176.4 | -175.8 | 178.4 | -3.2 | 0 | 0 | 111.4 | L365 H366 V372 A373 | L365-Q369 VanDerWaalsContact O-CB 3.31Å; L365-Q369 WeakPolarHBondContact O-CB 3.47Å; L365-Q369 PolarHBondContact O-N 3.14Å; H366-Q369 PolarHBondContact O-N 3.38Å; Q369-V372 PolarHBondContact O-N 3.41Å; Q369-A373 WeakPolarHBondContact O-CB 3.34Å; Q369-A373 PolarHBondContact O-N 3.37Å |
| 370 | A | 90.8 | Very high | 80.3 | Confident | 68 Ų | 68 | 103.1 Ų | 103.1 | 56% | 0.562 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -62.6 | -44.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | H366 S367 L368 V372 G374 | H366-A370 WeakPolarHBondContact O-CB 3.48Å; H366-A370 PolarHBondContact O-N 3.08Å; S367-A370 PolarHBondContact O-N 3.45Å; L368-A370 VanDerWaalsContact C-N 3.33Å; L368-A370 PolarHBondContact O-N 3.17Å; A370-V372 PolarHBondContact O-N 3.43Å; A370-G374 PolarHBondContact O-N 3.13Å |
| 371 | V | 91 | Very high | 77.6 | Confident | 66 Ų | 66 | 108.7 Ų | 108.7 | 40% | 0.4 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.6 | -37.7 | 177.8 | 172.9 | 0 | 0 | 0 | 0 | 112.2 | S367 L368 K375 | S367-V371 WeakPolarHBondContact O-CG2 3.25Å; S367-V371 PolarHBondContact O-N 3.1Å; L368-V371 PolarHBondContact O-N 3.38Å; V371-K375 HydrophobicContact CG1-CD 3.98Å; V371-K375 WeakPolarHBondContact O-CB 3.46Å; V371-K375 WeakPolarHBondContact O-CD 3.29Å; V371-K375 VanDerWaalsContact O-CG 3.29Å; V371-K375 WeakPolarHBondContact O-CG 3.42Å; V371-K375 PolarHBondContact O-N 3.39Å |
| 372 | V | 88.4 | Confident | 75.1 | Confident | 75 Ų | 75 | 110 Ų | 110 | 46% | 0.455 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -74 | -44.8 | 177.1 | 173.1 | 0 | 0 | 0 | 0 | 110.9 | L368 Q369 A370 G374 K375 V376 | L368-V372 HydrophobicContact CG-CG2 4.47Å; L368-V372 WeakPolarHBondContact O-CB 3.39Å; L368-V372 WeakPolarHBondContact O-CG2 3.3Å; L368-V372 PolarHBondContact O-N 3.44Å; Q369-V372 PolarHBondContact O-N 3.41Å; A370-V372 PolarHBondContact O-N 3.43Å; V372-G374 PolarHBondContact O-N 3.31Å; V372-K375 PolarHBondContact O-N 3.35Å; V372-V376 HydrophobicContact CG1-CG2 3.89Å; V372-V376 WeakPolarHBondContact O-CG2 3.43Å; V372-V376 PolarHBondContact O-N 3.37Å |
| 373 | A | 79.4 | Confident | 72.7 | Confident | 52 Ų | 52 | 110.8 Ų | 110.8 | 43% | 0.43 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -63.6 | -26.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q369 | Q369-A373 WeakPolarHBondContact O-CB 3.34Å; Q369-A373 PolarHBondContact O-N 3.37Å |
| 374 | G | 66.1 | Low | 70.7 | Confident | 68 Ų | 68 | 107.7 Ų | 107.7 | 70% | 0.701 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -80.9 | -17.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 115 | A370 V372 | A370-G374 PolarHBondContact O-N 3.13Å; V372-G374 PolarHBondContact O-N 3.31Å |
| 375 | K | 61.2 | Low | 68.4 | Low | 166 Ų | 166 | 107.5 Ų | 107.5 | 72% | 0.722 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -107.7 | -20.2 | -176.7 | -74.4 | 174.3 | -178.5 | 170.5 | 0 | 114.4 | V371 V372 P377 | V371-K375 HydrophobicContact CG1-CD 3.98Å; V371-K375 WeakPolarHBondContact O-CB 3.46Å; V371-K375 WeakPolarHBondContact O-CD 3.29Å; V371-K375 VanDerWaalsContact O-CG 3.29Å; V371-K375 WeakPolarHBondContact O-CG 3.42Å; V371-K375 PolarHBondContact O-N 3.39Å; V372-K375 PolarHBondContact O-N 3.35Å; K375-P377 WeakPolarHBondContact O-CD 3.4Å |
| 376 | V | 52.4 | Low | 66.4 | Low | 89 Ų | 89 | 108.6 Ų | 108.6 | 54% | 0.539 | 63% | 0.63 | S | S | . | * | S | Bend | trans | -88.5 | 111.4 | 170.3 | -178.2 | 0 | 0 | 0 | 0 | 108 | V372 R378 | V372-V376 HydrophobicContact CG1-CG2 3.89Å; V372-V376 WeakPolarHBondContact O-CG2 3.43Å; V372-V376 PolarHBondContact O-N 3.37Å; V376-R378 PolarHBondContact O-N 2.68Å |
| 377 | P | 49.2 | Very low | 64.3 | Low | 92 Ų | 92 | 108 Ų | 108 | 60% | 0.597 | 64% | 0.635 | S | S | * | * | trans | -59.5 | 136.4 | 170.9 | 25.7 | -32.8 | 0 | 0 | 0 | 108.8 | K375 S379 | K375-P377 WeakPolarHBondContact O-CD 3.4Å; P377-S379 PolarHBondContact O-N 3.48Å | ||
| 378 | R | 50 | Low | 62.9 | Low | 231 Ų | 231 | 107.8 Ų | 107.8 | 87% | 0.872 | 63% | 0.634 | S | S | * | * | trans | -71.5 | 58.1 | 170.3 | -72.1 | -173 | 178.7 | 87.4 | -7.7 | 110.8 | V376 | V376-R378 PolarHBondContact O-N 2.68Š| ||
| 379 | S | 49.4 | Very low | 61.8 | Low | 101 Ų | 101 | 104.9 Ų | 104.9 | 71% | 0.706 | 62% | 0.623 | S | S | * | * | trans | -95 | 14.7 | 177.3 | 60.5 | 0 | 0 | 0 | 0 | 113 | P377 K381 | P377-S379 PolarHBondContact O-N 3.48Å; S379-K381 VanDerWaalsContact C-N 3.32Å | ||
| 380 | C | 43.1 | Very low | 60.7 | Low | 112 Ų | 112 | 102.7 Ų | 102.7 | 76% | 0.757 | 62% | 0.621 | S | S | * | * | trans | -96.9 | 60.8 | 158.4 | -160.9 | 0 | 0 | 0 | 0 | 109.9 | V382 | C380-V382 PolarHBondContact O-N 2.99Š| ||
| 381 | K | 40.1 | Very low | 60.4 | Low | 177 Ų | 177 | 104.7 Ų | 104.7 | 77% | 0.77 | 62% | 0.621 | S | S | * | * | trans | -62.7 | 118.1 | 151.3 | 171.3 | 171.5 | 173.6 | 171.8 | 0 | 105.4 | S379 T383 | S379-K381 VanDerWaalsContact C-N 3.32Å; K381-T383 PolarHBondContact O-N 3.15Å | ||
| 382 | V | 47.5 | Very low | 59.9 | Low | 123 Ų | 123 | 107.8 Ų | 107.8 | 75% | 0.745 | 63% | 0.633 | S | S | * | * | trans | -66.2 | 84.1 | 173.6 | 177.2 | 0 | 0 | 0 | 0 | 108.5 | C380 G384 | C380-V382 PolarHBondContact O-N 2.99Å; V382-G384 PolarHBondContact O-N 2.86Å | ||
| 383 | T | 47.6 | Very low | 59.7 | Low | 98 Ų | 98 | 108.5 Ų | 108.5 | 60% | 0.601 | 64% | 0.637 | S | S | * | * | trans | -70.7 | 115.6 | 152.8 | -62.4 | 0 | 0 | 0 | 0 | 105.3 | K381 T385 | K381-T383 PolarHBondContact O-N 3.15Å; T383-T385 VanDerWaalsContact C-N 3.34Å; T383-T385 HydrophobicContact CG2-CG2 4.46Å; T383-T385 PolarHBondContact O-N 2.83Å | ||
| 384 | G | 53.8 | Low | 60.1 | Low | 75 Ų | 75 | 109.3 Ų | 109.3 | 77% | 0.773 | 64% | 0.637 | S | S | * | * | trans | -67.7 | 81.8 | -169 | 0 | 0 | 0 | 0 | 0 | 113.9 | V382 | V382-G384 PolarHBondContact O-N 2.86Š| ||
| 385 | T | 49.8 | Very low | 61.2 | Low | 115 Ų | 115 | 110.6 Ų | 110.6 | 71% | 0.706 | 63% | 0.631 | S | S | * | * | trans | -112.5 | 92.1 | 173.8 | 55.2 | 0 | 0 | 0 | 0 | 111.2 | T383 T387 | T383-T385 VanDerWaalsContact C-N 3.34Å; T383-T385 HydrophobicContact CG2-CG2 4.46Å; T383-T385 PolarHBondContact O-N 2.83Å; T385-T387 PolarHBondContact O-N 3.13Å | ||
| 386 | Q | 55.3 | Low | 62.3 | Low | 139 Ų | 139 | 107.9 Ų | 107.9 | 65% | 0.65 | 62% | 0.624 | S | S | * | * | trans | 62.7 | 42.2 | 147.1 | -138 | -174.2 | 39.6 | 0 | 0 | 118.6 | S388 S389 | Q386-S388 WeakPolarHBondContact CG-OG 3.42Å; Q386-S388 PolarHBondContact O-N 2.92Å; Q386-S388 VanDerWaalsContact O-N 3.08Å; Q386-S389 VanDerWaalsContact CG-OG 3.25Å; Q386-S389 WeakPolarHBondContact CG-OG 3.44Å; Q386-S389 PolarHBondContact O-N 3Å; Q386-S389 PolarHBondContact OE1-OG 3.18Å | ||
| 387 | T | 52.8 | Low | 63.9 | Low | 108 Ų | 108 | 107.6 Ų | 107.6 | 66% | 0.663 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -53.3 | -25.9 | 163.6 | -35.9 | 0 | 0 | 0 | 0 | 112.4 | T385 S389 C390 L391 | T385-T387 PolarHBondContact O-N 3.13Å; T387-S389 VanDerWaalsContact C-N 3.26Å; T387-S389 PolarHBondContact O-N 2.98Å; T387-C390 PolarHBondContact O-N 3.05Å; T387-L391 PolarHBondContact O-N 3.45Å |
| 388 | S | 64.3 | Low | 65.6 | Low | 70 Ų | 70 | 109.6 Ų | 109.6 | 49% | 0.49 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -55.3 | -34.1 | 171.3 | 51.7 | 0 | 0 | 0 | 0 | 113.6 | Q386 L391 M392 | Q386-S388 WeakPolarHBondContact CG-OG 3.42Å; Q386-S388 PolarHBondContact O-N 2.92Å; Q386-S388 VanDerWaalsContact O-N 3.08Å; S388-L391 PolarHBondContact O-N 3.24Å; S388-M392 VanDerWaalsContact O-CB 3.25Å; S388-M392 WeakPolarHBondContact O-CB 3.27Å; S388-M392 WeakPolarHBondContact O-CG 3.33Å; S388-M392 PolarHBondContact O-N 2.9Å |
| 389 | S | 72.6 | Confident | 67.2 | Low | 47 Ų | 47 | 101.4 Ų | 101.4 | 33% | 0.329 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -66.8 | -40.3 | 178.1 | -71.6 | 0 | 0 | 0 | 0 | 112.6 | Q386 T387 M392 V393 | Q386-S389 VanDerWaalsContact CG-OG 3.25Å; Q386-S389 WeakPolarHBondContact CG-OG 3.44Å; Q386-S389 PolarHBondContact O-N 3Å; Q386-S389 PolarHBondContact OE1-OG 3.18Å; T387-S389 VanDerWaalsContact C-N 3.26Å; T387-S389 PolarHBondContact O-N 2.98Å; S389-M392 PolarHBondContact O-N 3.31Å; S389-V393 WeakPolarHBondContact O-CG2 3.48Å; S389-V393 PolarHBondContact O-N 2.85Å |
| 390 | C | 69.5 | Low | 68.8 | Low | 84 Ų | 84 | 100.8 Ų | 100.8 | 57% | 0.568 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.3 | -44.8 | 176.9 | -177 | 0 | 0 | 0 | 0 | 110.9 | T387 M392 V393 V394 | T387-C390 PolarHBondContact O-N 3.05Å; C390-M392 PolarHBondContact O-N 2.98Å; C390-V393 PolarHBondContact O-N 3.37Å; C390-V394 WeakPolarHBondContact O-CG2 3.36Å; C390-V394 PolarHBondContact O-N 3.02Å |
| 391 | L | 84.6 | Confident | 70.7 | Confident | 110 Ų | 110 | 101.7 Ų | 101.7 | 58% | 0.576 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -63.1 | -40.3 | 175.3 | -63.8 | 175.7 | 0 | 0 | 0 | 112 | T387 S388 V393 V394 V395 | T387-L391 PolarHBondContact O-N 3.45Å; S388-L391 PolarHBondContact O-N 3.24Å; L391-V393 PolarHBondContact O-N 2.87Å; L391-V394 PolarHBondContact O-N 3.05Å; L391-V395 WeakPolarHBondContact O-CB 3.46Å; L391-V395 VanDerWaalsContact O-CG2 3.3Å; L391-V395 WeakPolarHBondContact O-CG2 3.41Å; L391-V395 PolarHBondContact O-N 2.96Å |
| 392 | M | 80.6 | Confident | 72.6 | Confident | 132 Ų | 132 | 98.1 Ų | 98.1 | 65% | 0.65 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.8 | -39.4 | 174.1 | -75.7 | -76.2 | -72.6 | 0 | 0 | 112.2 | S388 S389 C390 L396 | S388-M392 VanDerWaalsContact O-CB 3.25Å; S388-M392 WeakPolarHBondContact O-CB 3.27Å; S388-M392 WeakPolarHBondContact O-CG 3.33Å; S388-M392 PolarHBondContact O-N 2.9Å; S389-M392 PolarHBondContact O-N 3.31Å; C390-M392 PolarHBondContact O-N 2.98Å; M392-L396 WeakPolarHBondContact O-CB 3.38Å; M392-L396 PolarHBondContact O-N 3.11Å |
| 393 | V | 85.3 | Confident | 73.7 | Confident | 89 Ų | 89 | 94.6 Ų | 94.6 | 54% | 0.539 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66.4 | -41.9 | 175 | 169.8 | 0 | 0 | 0 | 0 | 111.3 | S389 C390 L391 L396 C397 | S389-V393 WeakPolarHBondContact O-CG2 3.48Å; S389-V393 PolarHBondContact O-N 2.85Å; C390-V393 PolarHBondContact O-N 3.37Å; L391-V393 PolarHBondContact O-N 2.87Å; V393-L396 PolarHBondContact O-N 3.01Å; V393-C397 PolarHBondContact O-N 3.34Å; V393-C397 PolarHBondContact O-SG 3.44Å |
| 394 | V | 87.6 | Confident | 74.7 | Confident | 70 Ų | 70 | 94 Ų | 94 | 42% | 0.424 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.4 | -47.4 | 175.5 | 173.6 | 0 | 0 | 0 | 0 | 111 | C390 L391 L396 C397 F398 | C390-V394 WeakPolarHBondContact O-CG2 3.36Å; C390-V394 PolarHBondContact O-N 3.02Å; L391-V394 PolarHBondContact O-N 3.05Å; V394-L396 VanDerWaalsContact C-N 3.33Å; V394-L396 PolarHBondContact O-N 2.88Å; V394-C397 WeakPolarHBondContact O-CB 3.38Å; V394-C397 PolarHBondContact O-N 3.01Å; V394-F398 HydrophobicContact CG1-CD2 3.9Å; V394-F398 HydrophobicContact CG1-CE2 3.85Å; V394-F398 WeakPolarHBondContact O-CD2 3.42Å; V394-F398 PolarHBondContact O-N 2.88Å |
| 395 | V | 88.1 | Confident | 75.2 | Confident | 95 Ų | 95 | 96.8 Ų | 96.8 | 58% | 0.576 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -61.2 | -40.7 | 176.3 | 170.4 | 0 | 0 | 0 | 0 | 111.4 | L391 F398 A399 | L391-V395 WeakPolarHBondContact O-CB 3.46Å; L391-V395 VanDerWaalsContact O-CG2 3.3Å; L391-V395 WeakPolarHBondContact O-CG2 3.41Å; L391-V395 PolarHBondContact O-N 2.96Å; V395-F398 PolarHBondContact O-N 2.91Å; V395-A399 WeakPolarHBondContact O-CB 3.47Å; V395-A399 PolarHBondContact O-N 3.21Å |
| 396 | L | 84.6 | Confident | 75.9 | Confident | 109 Ų | 109 | 100.4 Ų | 100.4 | 57% | 0.571 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -64.4 | -41 | 175.2 | -177.1 | 64 | 0 | 0 | 0 | 111.9 | M392 V393 V394 A399 V400 | M392-L396 WeakPolarHBondContact O-CB 3.38Å; M392-L396 PolarHBondContact O-N 3.11Å; V393-L396 PolarHBondContact O-N 3.01Å; V394-L396 VanDerWaalsContact C-N 3.33Å; V394-L396 PolarHBondContact O-N 2.88Å; L396-A399 PolarHBondContact O-N 3.44Å; L396-V400 HydrophobicContact CD1-CG2 4.21Å; L396-V400 HydrophobicContact CG-CG2 4.46Å; L396-V400 WeakPolarHBondContact O-CB 3.35Å; L396-V400 WeakPolarHBondContact O-CG2 3.44Å; L396-V400 PolarHBondContact O-N 2.93Å |
| 397 | C | 86.1 | Confident | 75.9 | Confident | 83 Ų | 83 | 99.6 Ų | 99.6 | 56% | 0.561 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -59.8 | -45.5 | 172.7 | -78.9 | 0 | 0 | 0 | 0 | 111.8 | V393 V394 F401 | V393-C397 PolarHBondContact O-N 3.34Å; V393-C397 PolarHBondContact O-SG 3.44Å; V394-C397 WeakPolarHBondContact O-CB 3.38Å; V394-C397 PolarHBondContact O-N 3.01Å; C397-F401 VanDerWaalsContact O-CB 3.25Å; C397-F401 WeakPolarHBondContact O-CB 3.43Å; C397-F401 PolarHBondContact O-N 3.06Å |
| 398 | F | 84.9 | Confident | 75.9 | Confident | 134 Ų | 134 | 99.3 Ų | 99.3 | 59% | 0.588 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -63.7 | -41 | 175 | -84.9 | -75.4 | 0 | 0 | 0 | 112.6 | V394 V395 F401 L402 | V394-F398 HydrophobicContact CG1-CD2 3.9Å; V394-F398 HydrophobicContact CG1-CE2 3.85Å; V394-F398 WeakPolarHBondContact O-CD2 3.42Å; V394-F398 PolarHBondContact O-N 2.88Å; V395-F398 PolarHBondContact O-N 2.91Å; F398-F401 PolarHBondContact O-N 3.45Å; F398-L402 WeakPolarHBondContact O-CB 3.25Å; F398-L402 WeakPolarHBondContact O-CG 3.46Å; F398-L402 PolarHBondContact O-N 3.38Å |
| 399 | A | 82.9 | Confident | 75.2 | Confident | 58 Ų | 58 | 104.2 Ų | 104.2 | 48% | 0.479 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -66.7 | -41.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | V395 L396 G403 | V395-A399 WeakPolarHBondContact O-CB 3.47Å; V395-A399 PolarHBondContact O-N 3.21Å; L396-A399 PolarHBondContact O-N 3.44Å; A399-G403 WeakPolarHBondContact O-CA 3.48Å; A399-G403 PolarHBondContact O-N 2.86Å |
| 400 | V | 82.8 | Confident | 73.8 | Confident | 89 Ų | 89 | 105.5 Ų | 105.5 | 54% | 0.539 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -68 | -39.3 | 175.3 | 172.1 | 0 | 0 | 0 | 0 | 110.9 | L396 S404 | L396-V400 HydrophobicContact CD1-CG2 4.21Å; L396-V400 HydrophobicContact CG-CG2 4.46Å; L396-V400 WeakPolarHBondContact O-CB 3.35Å; L396-V400 WeakPolarHBondContact O-CG2 3.44Å; L396-V400 PolarHBondContact O-N 2.93Å; V400-S404 VanDerWaalsContact O-CB 3.31Å; V400-S404 WeakPolarHBondContact O-CB 3.43Å; V400-S404 PolarHBondContact O-N 2.98Å; V400-S404 PolarHBondContact O-OG 3.25Å |
| 401 | F | 84.6 | Confident | 72.6 | Confident | 130 Ų | 130 | 107.3 Ų | 107.3 | 57% | 0.57 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -62.4 | -60 | 175.9 | -164.2 | -102.4 | 0 | 0 | 0 | 110.5 | C397 F398 G403 S404 F405 | C397-F401 VanDerWaalsContact O-CB 3.25Å; C397-F401 WeakPolarHBondContact O-CB 3.43Å; C397-F401 PolarHBondContact O-N 3.06Å; F398-F401 PolarHBondContact O-N 3.45Å; F401-G403 PolarHBondContact O-N 2.75Å; F401-S404 WeakPolarHBondContact O-CB 3.13Å; F401-S404 PolarHBondContact O-N 3.47Å; F401-S404 VanDerWaalsContact O-N 3.1Å; F401-F405 HydrophobicContact CD1-CD2 4.04Å; F401-F405 AromaticContact CD1-CE2 3.68Å; F401-F405 HydrophobicContact CD1-CE2 3.68Å; F401-F405 AromaticContact CD2-CE2 4Å; F401-F405 HydrophobicContact CD2-CE2 4Å; F401-F405 HydrophobicContact CE1-CD2 4.12Å; F401-F405 AromaticContact CE1-CE2 3.46Å; F401-F405 HydrophobicContact CE1-CE2 3.46Å; F401-F405 VanDerWaalsContact CE1-CE2 3.46Å; F401-F405 HydrophobicContact CE1-CZ 4.3Å; F401-F405 AromaticContact CE2-CE2 3.79Å; F401-F405 HydrophobicContact CE2-CE2 3.79Å; F401-F405 HydrophobicContact CE2-CZ 4.32Å; F401-F405 HydrophobicContact CG-CD2 4.43Å; F401-F405 AromaticContact CG-CE2 3.95Å; F401-F405 HydrophobicContact CG-CE2 3.95Å; F401-F405 AromaticContact CZ-CE2 3.52Å; F401-F405 HydrophobicContact CZ-CE2 3.52Å; F401-F405 HydrophobicContact CZ-CZ 4.02Å; F401-F405 WeakPolarHBondContact O-CD2 3.42Å; F401-F405 PolarHBondContact O-N 3.19Å |
| 402 | L | 79.1 | Confident | 70.1 | Confident | 103 Ų | 103 | 108 Ų | 108 | 54% | 0.539 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -61.8 | -40.1 | -179.1 | -67.9 | 169.1 | 0 | 0 | 0 | 112.9 | F398 S404 F405 Y406 | F398-L402 WeakPolarHBondContact O-CB 3.25Å; F398-L402 WeakPolarHBondContact O-CG 3.46Å; F398-L402 PolarHBondContact O-N 3.38Å; L402-S404 VanDerWaalsContact C-N 3.28Å; L402-S404 PolarHBondContact O-N 2.63Å; L402-F405 PolarHBondContact O-N 3.18Å; L402-Y406 PolarHBondContact O-N 3.03Å |
| 403 | G | 70.6 | Confident | 67.8 | Low | 49 Ų | 49 | 107.5 Ų | 107.5 | 51% | 0.505 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -64.5 | -29.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | A399 F401 | A399-G403 WeakPolarHBondContact O-CA 3.48Å; A399-G403 PolarHBondContact O-N 2.86Å; F401-G403 PolarHBondContact O-N 2.75Å |
| 404 | S | 67.9 | Low | 65.2 | Low | 85 Ų | 85 | 108.5 Ų | 108.5 | 59% | 0.594 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -75.7 | -23.6 | 174.7 | -58.9 | 0 | 0 | 0 | 0 | 113.1 | V400 F401 L402 | V400-S404 VanDerWaalsContact O-CB 3.31Å; V400-S404 WeakPolarHBondContact O-CB 3.43Å; V400-S404 PolarHBondContact O-N 2.98Å; V400-S404 PolarHBondContact O-OG 3.25Å; F401-S404 WeakPolarHBondContact O-CB 3.13Å; F401-S404 PolarHBondContact O-N 3.47Å; F401-S404 VanDerWaalsContact O-N 3.1Å; L402-S404 VanDerWaalsContact C-N 3.28Å; L402-S404 PolarHBondContact O-N 2.63Å |
| 405 | F | 65.2 | Low | 62.7 | Low | 134 Ų | 134 | 112 Ų | 112 | 59% | 0.588 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -84.2 | -10.9 | 176.2 | -73.2 | -72.4 | 0 | 0 | 0 | 114 | F401 L402 P407 | F401-F405 HydrophobicContact CD1-CD2 4.04Å; F401-F405 AromaticContact CD1-CE2 3.68Å; F401-F405 HydrophobicContact CD1-CE2 3.68Å; F401-F405 AromaticContact CD2-CE2 4Å; F401-F405 HydrophobicContact CD2-CE2 4Å; F401-F405 HydrophobicContact CE1-CD2 4.12Å; F401-F405 AromaticContact CE1-CE2 3.46Å; F401-F405 HydrophobicContact CE1-CE2 3.46Å; F401-F405 VanDerWaalsContact CE1-CE2 3.46Å; F401-F405 HydrophobicContact CE1-CZ 4.3Å; F401-F405 AromaticContact CE2-CE2 3.79Å; F401-F405 HydrophobicContact CE2-CE2 3.79Å; F401-F405 HydrophobicContact CE2-CZ 4.32Å; F401-F405 HydrophobicContact CG-CD2 4.43Å; F401-F405 AromaticContact CG-CE2 3.95Å; F401-F405 HydrophobicContact CG-CE2 3.95Å; F401-F405 AromaticContact CZ-CE2 3.52Å; F401-F405 HydrophobicContact CZ-CE2 3.52Å; F401-F405 HydrophobicContact CZ-CZ 4.02Å; F401-F405 WeakPolarHBondContact O-CD2 3.42Å; F401-F405 PolarHBondContact O-N 3.19Å; L402-F405 PolarHBondContact O-N 3.18Å; F405-P407 VanDerWaalsContact C-CD 3.41Å; F405-P407 WeakPolarHBondContact O-CD 3.34Å |
| 406 | Y | 63.8 | Low | 60.1 | Low | 191 Ų | 191 | 113.2 Ų | 113.2 | 75% | 0.749 | 68% | 0.675 | S | S | * | * | trans | -121.1 | 67.8 | 176.4 | -75 | -85.3 | 0 | 0 | 0 | 113.3 | L402 S408 | L402-Y406 PolarHBondContact O-N 3.03Å; Y406-S408 PolarHBondContact O-N 2.88Å | ||
| 407 | P | 55.2 | Low | 57.6 | Low | 121 Ų | 121 | 115.5 Ų | 115.5 | 79% | 0.786 | 68% | 0.683 | S | S | * | * | trans | -79.5 | 51.5 | 177 | 36.7 | -37.9 | 0 | 0 | 0 | 112.1 | F405 | F405-P407 VanDerWaalsContact C-CD 3.41Å; F405-P407 WeakPolarHBondContact O-CD 3.34Å | ||
| 408 | S | 53.2 | Low | 55 | Low | 102 Ų | 102 | 117.8 Ų | 117.8 | 71% | 0.713 | 69% | 0.694 | S | S | * | * | trans | -151.2 | 38 | -176.1 | -169.1 | 0 | 0 | 0 | 0 | 116.3 | Y406 | Y406-S408 PolarHBondContact O-N 2.88Š| ||
| 409 | L | 51 | Low | 52.5 | Low | 174 Ų | 174 | 114.2 Ų | 114.2 | 91% | 0.911 | 70% | 0.696 | S | S | * | * | trans | -146.5 | 85.3 | 152.3 | -78.5 | -173.1 | 0 | 0 | 0 | 109.7 | ||||
| 410 | G | 42.1 | Very low | 50 | Low | 73 Ų | 73 | 119.9 Ų | 119.9 | 75% | 0.753 | 72% | 0.717 | S | S | * | * | trans | -77.3 | 156.2 | 166 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 411 | P | 43.9 | Very low | 47.4 | Very low | 123 Ų | 123 | 120.8 Ų | 120.8 | 80% | 0.799 | 73% | 0.727 | S | S | * | * | -132.6 | 127.5 | 117.9 | 10.6 | 10.4 | 0 | 0 | 0 | 114.4 | |||||
| 412 | C | 33 | Very low | 44.9 | Very low | 125 Ų | 125 | 124.4 Ų | 124.4 | 85% | 0.845 | 74% | 0.737 | S | S | * | * | trans | 27.4 | 114.1 | 145.1 | -57.3 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 413 | S | 32.7 | Very low | 42.4 | Very low | 120 Ų | 120 | 124.5 Ų | 124.5 | 84% | 0.839 | 74% | 0.738 | S | S | * | * | -174.5 | 107.7 | 122.1 | -77.8 | 0 | 0 | 0 | 0 | 108.7 | |||||
| 414 | S | 30.4 | Very low | 40.5 | Very low | 110 Ų | 110 | 130.6 Ų | 130.6 | 77% | 0.769 | 76% | 0.756 | S | S | * | * | 62.9 | 104.6 | 86.8 | 178.4 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 415 | I | 35.2 | Very low | 38.6 | Very low | 145 Ų | 145 | 130.9 Ų | 130.9 | 74% | 0.744 | 76% | 0.763 | S | S | * | * | 161.7 | 131.2 | 115 | -158.1 | 159.6 | 0 | 0 | 0 | 112.5 | |||||
| 416 | T | 32.5 | Very low | 36.8 | Very low | 120 Ų | 120 | 132.5 Ų | 132.5 | 74% | 0.736 | 78% | 0.775 | S | S | * | * | trans | 50 | 148.9 | 153.6 | 51.8 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 417 | E | 31.9 | Very low | 35 | Very low | 157 Ų | 157 | 130.7 Ų | 130.7 | 73% | 0.734 | 77% | 0.773 | S | S | * | * | cis | -174.5 | 158.3 | -14.6 | -163.4 | -163.4 | 145.9 | 0 | 0 | 108.2 | ||||
| 418 | T | 32.6 | Very low | 33.9 | Very low | 130 Ų | 130 | 133.2 Ų | 133.2 | 80% | 0.798 | 77% | 0.774 | S | S | * | * | trans | 65.3 | 154.7 | 168.1 | 74.9 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 419 | G | 31.1 | Very low | 33.3 | Very low | 60 Ų | 60 | 132.4 Ų | 132.4 | 62% | 0.619 | 77% | 0.769 | S | S | * | * | cis | 152.2 | 124.6 | -9.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 420 | L | 31.2 | Very low | 32.4 | Very low | 176 Ų | 176 | 134.3 Ų | 134.3 | 92% | 0.921 | 77% | 0.765 | S | S | * | * | trans | 65.1 | 136.2 | 176.8 | -61.7 | 121.1 | 0 | 0 | 0 | 116.7 | ||||
| 421 | S | 27.3 | Very low | 32.1 | Very low | 108 Ų | 108 | 137.5 Ų | 137.5 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | cis | 101 | 115.2 | 19.2 | -168.6 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 422 | R | 32.6 | Very low | 31.4 | Very low | 206 Ų | 206 | 135.5 Ų | 135.5 | 78% | 0.777 | 76% | 0.764 | S | S | * | * | 136.5 | 131.8 | 124.1 | -167.3 | 164.2 | -174 | 104.8 | 27.2 | 118 | |||||
| 423 | D | 28.1 | Very low | 31.6 | Very low | 105 Ų | 105 | 136.7 Ų | 136.7 | 56% | 0.561 | 77% | 0.768 | S | S | * | * | trans | 51.9 | 124.4 | 154.7 | -65 | -2.8 | 0 | 0 | 0 | 121.2 | ||||
| 424 | M | 30.2 | Very low | 31.6 | Very low | 178 Ų | 178 | 137.3 Ų | 137.3 | 88% | 0.877 | 77% | 0.766 | S | S | * | * | 91.5 | 116.8 | 56.4 | -80.1 | -154.8 | 76.1 | 0 | 0 | 115 | |||||
| 425 | A | 28.2 | Very low | 32 | Very low | 91 Ų | 91 | 141.9 Ų | 141.9 | 75% | 0.752 | 77% | 0.772 | S | S | * | * | trans | -175.5 | 119.4 | 151.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 426 | M | 27.2 | Very low | 32.5 | Very low | 168 Ų | 168 | 139 Ų | 139 | 83% | 0.828 | 76% | 0.764 | S | S | * | * | 88.6 | 132.1 | 85.6 | -164.7 | -178.5 | -173.7 | 0 | 0 | 111.8 | |||||
| 427 | Q | 25.5 | Very low | 33.1 | Very low | 153 Ų | 153 | 144.5 Ų | 144.5 | 72% | 0.715 | 77% | 0.772 | S | S | * | * | cis | -168.9 | 159 | -7.9 | 164.5 | 174.5 | -18.8 | 0 | 0 | 110 | ||||
| 428 | E | 31 | Very low | 33 | Very low | 173 Ų | 173 | 143 Ų | 143 | 81% | 0.808 | 78% | 0.779 | S | S | * | * | trans | -80.4 | 168.4 | 178.1 | -59.6 | -176.9 | 125.9 | 0 | 0 | 115.7 | ||||
| 429 | S | 40.9 | Very low | 33.1 | Very low | 86 Ų | 86 | 144 Ų | 144 | 60% | 0.601 | 78% | 0.779 | S | S | * | * | trans | 134 | 157.5 | 148.4 | -55 | 0 | 0 | 0 | 0 | 112 | ||||
| 430 | Y | 33.3 | Very low | 33.2 | Very low | 213 Ų | 213 | 148.8 Ų | 148.8 | 84% | 0.835 | 79% | 0.789 | S | S | * | * | cis | -151.7 | 177.1 | 22.4 | -41.2 | -100.8 | 0 | 0 | 0 | 112 | ||||
| 431 | T | 34.4 | Very low | 33 | Very low | 141 Ų | 141 | 146.2 Ų | 146.2 | 87% | 0.865 | 79% | 0.786 | S | S | * | * | trans | -116.8 | -177.2 | 179.8 | 68.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 432 | A | 30.8 | Very low | 33.3 | Very low | 80 Ų | 80 | 149.7 Ų | 149.7 | 66% | 0.661 | 78% | 0.783 | S | S | * | * | cis | -162.1 | 162.2 | 3.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 433 | T | 37.1 | Very low | 33.1 | Very low | 151 Ų | 151 | 149.4 Ų | 149.4 | 93% | 0.926 | 79% | 0.791 | S | S | * | * | trans | -150.4 | 152.7 | 151.7 | 28.2 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 434 | V | 31.5 | Very low | 33.4 | Very low | 132 Ų | 132 | 151 Ų | 151 | 80% | 0.8 | 80% | 0.795 | S | S | * | * | trans | -135.5 | 147.6 | -164.6 | 171 | 0 | 0 | 0 | 0 | 111 | ||||
| 435 | K | 39.3 | Very low | 33.3 | Very low | 206 Ų | 206 | 154.1 Ų | 154.1 | 90% | 0.896 | 80% | 0.797 | S | S | * | * | trans | -151.9 | 142.5 | 148 | -153.4 | 155.7 | -175.7 | 170.4 | 0 | 113.3 | ||||
| 436 | S | 44.9 | Very low | 33.5 | Very low | 84 Ų | 84 | 152.9 Ų | 152.9 | 59% | 0.587 | 79% | 0.793 | S | S | * | * | trans | -128.6 | -177.8 | -175.3 | 64.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 437 | R | 44.9 | Very low | 34 | Very low | 237 Ų | 237 | 152.5 Ų | 152.5 | 89% | 0.894 | 79% | 0.794 | S | S | * | * | trans | 97.9 | 142.8 | 174.1 | -53 | 146.2 | -169.7 | -140.4 | -2.8 | 113.1 | ||||
| 438 | S | 30.2 | Very low | 34.5 | Very low | 126 Ų | 126 | 152 Ų | 152 | 88% | 0.881 | 80% | 0.796 | S | S | * | * | cis | -143.7 | 172.6 | 12.8 | -162.4 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 439 | L | 34.5 | Very low | 34.7 | Very low | 151 Ų | 151 | 152.4 Ų | 152.4 | 79% | 0.791 | 80% | 0.798 | S | S | * | * | trans | -106.5 | 176.6 | -173 | -122.7 | 169.3 | 0 | 0 | 0 | 112.9 | ||||
| 440 | L | 34.8 | Very low | 34.7 | Very low | 160 Ų | 160 | 153 Ų | 153 | 84% | 0.838 | 80% | 0.799 | S | S | * | * | trans | 82.1 | 132.3 | 169.3 | -62.8 | 146.6 | 0 | 0 | 0 | 115.7 | ||||
| 441 | S | 26.6 | Very low | 34.8 | Very low | 121 Ų | 121 | 151.9 Ų | 151.9 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | cis | -143.1 | -177.1 | 43.1 | 49.7 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 442 | Y | 33.3 | Very low | 34.6 | Very low | 181 Ų | 181 | 153.4 Ų | 153.4 | 71% | 0.71 | 80% | 0.803 | S | S | * | * | trans | -131.4 | 136.7 | -167.8 | -178.2 | -93.6 | 0 | 0 | 0 | 109.2 | E444 | Y442-E444 HydrophobicContact CD1-CB 4.3Å; Y442-E444 HydrophobicContact CE1-CB 3.54Å; Y442-E444 HydrophobicContact CE1-CG 4.43Å | ||
| 443 | E | 27.8 | Very low | 35.3 | Very low | 200 Ų | 200 | 157.6 Ų | 157.6 | 94% | 0.935 | 81% | 0.814 | S | S | * | * | trans | -142.7 | 149.2 | 149.7 | -167.6 | 145 | -151.9 | 0 | 0 | 109.7 | ||||
| 444 | E | 34.8 | Very low | 35 | Very low | 138 Ų | 138 | 153.8 Ų | 153.8 | 65% | 0.645 | 81% | 0.805 | S | S | * | * | trans | -120.4 | 164 | -156.8 | 155.5 | -177.4 | -161.9 | 0 | 0 | 110.5 | Y442 | Y442-E444 HydrophobicContact CD1-CB 4.3Å; Y442-E444 HydrophobicContact CE1-CB 3.54Å; Y442-E444 HydrophobicContact CE1-CG 4.43Å | ||
| 445 | R | 28.2 | Very low | 35 | Very low | 245 Ų | 245 | 156.2 Ų | 156.2 | 93% | 0.925 | 81% | 0.812 | S | S | * | * | trans | 90.9 | 120.4 | 173.6 | -158.9 | -173.6 | -53.6 | -167.6 | 2.7 | 114.4 | ||||
| 446 | G | 32.2 | Very low | 35 | Very low | 65 Ų | 65 | 150.3 Ų | 150.3 | 67% | 0.67 | 81% | 0.81 | S | S | * | * | cis | 148.6 | 146.9 | -7.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 447 | L | 38.8 | Very low | 34.3 | Very low | 160 Ų | 160 | 149.8 Ų | 149.8 | 84% | 0.838 | 82% | 0.818 | S | S | * | * | trans | 68.1 | 141.4 | 171.4 | -90.9 | 50.3 | 0 | 0 | 0 | 117.9 | ||||
| 448 | D | 34.3 | Very low | 33.8 | Very low | 143 Ų | 143 | 146.4 Ų | 146.4 | 77% | 0.765 | 82% | 0.817 | S | S | * | * | cis | -172.8 | -175.9 | -20.5 | -116.8 | 5.9 | 0 | 0 | 0 | 111.1 | ||||
| 449 | E | 35.4 | Very low | 34.1 | Very low | 180 Ų | 180 | 151.5 Ų | 151.5 | 84% | 0.841 | 82% | 0.819 | S | S | * | * | trans | 96.4 | 143.5 | 164.5 | -78.9 | -103.1 | 104.8 | 0 | 0 | 119.1 | ||||
| 450 | P | 42.1 | Very low | 34.5 | Very low | 98 Ų | 98 | 148.8 Ų | 148.8 | 64% | 0.636 | 81% | 0.811 | S | S | * | * | -138.7 | -179.1 | -127.7 | 35.6 | -12.3 | 0 | 0 | 0 | 115.3 | |||||
| 451 | H | 35.1 | Very low | 34.8 | Very low | 191 Ų | 191 | 149.4 Ų | 149.4 | 88% | 0.884 | 82% | 0.815 | S | S | * | * | trans | -82.4 | 138.2 | 164 | -72.9 | -63.9 | 0 | 0 | 0 | 111.8 | ||||
| 452 | L | 30.9 | Very low | 35.6 | Very low | 172 Ų | 172 | 150 Ų | 150 | 90% | 0.901 | 80% | 0.804 | S | S | * | * | trans | -141.1 | 130.9 | 157.4 | -114.2 | 171.7 | 0 | 0 | 0 | 110.3 | ||||
| 453 | L | 44.4 | Very low | 35.9 | Very low | 168 Ų | 168 | 148.5 Ų | 148.5 | 88% | 0.88 | 81% | 0.808 | S | S | * | * | trans | -99.9 | 147.3 | 178.9 | -75 | 168.6 | 0 | 0 | 0 | 110.9 | ||||
| 454 | G | 30.2 | Very low | 36.7 | Very low | 72 Ų | 72 | 147 Ų | 147 | 74% | 0.742 | 80% | 0.8 | S | S | * | * | trans | 95.8 | 116.7 | 153.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 455 | L | 32.6 | Very low | 37.3 | Very low | 182 Ų | 182 | 149.2 Ų | 149.2 | 95% | 0.953 | 80% | 0.803 | S | S | * | * | -172.2 | 155.2 | 116.4 | -95.2 | 166.1 | 0 | 0 | 0 | 108.9 | |||||
| 456 | G | 39.3 | Very low | 38.6 | Very low | 82 Ų | 82 | 141 Ų | 141 | 85% | 0.845 | 78% | 0.781 | S | S | * | * | trans | -72.5 | 159.8 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 457 | G | 29.1 | Very low | 39.5 | Very low | 73 Ų | 73 | 142.1 Ų | 142.1 | 75% | 0.753 | 78% | 0.775 | S | S | * | * | trans | -151.9 | 139.7 | 171 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 458 | D | 36.3 | Very low | 40.7 | Very low | 166 Ų | 166 | 139.4 Ų | 139.4 | 89% | 0.888 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -67 | 151.9 | -167.5 | -58.2 | -80.3 | 0 | 0 | 0 | 114.9 | ||
| 459 | Y | 35.3 | Very low | 42.3 | Very low | 233 Ų | 233 | 137.5 Ų | 137.5 | 91% | 0.914 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 125.2 | 174.9 | -129.6 | -94.3 | 0 | 0 | 0 | 110.1 | ||
| 460 | P | 42.3 | Very low | 43.7 | Very low | 95 Ų | 95 | 134.3 Ų | 134.3 | 62% | 0.617 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -90.1 | 132.4 | 170.5 | 32.8 | -30.2 | 0 | 0 | 0 | 111.5 | Q462 | P460-Q462 PolarHBondContact O-N 3.35Š|
| 461 | D | 42.2 | Very low | 44.7 | Very low | 172 Ų | 172 | 132 Ų | 132 | 92% | 0.92 | 73% | 0.734 | S | S | * | * | trans | -54.6 | 108.8 | 172.4 | -85.8 | -59 | 0 | 0 | 0 | 112.2 | ||||
| 462 | Q | 42.6 | Very low | 46.2 | Very low | 135 Ų | 135 | 125.8 Ų | 125.8 | 63% | 0.631 | 72% | 0.715 | S | S | * | * | trans | -129.5 | 17.5 | 178.1 | -162.3 | 162 | 94.9 | 0 | 0 | 113.3 | P460 E464 R465 P466 | P460-Q462 PolarHBondContact O-N 3.35Å; Q462-E464 VanDerWaalsContact C-N 3.34Å; Q462-E464 PolarHBondContact O-N 2.99Å; Q462-R465 HydrophobicContact CG-CB 4.42Å; Q462-P466 WeakPolarHBondContact O-CD 3.38Å | ||
| 463 | L | 40 | Very low | 47.9 | Very low | 149 Ų | 149 | 124.9 Ų | 124.9 | 78% | 0.78 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -73.7 | -20.8 | -177.8 | -156.7 | 67.5 | 0 | 0 | 0 | 114 | ||
| 464 | E | 45.2 | Very low | 48.8 | Very low | 167 Ų | 167 | 125.6 Ų | 125.6 | 78% | 0.78 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -81.6 | -27.9 | -178.7 | -63.4 | -166.5 | 143 | 0 | 0 | 114.3 | Q462 T467 V468 | Q462-E464 VanDerWaalsContact C-N 3.34Å; Q462-E464 PolarHBondContact O-N 2.99Å; E464-T467 PolarHBondContact O-N 3.36Å; E464-V468 PolarHBondContact O-N 3.46Å |
| 465 | R | 47.8 | Very low | 50.2 | Low | 186 Ų | 186 | 125.7 Ų | 125.7 | 70% | 0.702 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -64.2 | -42.2 | -175.7 | -92 | -175.9 | 155.8 | 84.7 | 2.2 | 114.6 | Q462 T467 V468 V469 | Q462-R465 HydrophobicContact CG-CB 4.42Å; R465-T467 VanDerWaalsContact C-N 3.29Å; R465-T467 PolarHBondContact O-N 2.96Å; R465-V468 PolarHBondContact O-N 3.41Å; R465-V469 WeakPolarHBondContact O-CG2 3.46Å; R465-V469 PolarHBondContact O-N 2.63Å |
| 466 | P | 54.9 | Low | 51.8 | Low | 71 Ų | 71 | 123.1 Ų | 123.1 | 46% | 0.461 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -59.4 | -39.7 | 176.4 | -24.8 | 34.5 | 0 | 0 | 0 | 112.8 | Q462 V469 M470 | Q462-P466 WeakPolarHBondContact O-CD 3.38Å; P466-V469 PolarHBondContact O-N 2.93Å; P466-M470 WeakPolarHBondContact O-CG 3.38Å; P466-M470 PolarHBondContact O-N 2.95Å |
| 467 | T | 51.8 | Low | 52.7 | Low | 89 Ų | 89 | 125.2 Ų | 125.2 | 55% | 0.546 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -66.1 | -42.7 | -176.8 | -49 | 0 | 0 | 0 | 0 | 112 | E464 R465 M470 A471 | E464-T467 PolarHBondContact O-N 3.36Å; R465-T467 VanDerWaalsContact C-N 3.29Å; R465-T467 PolarHBondContact O-N 2.96Å; T467-M470 PolarHBondContact O-N 2.87Å; T467-A471 WeakPolarHBondContact O-CB 3.45Å; T467-A471 PolarHBondContact O-N 2.75Å |
| 468 | V | 64.1 | Low | 54 | Low | 103 Ų | 103 | 130 Ų | 130 | 62% | 0.624 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -65 | -40.5 | 177.7 | 176.8 | 0 | 0 | 0 | 0 | 111.6 | E464 R465 A471 A472 | E464-V468 PolarHBondContact O-N 3.46Å; R465-V468 PolarHBondContact O-N 3.41Å; V468-A471 PolarHBondContact O-N 2.76Å; V468-A472 PolarHBondContact O-N 3Å |
| 469 | V | 67.4 | Low | 54.8 | Low | 104 Ų | 104 | 128.7 Ų | 128.7 | 63% | 0.63 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -66.5 | -41.7 | 177.7 | 176.1 | 0 | 0 | 0 | 0 | 111.4 | R465 P466 A472 W473 | R465-V469 WeakPolarHBondContact O-CG2 3.46Å; R465-V469 PolarHBondContact O-N 2.63Å; P466-V469 PolarHBondContact O-N 2.93Å; V469-A472 PolarHBondContact O-N 3.04Å; V469-W473 PolarHBondContact O-N 2.99Å; V469-W473 VanDerWaalsContact O-N 3.17Å |
| 470 | M | 64 | Low | 55.6 | Low | 113 Ų | 113 | 124.4 Ų | 124.4 | 56% | 0.557 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -67.2 | -34 | 174.7 | -71.9 | -167.3 | -69.8 | 0 | 0 | 113.1 | P466 T467 R474 | P466-M470 WeakPolarHBondContact O-CG 3.38Å; P466-M470 PolarHBondContact O-N 2.95Å; T467-M470 PolarHBondContact O-N 2.87Å; M470-R474 WeakPolarHBondContact O-CB 3.44Å; M470-R474 PolarHBondContact O-N 3.12Å; M470-R474 VanDerWaalsContact O-N 3.08Å |
| 471 | A | 63.1 | Low | 55.6 | Low | 48 Ų | 48 | 128 Ų | 128 | 40% | 0.397 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -67.9 | -40.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | T467 V468 R474 S475 | T467-A471 WeakPolarHBondContact O-CB 3.45Å; T467-A471 PolarHBondContact O-N 2.75Å; V468-A471 PolarHBondContact O-N 2.76Å; A471-R474 PolarHBondContact O-N 3.11Å; A471-S475 PolarHBondContact O-N 2.95Å; A471-S475 VanDerWaalsContact O-N 3.11Å; A471-S475 PolarHBondContact O-OG 2.88Å |
| 472 | A | 67.6 | Low | 55.5 | Low | 61 Ų | 61 | 121.3 Ų | 121.3 | 50% | 0.504 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -59.8 | -51.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | V468 V469 R474 S475 E476 | V468-A472 PolarHBondContact O-N 3Å; V469-A472 PolarHBondContact O-N 3.04Å; A472-R474 VanDerWaalsContact C-N 3.32Å; A472-R474 PolarHBondContact O-N 3.31Å; A472-S475 WeakPolarHBondContact O-CB 3.49Å; A472-S475 PolarHBondContact O-N 3.49Å; A472-E476 PolarHBondContact O-N 3Å |
| 473 | W | 65.3 | Low | 55.4 | Low | 153 Ų | 153 | 121.7 Ų | 121.7 | 58% | 0.58 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.3 | -35.8 | 179.8 | -167.3 | 77 | 0 | 0 | 0 | 113.4 | V469 S475 K477 | V469-W473 PolarHBondContact O-N 2.99Å; V469-W473 VanDerWaalsContact O-N 3.17Å; W473-S475 VanDerWaalsContact C-N 3.29Å; W473-S475 PolarHBondContact O-N 2.83Å; W473-K477 HydrophobicContact CH2-CD 3.94Å; W473-K477 VanDerWaalsContact CH2-CE 3.46Å; W473-K477 HydrophobicContact CZ2-CD 4.28Å; W473-K477 HydrophobicContact CZ3-CD 4.09Å; W473-K477 PolarHBondContact O-N 3.28Å |
| 474 | R | 63.5 | Low | 55.4 | Low | 184 Ų | 184 | 122.4 Ų | 122.4 | 69% | 0.694 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -68.1 | -28.9 | 174.9 | -166.7 | -177 | -64.4 | 167.2 | -0.9 | 112.5 | M470 A471 A472 K478 | M470-R474 WeakPolarHBondContact O-CB 3.44Å; M470-R474 PolarHBondContact O-N 3.12Å; M470-R474 VanDerWaalsContact O-N 3.08Å; A471-R474 PolarHBondContact O-N 3.11Å; A472-R474 VanDerWaalsContact C-N 3.32Å; A472-R474 PolarHBondContact O-N 3.31Å; R474-K478 PolarHBondContact O-N 3.08Å |
| 475 | S | 60.4 | Low | 55.1 | Low | 74 Ų | 74 | 118.6 Ų | 118.6 | 52% | 0.517 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -76.5 | -43 | 178.6 | -55.7 | 0 | 0 | 0 | 0 | 111.1 | A471 A472 W473 K477 K478 Q479 | A471-S475 PolarHBondContact O-N 2.95Å; A471-S475 VanDerWaalsContact O-N 3.11Å; A471-S475 PolarHBondContact O-OG 2.88Å; A472-S475 WeakPolarHBondContact O-CB 3.49Å; A472-S475 PolarHBondContact O-N 3.49Å; W473-S475 VanDerWaalsContact C-N 3.29Å; W473-S475 PolarHBondContact O-N 2.83Å; S475-K477 PolarHBondContact O-N 2.94Å; S475-K478 WeakPolarHBondContact O-CB 3.41Å; S475-K478 PolarHBondContact O-N 3.45Å; S475-Q479 PolarHBondContact O-N 2.87Å |
| 476 | E | 65.8 | Low | 54.6 | Low | 128 Ų | 128 | 117.8 Ų | 117.8 | 60% | 0.598 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -58.2 | -47.2 | 175.7 | -171.5 | 168.7 | -135.2 | 0 | 0 | 112.1 | A472 K478 Q479 Q480 | A472-E476 PolarHBondContact O-N 3Å; E476-K478 PolarHBondContact O-N 3.25Å; E476-Q479 PolarHBondContact O-N 2.86Å; E476-Q480 PolarHBondContact O-N 3.27Å; E476-Q480 VanDerWaalsContact O-N 3.11Å |
| 477 | K | 58 | Low | 53.7 | Low | 125 Ų | 125 | 125.7 Ų | 125.7 | 54% | 0.543 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -60.7 | -27.5 | 172.8 | -87.1 | -159.6 | 169.7 | -169.3 | 0 | 114.4 | W473 S475 | W473-K477 HydrophobicContact CH2-CD 3.94Å; W473-K477 VanDerWaalsContact CH2-CE 3.46Å; W473-K477 HydrophobicContact CZ2-CD 4.28Å; W473-K477 HydrophobicContact CZ3-CD 4.09Å; W473-K477 PolarHBondContact O-N 3.28Å; S475-K477 PolarHBondContact O-N 2.94Å |
| 478 | K | 56.7 | Low | 53 | Low | 174 Ų | 174 | 125.8 Ų | 125.8 | 76% | 0.757 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -80.4 | -31.7 | 179.1 | -150.1 | 179.1 | -175.1 | -172.5 | 0 | 111.6 | R474 S475 E476 G482 | R474-K478 PolarHBondContact O-N 3.08Å; S475-K478 WeakPolarHBondContact O-CB 3.41Å; S475-K478 PolarHBondContact O-N 3.45Å; E476-K478 PolarHBondContact O-N 3.25Å; K478-G482 PolarHBondContact O-N 3.19Å |
| 479 | Q | 52.9 | Low | 51.9 | Low | 138 Ų | 138 | 129.5 Ų | 129.5 | 65% | 0.645 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -70.1 | -44.5 | 176 | -163.7 | 164.1 | 4.1 | 0 | 0 | 111.3 | S475 E476 K481 G482 E483 | S475-Q479 PolarHBondContact O-N 2.87Å; E476-Q479 PolarHBondContact O-N 2.86Å; Q479-K481 VanDerWaalsContact C-N 3.27Å; Q479-K481 PolarHBondContact O-N 3.29Å; Q479-G482 PolarHBondContact O-N 3.46Å; Q479-E483 PolarHBondContact O-N 3.25Å |
| 480 | Q | 51.8 | Low | 50.1 | Low | 144 Ų | 144 | 131.4 Ų | 131.4 | 67% | 0.673 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -58.5 | -36.5 | 175.7 | -130.2 | 173.4 | 22.8 | 0 | 0 | 113 | E476 G482 | E476-Q480 PolarHBondContact O-N 3.27Å; E476-Q480 VanDerWaalsContact O-N 3.11Å; Q480-G482 VanDerWaalsContact C-N 3.34Å |
| 481 | K | 42.8 | Very low | 48.5 | Very low | 169 Ų | 169 | 138 Ų | 138 | 74% | 0.735 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -77.3 | -16.3 | 176.6 | -164.4 | 170.7 | -177.3 | 178.6 | 0 | 113.7 | Q479 | Q479-K481 VanDerWaalsContact C-N 3.27Å; Q479-K481 PolarHBondContact O-N 3.29Å |
| 482 | G | 40.7 | Very low | 46.8 | Very low | 32 Ų | 32 | 140.8 Ų | 140.8 | 33% | 0.33 | 69% | 0.69 | S | S | . | * | H | α-helix | trans | -81 | -43.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113 | K478 Q479 Q480 E484 S485 H486 | K478-G482 PolarHBondContact O-N 3.19Å; Q479-G482 PolarHBondContact O-N 3.46Å; Q480-G482 VanDerWaalsContact C-N 3.34Å; G482-E484 VanDerWaalsContact C-N 3.29Å; G482-E484 PolarHBondContact O-N 3.05Å; G482-S485 PolarHBondContact O-N 2.69Å; G482-H486 PolarHBondContact O-CD2 3.01Å |
| 483 | E | 39.8 | Very low | 45.7 | Very low | 144 Ų | 144 | 142.9 Ų | 142.9 | 67% | 0.673 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -66.5 | -29.3 | -177.6 | -68.5 | -175.8 | 133.9 | 0 | 0 | 113.2 | Q479 S485 | Q479-E483 PolarHBondContact O-N 3.25Å; E483-S485 PolarHBondContact O-N 2.85Å |
| 484 | E | 40.4 | Very low | 44 | Very low | 163 Ų | 163 | 144.4 Ų | 144.4 | 76% | 0.762 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -29.8 | 179.9 | -156.9 | 165.9 | -140.2 | 0 | 0 | 112.6 | G482 | G482-E484 VanDerWaalsContact C-N 3.29Å; G482-E484 PolarHBondContact O-N 3.05Å |
| 485 | S | 37.7 | Very low | 42.2 | Very low | 88 Ų | 88 | 142.3 Ų | 142.3 | 62% | 0.615 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -78 | -25.9 | -179 | -164.8 | 0 | 0 | 0 | 0 | 113.8 | G482 E483 | G482-S485 PolarHBondContact O-N 2.69Å; E483-S485 PolarHBondContact O-N 2.85Å |
| 486 | H | 39 | Very low | 40.8 | Very low | 169 Ų | 169 | 145.9 Ų | 145.9 | 78% | 0.782 | 73% | 0.725 | S | S | * | * | G | 310 helix | trans | -87.1 | -4.3 | -176.7 | -76.1 | -68.5 | 0 | 0 | 0 | 114.3 | G482 | G482-H486 PolarHBondContact O-CD2 3.01Š|
| 487 | R | 35.5 | Very low | 39 | Very low | 236 Ų | 236 | 145.5 Ų | 145.5 | 89% | 0.891 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -90.4 | -10.8 | -179.1 | -156.6 | 173.9 | -172 | -173.6 | 3.1 | 114.3 | ||
| 488 | A | 37.4 | Very low | 37.9 | Very low | 92 Ų | 92 | 147.2 Ų | 147.2 | 76% | 0.76 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -92.4 | -13.3 | -169.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 489 | E | 39.3 | Very low | 36.6 | Very low | 180 Ų | 180 | 143.9 Ų | 143.9 | 84% | 0.841 | 76% | 0.756 | S | S | * | * | trans | -124.8 | 69.8 | -163.6 | -156.3 | 168 | -152.3 | 0 | 0 | 113.6 | ||||
| 490 | T | 31.2 | Very low | 35.7 | Very low | 145 Ų | 145 | 144.3 Ų | 144.3 | 89% | 0.89 | 76% | 0.763 | S | S | * | * | trans | -149.9 | 94.7 | 160.9 | -44.3 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 491 | R | 30.1 | Very low | 35.4 | Very low | 250 Ų | 250 | 142.6 Ų | 142.6 | 94% | 0.943 | 77% | 0.765 | S | S | * | * | trans | -141.6 | 116.7 | 169.9 | -170.1 | 174.6 | -175.2 | 166.9 | 1.8 | 110.3 | ||||
| 492 | S | 27.1 | Very low | 35.1 | Very low | 108 Ų | 108 | 142.1 Ų | 142.1 | 76% | 0.755 | 77% | 0.765 | S | S | * | * | trans | -94.3 | 161.1 | 168.9 | 65.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 493 | P | 44 | Very low | 35.1 | Very low | 104 Ų | 104 | 149.6 Ų | 149.6 | 68% | 0.675 | 79% | 0.789 | S | S | * | * | trans | -113.9 | 173.7 | -170.8 | 34.4 | -19.2 | 0 | 0 | 0 | 115.2 | ||||
| 494 | F | 29.7 | Very low | 35.3 | Very low | 185 Ų | 185 | 148.3 Ų | 148.3 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | trans | 75.4 | 146.1 | 177.8 | -61.6 | -84.7 | 0 | 0 | 0 | 115.9 | ||||
| 495 | N | 26.6 | Very low | 35.4 | Very low | 141 Ų | 141 | 149.1 Ų | 149.1 | 75% | 0.754 | 80% | 0.801 | S | S | * | * | cis | -150 | 168.4 | 9.5 | -138.6 | -23.6 | 0 | 0 | 0 | 113.6 | ||||
| 496 | N | 29.9 | Very low | 35.7 | Very low | 149 Ų | 149 | 152.1 Ų | 152.1 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | trans | -76.8 | 148.2 | -177.5 | -71.7 | -49 | 0 | 0 | 0 | 115 | ||||
| 497 | S | 28.9 | Very low | 36.2 | Very low | 119 Ų | 119 | 151 Ų | 151 | 83% | 0.832 | 81% | 0.809 | S | S | * | * | -178.3 | 159.6 | 121 | 35.9 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 498 | D | 34.2 | Very low | 36.6 | Very low | 161 Ų | 161 | 146.4 Ų | 146.4 | 86% | 0.861 | 80% | 0.802 | S | S | * | * | trans | -52.2 | 143.4 | -162.1 | -55.2 | -89.5 | 0 | 0 | 0 | 120.6 | ||||
| 499 | A | 30.3 | Very low | 37.1 | Very low | 104 Ų | 104 | 149.1 Ų | 149.1 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | 170.4 | 138.4 | 118.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 500 | N | 33.9 | Very low | 37.4 | Very low | 147 Ų | 147 | 146.5 Ų | 146.5 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | trans | -105.8 | 135.7 | 166.6 | 176.4 | 55.8 | 0 | 0 | 0 | 107.1 | ||||
| 501 | P | 44.8 | Very low | 38.4 | Very low | 109 Ų | 109 | 148.2 Ų | 148.2 | 71% | 0.708 | 78% | 0.78 | S | S | * | * | -151.9 | 145.3 | 80.9 | 35.4 | -13.6 | 0 | 0 | 0 | 119.3 | |||||
| 502 | Q | 36.9 | Very low | 39.2 | Very low | 159 Ų | 159 | 140.1 Ų | 140.1 | 74% | 0.743 | 76% | 0.762 | S | S | * | * | trans | 53.6 | 121.8 | 142.6 | -59.5 | -165.3 | 3.2 | 0 | 0 | 123.5 | ||||
| 503 | K | 40.3 | Very low | 40.3 | Very low | 189 Ų | 189 | 140.3 Ų | 140.3 | 82% | 0.822 | 75% | 0.754 | S | S | * | * | trans | 55.9 | 130.3 | 142.4 | -66 | -179.1 | 178.2 | 178.1 | 0 | 119.3 | ||||
| 504 | P | 44.2 | Very low | 40.6 | Very low | 116 Ų | 116 | 140.6 Ų | 140.6 | 75% | 0.753 | 75% | 0.746 | S | S | * | * | -146.7 | 128.2 | 89.7 | 35.1 | -17.5 | 0 | 0 | 0 | 116.2 | |||||
| 505 | L | 41.7 | Very low | 41.6 | Very low | 181 Ų | 181 | 138.2 Ų | 138.2 | 95% | 0.948 | 74% | 0.737 | S | S | * | * | trans | -135.5 | 64.9 | 163.5 | -84.9 | 174.6 | 0 | 0 | 0 | 109 | ||||
| 506 | L | 44.2 | Very low | 42.8 | Very low | 151 Ų | 151 | 140.2 Ų | 140.2 | 79% | 0.791 | 74% | 0.735 | S | S | * | * | trans | -147.5 | 30.5 | -173.9 | -138.5 | 172.2 | 0 | 0 | 0 | 113.1 | ||||
| 507 | L | 49.1 | Very low | 43.9 | Very low | 145 Ų | 145 | 137.2 Ų | 137.2 | 76% | 0.759 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -122.1 | -17.2 | -179.6 | -76.6 | 171.5 | 0 | 0 | 0 | 115.6 | ||
| 508 | D | 44.8 | Very low | 44.8 | Very low | 139 Ų | 139 | 136.1 Ų | 136.1 | 74% | 0.743 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -91.2 | -25.4 | 177.9 | -85 | -25.4 | 0 | 0 | 0 | 114.7 | H510 | D508-H510 PolarHBondContact O-N 3.33Å |
| 509 | L | 47.8 | Very low | 45.7 | Very low | 149 Ų | 149 | 132.7 Ų | 132.7 | 78% | 0.78 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -71.9 | -25.2 | -177.8 | -97.2 | 161.1 | 0 | 0 | 0 | 114 | ||
| 510 | H | 45.7 | Very low | 46.8 | Very low | 125 Ų | 125 | 130.8 Ų | 130.8 | 58% | 0.579 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -74.7 | -41.2 | -179.1 | -152.1 | -88.5 | 0 | 0 | 0 | 112.3 | D508 S512 L513 E514 | D508-H510 PolarHBondContact O-N 3.33Å; H510-S512 VanDerWaalsContact C-N 3.33Å; H510-S512 PolarHBondContact O-N 3.47Å; H510-L513 PolarHBondContact O-N 3.02Å; H510-E514 IonicContact CE1-OE1 3.27Å; H510-E514 PolarHBondContact CE1-OE1 3.16Å; H510-E514 IonicContact CE1-OE2 3.94Å; H510-E514 VanDerWaalsContact ND1-CD 3.32Å; H510-E514 IonicContact ND1-OE1 3.85Å; H510-E514 PolarHBondContact ND1-OE1 3.48Å; H510-E514 IonicContact ND1-OE2 3.3Å; H510-E514 PolarHBondContact ND1-OE2 3Å; H510-E514 PolarHBondContact O-N 3.43Å |
| 511 | R | 51.3 | Low | 47.7 | Very low | 182 Ų | 182 | 127.5 Ų | 127.5 | 69% | 0.687 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -65.5 | -34.3 | -175.9 | -164.5 | -176.4 | -56.6 | -101.2 | -3.6 | 112.9 | ||
| 512 | S | 47 | Very low | 48.1 | Very low | 79 Ų | 79 | 128.5 Ų | 128.5 | 55% | 0.552 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -74 | -29 | 178.9 | -170.5 | 0 | 0 | 0 | 0 | 113 | H510 | H510-S512 VanDerWaalsContact C-N 3.33Å; H510-S512 PolarHBondContact O-N 3.47Å |
| 513 | L | 50.1 | Low | 48.9 | Very low | 113 Ų | 113 | 126.8 Ų | 126.8 | 59% | 0.592 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -79.1 | -40 | -178.2 | -165.6 | 64 | 0 | 0 | 0 | 112.1 | H510 Q515 R516 V517 | H510-L513 PolarHBondContact O-N 3.02Å; L513-Q515 VanDerWaalsContact C-N 3.33Å; L513-Q515 PolarHBondContact O-N 2.95Å; L513-R516 PolarHBondContact O-N 3.18Å; L513-V517 PolarHBondContact O-N 3.08Å |
| 514 | E | 51.1 | Low | 49.5 | Very low | 109 Ų | 109 | 121 Ų | 121 | 51% | 0.509 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -64.7 | -34.8 | 178.6 | -69.9 | 175.8 | 140 | 0 | 0 | 112.7 | H510 N518 | H510-E514 IonicContact CE1-OE1 3.27Å; H510-E514 PolarHBondContact CE1-OE1 3.16Å; H510-E514 IonicContact CE1-OE2 3.94Å; H510-E514 VanDerWaalsContact ND1-CD 3.32Å; H510-E514 IonicContact ND1-OE1 3.85Å; H510-E514 PolarHBondContact ND1-OE1 3.48Å; H510-E514 IonicContact ND1-OE2 3.3Å; H510-E514 PolarHBondContact ND1-OE2 3Å; H510-E514 PolarHBondContact O-N 3.43Å; E514-N518 PolarHBondContact O-N 3.02Å; E514-N518 PolarHBondContact O-ND2 2.82Å |
| 515 | Q | 50.5 | Low | 49.7 | Very low | 135 Ų | 135 | 122.2 Ų | 122.2 | 63% | 0.631 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -61.4 | -45.2 | 174.8 | -159.1 | 86.8 | 24.3 | 0 | 0 | 111.4 | L513 V517 | L513-Q515 VanDerWaalsContact C-N 3.33Å; L513-Q515 PolarHBondContact O-N 2.95Å; Q515-V517 PolarHBondContact O-N 3.48Å |
| 516 | R | 51.5 | Low | 50.1 | Low | 184 Ų | 184 | 120 Ų | 120 | 69% | 0.694 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.6 | -34.3 | -176.9 | -170.6 | -171.4 | -65.7 | -122.4 | 2.2 | 113 | L513 | L513-R516 PolarHBondContact O-N 3.18Å |
| 517 | V | 53.4 | Low | 50.2 | Low | 85 Ų | 85 | 120.6 Ų | 120.6 | 52% | 0.515 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -69.2 | -41.1 | -179.8 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | L513 Q515 D519 S520 T521 | L513-V517 PolarHBondContact O-N 3.08Å; Q515-V517 PolarHBondContact O-N 3.48Å; V517-D519 PolarHBondContact O-N 3.21Å; V517-S520 PolarHBondContact O-N 3.19Å; V517-T521 PolarHBondContact O-N 2.92Å; V517-T521 PolarHBondContact O-OG1 2.76Å |
| 518 | N | 48.1 | Very low | 50.4 | Low | 96 Ų | 96 | 123 Ų | 123 | 51% | 0.513 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -67.7 | -31.7 | -176.5 | -79 | -29.7 | 0 | 0 | 0 | 114.6 | E514 T521 K522 | E514-N518 PolarHBondContact O-N 3.02Å; E514-N518 PolarHBondContact O-ND2 2.82Å; N518-T521 PolarHBondContact O-OG1 2.85Å; N518-K522 WeakPolarHBondContact O-CG 3.38Å |
| 519 | D | 52.3 | Low | 50.6 | Low | 90 Ų | 90 | 121.9 Ų | 121.9 | 48% | 0.481 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -75.4 | -33.8 | 175.5 | -69 | -29.3 | 0 | 0 | 0 | 111.4 | V517 K522 I523 | V517-D519 PolarHBondContact O-N 3.21Å; D519-K522 PolarHBondContact O-N 3.14Å; D519-I523 WeakPolarHBondContact O-CG1 3.47Å; D519-I523 PolarHBondContact O-N 3.4Å |
| 520 | S | 53.6 | Low | 50.8 | Low | 64 Ų | 64 | 120.4 Ų | 120.4 | 45% | 0.448 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -68.4 | -35.3 | 177.7 | -167.3 | 0 | 0 | 0 | 0 | 112.9 | V517 I524 | V517-S520 PolarHBondContact O-N 3.19Å; S520-I524 VanDerWaalsContact O-CD1 3.32Å; S520-I524 WeakPolarHBondContact O-CD1 3.47Å; S520-I524 VanDerWaalsContact O-CG1 3.24Å; S520-I524 WeakPolarHBondContact O-CG1 3.28Å; S520-I524 PolarHBondContact O-N 2.94Å |
| 521 | T | 53.2 | Low | 50.9 | Low | 77 Ų | 77 | 121.7 Ų | 121.7 | 47% | 0.472 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -67.4 | -39.9 | 175.3 | 27.6 | 0 | 0 | 0 | 0 | 112.7 | V517 N518 I523 I524 E525 | V517-T521 PolarHBondContact O-N 2.92Å; V517-T521 PolarHBondContact O-OG1 2.76Å; N518-T521 PolarHBondContact O-OG1 2.85Å; T521-I523 PolarHBondContact O-N 3.18Å; T521-I524 PolarHBondContact O-N 3.35Å; T521-E525 PolarHBondContact O-N 3.31Å; T521-E525 VanDerWaalsContact O-N 3.09Å |
| 522 | K | 52.5 | Low | 50.6 | Low | 131 Ų | 131 | 122.6 Ų | 122.6 | 57% | 0.57 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -65.8 | -37.1 | -180 | -70.6 | 175.7 | -178 | 176.2 | 0 | 113.4 | N518 D519 I524 E525 L526 | N518-K522 WeakPolarHBondContact O-CG 3.38Å; D519-K522 PolarHBondContact O-N 3.14Å; K522-I524 VanDerWaalsContact C-N 3.35Å; K522-E525 PolarHBondContact O-N 3.15Å; K522-L526 PolarHBondContact O-N 2.99Å |
| 523 | I | 54.6 | Low | 50.5 | Low | 122 Ų | 122 | 125.3 Ų | 125.3 | 63% | 0.626 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -67.5 | -38.9 | 176.8 | -65.2 | 166.3 | 0 | 0 | 0 | 110.6 | D519 T521 E525 | D519-I523 WeakPolarHBondContact O-CG1 3.47Å; D519-I523 PolarHBondContact O-N 3.4Å; T521-I523 PolarHBondContact O-N 3.18Å; I523-E525 VanDerWaalsContact C-N 3.33Å; I523-E525 PolarHBondContact O-N 3.46Å |
| 524 | I | 52.1 | Low | 50 | Low | 69 Ų | 69 | 129.5 Ų | 129.5 | 35% | 0.354 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -74.4 | -20.8 | -179.1 | -69.9 | 170.3 | 0 | 0 | 0 | 112.8 | S520 T521 K522 R528 | S520-I524 VanDerWaalsContact O-CD1 3.32Å; S520-I524 WeakPolarHBondContact O-CD1 3.47Å; S520-I524 VanDerWaalsContact O-CG1 3.24Å; S520-I524 WeakPolarHBondContact O-CG1 3.28Å; S520-I524 PolarHBondContact O-N 2.94Å; T521-I524 PolarHBondContact O-N 3.35Å; K522-I524 VanDerWaalsContact C-N 3.35Å; I524-R528 VanDerWaalsContact CG2-CZ 3.46Å; I524-R528 VanDerWaalsContact CG2-NH1 3.26Å |
| 525 | E | 50.3 | Low | 49.9 | Very low | 140 Ų | 140 | 130.6 Ų | 130.6 | 65% | 0.654 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -83.1 | -35.7 | 177.7 | -165.3 | 165.5 | -162.6 | 0 | 0 | 112.6 | T521 K522 I523 | T521-E525 PolarHBondContact O-N 3.31Å; T521-E525 VanDerWaalsContact O-N 3.09Å; K522-E525 PolarHBondContact O-N 3.15Å; I523-E525 VanDerWaalsContact C-N 3.33Å; I523-E525 PolarHBondContact O-N 3.46Å |
| 526 | L | 48.2 | Very low | 49.9 | Very low | 136 Ų | 136 | 130.3 Ų | 130.3 | 71% | 0.712 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -70.8 | -27.3 | 176.7 | -99.2 | 79 | 0 | 0 | 0 | 114.1 | K522 R528 | K522-L526 PolarHBondContact O-N 2.99Å; L526-R528 PolarHBondContact O-N 3.25Å |
| 527 | E | 48.1 | Very low | 49.8 | Very low | 163 Ų | 163 | 127.3 Ų | 127.3 | 76% | 0.762 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | -7.1 | -177.7 | -149.5 | -174.6 | 168.5 | 0 | 0 | 113.4 | ||
| 528 | R | 51.7 | Low | 49.6 | Very low | 194 Ų | 194 | 129.8 Ų | 129.8 | 73% | 0.732 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.6 | -1.1 | -172.2 | -69 | -175.4 | 179 | 138.3 | 5.1 | 115.7 | I524 L526 | I524-R528 VanDerWaalsContact CG2-CZ 3.46Å; I524-R528 VanDerWaalsContact CG2-NH1 3.26Å; L526-R528 PolarHBondContact O-N 3.25Å |
| 529 | T | 50.4 | Low | 49.7 | Very low | 116 Ų | 116 | 131.9 Ų | 131.9 | 71% | 0.712 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -113.4 | 12 | -171.5 | 54.3 | 0 | 0 | 0 | 0 | 115 | ||
| 530 | V | 51.1 | Low | 49.5 | Very low | 119 Ų | 119 | 134.7 Ų | 134.7 | 72% | 0.721 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -110.7 | 2.1 | -174.6 | -177 | 0 | 0 | 0 | 0 | 113.8 | ||
| 531 | N | 47.4 | Very low | 49.2 | Very low | 152 Ų | 152 | 139.8 Ų | 139.8 | 81% | 0.813 | 74% | 0.736 | S | S | * | * | trans | -125.7 | 58.2 | -175.4 | -70.1 | -10.9 | 0 | 0 | 0 | 114.5 | ||||
| 532 | E | 44.8 | Very low | 48.9 | Very low | 200 Ų | 200 | 144.6 Ų | 144.6 | 94% | 0.935 | 76% | 0.757 | S | S | * | * | trans | -136.4 | 141.8 | 155.3 | -78.1 | -159.1 | 134.2 | 0 | 0 | 111.3 | ||||
| 533 | T | 46.6 | Very low | 48.6 | Very low | 136 Ų | 136 | 145.8 Ų | 145.8 | 83% | 0.834 | 77% | 0.772 | S | S | * | * | trans | -122.9 | 131.5 | -175.5 | 41.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 534 | S | 37.8 | Very low | 48 | Very low | 202 Ų | 202 | 147.9 Ų | 147.9 | 100% | 1.413 | 79% | 0.786 | S | S | * | * | trans | -159.9 | 0 | 149.4 | -76.9 | 0 | 0 | 0 | 0 | 109.6 |
Retrieved 534 of 534 residues in 1703.6 ms
(Link to these results)