| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.5 | Very low | 34 | Very low | 248 Ų | 248 | 160.1 Ų | 160.1 | 100% | 1.222 | 80% | 0.8 | S | S | * | * | 0 | 130.6 | 0 | -79.6 | 167.8 | 161.8 | 0 | 0 | 107 | |||||
| 2 | E | 28 | Very low | 33.7 | Very low | 185 Ų | 185 | 162.7 Ų | 162.7 | 86% | 0.864 | 81% | 0.807 | S | S | * | * | trans | -85 | 172.9 | 171.9 | -72 | 169.3 | 111.8 | 0 | 0 | 110.3 | ||||
| 3 | P | 45.6 | Very low | 33.6 | Very low | 112 Ų | 112 | 157.9 Ų | 157.9 | 73% | 0.727 | 80% | 0.799 | S | S | * | * | cis | -128.8 | -150.9 | -28.6 | 35.2 | -13.7 | 0 | 0 | 0 | 109.5 | ||||
| 4 | Q | 37.5 | Very low | 33.2 | Very low | 156 Ų | 156 | 158.2 Ų | 158.2 | 73% | 0.729 | 80% | 0.803 | S | S | * | * | cis | -156.6 | 164.7 | -5.6 | -143.8 | -174.2 | 86.5 | 0 | 0 | 110.1 | ||||
| 5 | N | 33.7 | Very low | 32.7 | Very low | 118 Ų | 118 | 157.7 Ų | 157.7 | 63% | 0.631 | 80% | 0.803 | S | S | * | * | trans | 27.1 | 141.6 | 139.3 | -71.3 | -8 | 0 | 0 | 0 | 122.8 | ||||
| 6 | T | 36.5 | Very low | 32.3 | Very low | 101 Ų | 101 | 154.1 Ų | 154.1 | 62% | 0.62 | 80% | 0.804 | S | S | * | * | cis | -159.3 | 143.7 | 5.4 | 0.4 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 7 | R | 32.6 | Very low | 32.2 | Very low | 201 Ų | 201 | 154.5 Ų | 154.5 | 76% | 0.758 | 81% | 0.807 | S | S | * | * | trans | 33.7 | 145.6 | 139.4 | -69.2 | 174.1 | 179.2 | 165.5 | -2.5 | 120.6 | ||||
| 8 | Y | 34.8 | Very low | 32.1 | Very low | 195 Ų | 195 | 155.7 Ų | 155.7 | 77% | 0.765 | 81% | 0.812 | S | S | * | * | cis | -132.8 | 174.2 | 19.6 | -106.7 | -68.5 | 0 | 0 | 0 | 113.4 | ||||
| 9 | E | 30.2 | Very low | 32 | Very low | 170 Ų | 170 | 151.7 Ų | 151.7 | 79% | 0.794 | 80% | 0.798 | S | S | * | * | trans | -102 | 140.6 | -177.9 | -60.1 | 155.8 | 124.4 | 0 | 0 | 111.4 | ||||
| 10 | T | 31.5 | Very low | 32 | Very low | 149 Ų | 149 | 151.2 Ų | 151.2 | 91% | 0.914 | 80% | 0.796 | S | S | * | * | -166 | 158.9 | 127.3 | 7.8 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 11 | T | 28.8 | Very low | 32.1 | Very low | 126 Ų | 126 | 149.3 Ų | 149.3 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | trans | -118.2 | 124 | -171.9 | 48.8 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 12 | H | 30.7 | Very low | 32 | Very low | 191 Ų | 191 | 144 Ų | 144 | 88% | 0.884 | 77% | 0.767 | S | S | * | * | trans | -143.5 | 133.2 | 146.5 | -103.3 | -81.6 | 0 | 0 | 0 | 110.4 | ||||
| 13 | S | 33.1 | Very low | 32.2 | Very low | 101 Ų | 101 | 142 Ų | 142 | 71% | 0.706 | 76% | 0.758 | S | S | * | * | trans | -130.1 | 143.8 | 157.9 | 62.1 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 14 | L | 28.1 | Very low | 31.6 | Very low | 162 Ų | 162 | 142.4 Ų | 142.4 | 85% | 0.848 | 75% | 0.754 | S | S | * | * | S | Bend | cis | -147.5 | 65.6 | 12.6 | -146.6 | 163.6 | 0 | 0 | 0 | 110.6 | ||
| 15 | D | 24.6 | Very low | 31.4 | Very low | 150 Ų | 150 | 142.3 Ų | 142.3 | 80% | 0.802 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -103 | 153.2 | 174 | -75.9 | -61.9 | 0 | 0 | 0 | 112 | ||
| 16 | A | 26.9 | Very low | 31.1 | Very low | 100 Ų | 100 | 143.4 Ų | 143.4 | 83% | 0.826 | 76% | 0.758 | S | S | * | * | trans | 32.2 | 114.4 | 164.2 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 17 | L | 30.1 | Very low | 30.8 | Very low | 162 Ų | 162 | 146 Ų | 146 | 85% | 0.848 | 77% | 0.766 | S | S | * | * | trans | -140.8 | 69.9 | 156.6 | -138 | 175.8 | 0 | 0 | 0 | 112 | ||||
| 18 | I | 30.7 | Very low | 30.5 | Very low | 176 Ų | 176 | 144.7 Ų | 144.7 | 90% | 0.903 | 77% | 0.768 | S | S | * | * | trans | -105.2 | 123.5 | 150.7 | -63.9 | 177.2 | 0 | 0 | 0 | 105.8 | ||||
| 19 | S | 31.2 | Very low | 30.2 | Very low | 79 Ų | 79 | 144.9 Ų | 144.9 | 55% | 0.552 | 77% | 0.773 | S | S | * | * | trans | -138.3 | 124 | 175.1 | -167.8 | 0 | 0 | 0 | 0 | 105 | ||||
| 20 | D | 32 | Very low | 30 | Very low | 141 Ų | 141 | 141.5 Ų | 141.5 | 75% | 0.754 | 77% | 0.768 | S | S | * | * | -151.9 | 127.5 | 73.1 | -84.3 | -14.7 | 0 | 0 | 0 | 110.5 | |||||
| 21 | V | 33.1 | Very low | 29.7 | Very low | 112 Ų | 112 | 139.4 Ų | 139.4 | 68% | 0.679 | 76% | 0.76 | S | S | * | * | 69.3 | 90.4 | 94.8 | 173.5 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 22 | N | 31.8 | Very low | 29.9 | Very low | 138 Ų | 138 | 144.4 Ų | 144.4 | 74% | 0.738 | 77% | 0.766 | S | S | * | * | 82.9 | 151 | 103 | -86.2 | 18.8 | 0 | 0 | 0 | 113.8 | |||||
| 23 | E | 32.5 | Very low | 29.8 | Very low | 143 Ų | 143 | 141.2 Ų | 141.2 | 67% | 0.668 | 76% | 0.756 | S | S | * | * | cis | -161.1 | 156.8 | 26 | -142.1 | 171.4 | -109.7 | 0 | 0 | 112.5 | ||||
| 24 | N | 32.8 | Very low | 29.8 | Very low | 119 Ų | 119 | 142.1 Ų | 142.1 | 64% | 0.636 | 76% | 0.759 | S | S | * | * | trans | 67.4 | 147.4 | 158.8 | -52.8 | -41.4 | 0 | 0 | 0 | 119.7 | ||||
| 25 | E | 33.4 | Very low | 29.6 | Very low | 155 Ų | 155 | 140.7 Ų | 140.7 | 72% | 0.724 | 75% | 0.752 | S | S | * | * | cis | -167 | 155.2 | -32.4 | -123.9 | -176.1 | 168.7 | 0 | 0 | 109.6 | ||||
| 26 | L | 28.7 | Very low | 29.8 | Very low | 140 Ų | 140 | 140.5 Ų | 140.5 | 73% | 0.733 | 75% | 0.747 | S | S | * | * | trans | 17.3 | 137.2 | 140.7 | -64.6 | 173.6 | 0 | 0 | 0 | 119.8 | ||||
| 27 | M | 30.1 | Very low | 29.8 | Very low | 157 Ų | 157 | 146 Ų | 146 | 77% | 0.773 | 75% | 0.752 | S | S | * | * | cis | -154 | -172.1 | 15.9 | -81.4 | -134 | -72.9 | 0 | 0 | 111.9 | ||||
| 28 | E | 26.1 | Very low | 29.8 | Very low | 172 Ų | 172 | 144.5 Ų | 144.5 | 80% | 0.804 | 74% | 0.744 | S | S | * | * | trans | -39.3 | 132.4 | 169.7 | -52.7 | 170.9 | 117.9 | 0 | 0 | 115.1 | ||||
| 29 | F | 28.8 | Very low | 29.7 | Very low | 200 Ų | 200 | 144.1 Ų | 144.1 | 88% | 0.877 | 74% | 0.738 | S | S | * | * | trans | -176.3 | 129 | 132.2 | -106.5 | -67.8 | 0 | 0 | 0 | 112.6 | ||||
| 30 | S | 25.7 | Very low | 29.5 | Very low | 98 Ų | 98 | 145.7 Ų | 145.7 | 69% | 0.685 | 74% | 0.744 | S | S | * | * | trans | 42.8 | 123.6 | 152.6 | 61.2 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 31 | S | 25.8 | Very low | 29.2 | Very low | 105 Ų | 105 | 147.9 Ų | 147.9 | 73% | 0.734 | 75% | 0.75 | S | S | * | * | trans | 59.5 | 116 | 141.5 | 64.1 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 32 | Y | 31.1 | Very low | 29 | Very low | 231 Ų | 231 | 148.9 Ų | 148.9 | 91% | 0.906 | 75% | 0.751 | S | S | * | * | -147.9 | 112 | 120.5 | -120.8 | -82.1 | 0 | 0 | 0 | 110.2 | |||||
| 33 | D | 29.2 | Very low | 29 | Very low | 125 Ų | 125 | 147.6 Ų | 147.6 | 67% | 0.668 | 75% | 0.75 | S | S | * | * | trans | -87 | 155.7 | 160.4 | -142.4 | -44.5 | 0 | 0 | 0 | 107 | D35 | D33-D35 PolarHBondContact OD1-N 3.35Š| ||
| 34 | P | 32.4 | Very low | 28.9 | Very low | 120 Ų | 120 | 146.5 Ų | 146.5 | 78% | 0.779 | 75% | 0.749 | S | S | * | * | -152.4 | 122.9 | 95.2 | 35 | -15.3 | 0 | 0 | 0 | 115.4 | |||||
| 35 | D | 23.9 | Very low | 28.9 | Very low | 131 Ų | 131 | 147.7 Ų | 147.7 | 70% | 0.701 | 76% | 0.755 | S | S | * | * | S | Bend | -120.1 | 139.2 | 128.8 | -139 | -29.2 | 0 | 0 | 0 | 112.1 | D33 | D33-D35 PolarHBondContact OD1-N 3.35Š| |
| 36 | Q | 29.2 | Very low | 28.5 | Very low | 147 Ų | 147 | 146.7 Ų | 146.7 | 69% | 0.687 | 76% | 0.755 | S | S | * | * | trans | 49.6 | 120.8 | 175 | -49.3 | -164.2 | 18.3 | 0 | 0 | 120.9 | ||||
| 37 | F | 27.7 | Very low | 28.5 | Very low | 215 Ų | 215 | 146.6 Ų | 146.6 | 94% | 0.943 | 76% | 0.755 | S | S | * | * | trans | -132.6 | 111.6 | 139.2 | -118.9 | -82.1 | 0 | 0 | 0 | 110 | ||||
| 38 | I | 29.8 | Very low | 28.5 | Very low | 131 Ų | 131 | 143.9 Ų | 143.9 | 67% | 0.672 | 75% | 0.747 | S | S | * | * | trans | -107.8 | 125.9 | 170.7 | -61.7 | 173.9 | 0 | 0 | 0 | 107.6 | ||||
| 39 | Q | 27.8 | Very low | 28.7 | Very low | 168 Ų | 168 | 143.9 Ų | 143.9 | 79% | 0.785 | 75% | 0.745 | S | S | * | * | -175 | 138.5 | 126.3 | -104.3 | 178.7 | 39.1 | 0 | 0 | 115.3 | |||||
| 40 | T | 27.3 | Very low | 28.8 | Very low | 111 Ų | 111 | 140.7 Ų | 140.7 | 68% | 0.681 | 73% | 0.733 | S | S | * | * | trans | 57.9 | 110.1 | 154.7 | 61.2 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 41 | H | 26.4 | Very low | 29 | Very low | 188 Ų | 188 | 141.8 Ų | 141.8 | 87% | 0.87 | 73% | 0.731 | S | S | * | * | -150.1 | 125 | 98.1 | -103.3 | 55.8 | 0 | 0 | 0 | 110.2 | |||||
| 42 | N | 28 | Very low | 29.3 | Very low | 133 Ų | 133 | 143.2 Ų | 143.2 | 71% | 0.711 | 73% | 0.726 | S | S | * | * | trans | -110.4 | 149.8 | 157.7 | -145.6 | 20 | 0 | 0 | 0 | 105 | ||||
| 43 | P | 33.4 | Very low | 29.5 | Very low | 110 Ų | 110 | 138.1 Ų | 138.1 | 71% | 0.714 | 71% | 0.709 | S | S | * | * | -143 | -178.4 | 58.4 | 41.3 | -23.1 | 0 | 0 | 0 | 115.7 | |||||
| 44 | D | 29 | Very low | 29.7 | Very low | 121 Ų | 121 | 139.6 Ų | 139.6 | 65% | 0.647 | 71% | 0.711 | S | S | * | * | trans | -58.2 | 140.9 | 174.9 | -39.5 | -98.4 | 0 | 0 | 0 | 113.8 | ||||
| 45 | N | 32.2 | Very low | 29.7 | Very low | 143 Ų | 143 | 139.6 Ų | 139.6 | 77% | 0.765 | 70% | 0.704 | S | S | * | * | 177.7 | 165.5 | 102.6 | -98.5 | -79 | 0 | 0 | 0 | 113.4 | |||||
| 46 | N | 25.8 | Very low | 30 | Very low | 135 Ų | 135 | 138.9 Ų | 138.9 | 72% | 0.722 | 70% | 0.704 | S | S | * | * | trans | -37.1 | 146.3 | 169.1 | -50.8 | -42 | 0 | 0 | 0 | 113.4 | ||||
| 47 | D | 29.8 | Very low | 30 | Very low | 138 Ų | 138 | 138.8 Ų | 138.8 | 74% | 0.738 | 71% | 0.707 | S | S | * | * | -165.4 | 143.8 | 73.7 | -108.8 | -23.9 | 0 | 0 | 0 | 115.8 | |||||
| 48 | T | 30.3 | Very low | 29.9 | Very low | 99 Ų | 99 | 134.7 Ų | 134.7 | 61% | 0.607 | 70% | 0.695 | S | S | * | * | trans | 50.8 | 131.8 | 143.2 | 64.9 | 0 | 0 | 0 | 0 | 123.9 | ||||
| 49 | F | 29.1 | Very low | 29.7 | Very low | 173 Ų | 173 | 133.7 Ų | 133.7 | 76% | 0.759 | 70% | 0.695 | S | S | * | * | trans | 67.5 | 143.2 | 130.3 | -77.6 | -126.2 | 0 | 0 | 0 | 118.7 | ||||
| 50 | E | 31.3 | Very low | 29.6 | Very low | 132 Ų | 132 | 132 Ų | 132 | 62% | 0.617 | 70% | 0.697 | S | S | * | * | cis | -167.1 | 155.1 | -5.8 | -132.3 | -169.5 | -165.3 | 0 | 0 | 109.7 | ||||
| 51 | N | 29.8 | Very low | 29.8 | Very low | 121 Ų | 121 | 135.9 Ų | 135.9 | 65% | 0.647 | 71% | 0.707 | S | S | * | * | trans | 54.2 | 157.3 | 143.7 | -68.7 | -24.3 | 0 | 0 | 0 | 120.4 | ||||
| 52 | E | 32.6 | Very low | 30 | Very low | 136 Ų | 136 | 135.5 Ų | 135.5 | 64% | 0.636 | 71% | 0.706 | S | S | * | * | cis | -158.2 | 177.5 | -7.1 | -122.5 | -168.2 | 149.6 | 0 | 0 | 105.8 | ||||
| 53 | K | 34.5 | Very low | 30.1 | Very low | 124 Ų | 124 | 135.9 Ų | 135.9 | 54% | 0.539 | 71% | 0.708 | S | S | . | * | cis | -156.6 | 152.7 | 9.1 | -142.1 | 161.3 | -173 | 114.7 | 0 | 104.8 | I55 | K53-I55 HydrophobicContact CG-CD1 4.48Å; K53-I55 HydrophobicContact CG-CG1 4.49Å | ||
| 54 | H | 33.1 | Very low | 29.9 | Very low | 155 Ų | 155 | 138.7 Ų | 138.7 | 72% | 0.718 | 71% | 0.711 | S | S | * | * | cis | -150.7 | 127.7 | 49.4 | -97 | -99.9 | 0 | 0 | 0 | 108.6 | ||||
| 55 | I | 32.8 | Very low | 29.8 | Very low | 121 Ų | 121 | 140.1 Ų | 140.1 | 62% | 0.621 | 71% | 0.714 | S | S | * | * | 76.4 | 124.7 | 89.7 | -78.8 | -177.7 | 0 | 0 | 0 | 114.2 | K53 | K53-I55 HydrophobicContact CG-CD1 4.48Å; K53-I55 HydrophobicContact CG-CG1 4.49Å | |||
| 56 | V | 30.2 | Very low | 29.8 | Very low | 116 Ų | 116 | 139.7 Ų | 139.7 | 70% | 0.703 | 71% | 0.712 | S | S | * | * | cis | -166.7 | 148.4 | -14.2 | 97.3 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 57 | L | 28.5 | Very low | 30 | Very low | 145 Ų | 145 | 137.8 Ų | 137.8 | 76% | 0.759 | 71% | 0.709 | S | S | * | * | trans | 28 | 121 | 153.4 | -61.2 | 164.6 | 0 | 0 | 0 | 124 | ||||
| 58 | N | 25.5 | Very low | 30 | Very low | 129 Ų | 129 | 137.4 Ų | 137.4 | 69% | 0.69 | 71% | 0.711 | S | S | * | * | 45.3 | 121.6 | 98.4 | -113.4 | 25.4 | 0 | 0 | 0 | 122.9 | |||||
| 59 | T | 25.7 | Very low | 30 | Very low | 109 Ų | 109 | 138.2 Ų | 138.2 | 67% | 0.669 | 72% | 0.716 | S | S | * | * | trans | 74.8 | 146.7 | 130.3 | 51.7 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 60 | T | 26.1 | Very low | 30 | Very low | 134 Ų | 134 | 136 Ų | 136 | 82% | 0.822 | 71% | 0.712 | S | S | * | * | trans | 69.3 | 106.4 | 157 | 46 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 61 | E | 31 | Very low | 29.9 | Very low | 191 Ų | 191 | 136.1 Ų | 136.1 | 89% | 0.893 | 72% | 0.716 | S | S | * | * | trans | -141.5 | 106.2 | 135.7 | -141.8 | 165.5 | -135.4 | 0 | 0 | 112.5 | ||||
| 62 | Q | 31.6 | Very low | 29.9 | Very low | 181 Ų | 181 | 136.5 Ų | 136.5 | 85% | 0.846 | 72% | 0.718 | S | S | * | * | trans | 34.7 | 122.6 | 150 | -58.1 | -174.2 | -11.4 | 0 | 0 | 124 | ||||
| 63 | N | 30.9 | Very low | 29.9 | Very low | 140 Ų | 140 | 138 Ų | 138 | 75% | 0.749 | 72% | 0.722 | S | S | * | * | trans | -26.5 | 147.8 | 152.1 | -51.2 | -9.5 | 0 | 0 | 0 | 118.4 | ||||
| 64 | Q | 27.9 | Very low | 29.6 | Very low | 169 Ų | 169 | 138.4 Ų | 138.4 | 79% | 0.79 | 73% | 0.73 | S | S | * | * | trans | 60.8 | 140.5 | 139.6 | -69.1 | 166.5 | -37.6 | 0 | 0 | 117.5 | ||||
| 65 | E | 28.1 | Very low | 29.4 | Very low | 151 Ų | 151 | 139.6 Ų | 139.6 | 71% | 0.706 | 74% | 0.736 | S | S | * | * | cis | -166.4 | 156.5 | 27.5 | -144.4 | -173.8 | -121.7 | 0 | 0 | 109.6 | ||||
| 66 | N | 30.5 | Very low | 29.4 | Very low | 135 Ų | 135 | 139.2 Ų | 139.2 | 72% | 0.722 | 74% | 0.739 | S | S | * | * | trans | 54.8 | 140.4 | 152.5 | -73.5 | -37.9 | 0 | 0 | 0 | 120.8 | ||||
| 67 | S | 30.5 | Very low | 29.5 | Very low | 95 Ų | 95 | 140.7 Ų | 140.7 | 66% | 0.664 | 74% | 0.741 | S | S | * | * | cis | -175.2 | 172.2 | -0.4 | 57 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 68 | V | 29.9 | Very low | 29.5 | Very low | 129 Ų | 129 | 141.1 Ų | 141.1 | 78% | 0.782 | 74% | 0.743 | S | S | * | * | trans | 81.7 | 116.3 | 145.4 | 156.8 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 69 | V | 30.3 | Very low | 29.5 | Very low | 117 Ų | 117 | 139.9 Ų | 139.9 | 71% | 0.709 | 74% | 0.744 | S | S | * | * | trans | 87 | 104.6 | 144.4 | 167.1 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 70 | N | 29.7 | Very low | 29.8 | Very low | 127 Ų | 127 | 143.1 Ų | 143.1 | 68% | 0.679 | 75% | 0.752 | S | S | * | * | trans | 64.6 | 132.6 | 131 | -67.7 | 12.3 | 0 | 0 | 0 | 124.9 | ||||
| 71 | I | 28.2 | Very low | 30 | Very low | 134 Ų | 134 | 142.9 Ų | 142.9 | 69% | 0.687 | 74% | 0.744 | S | S | * | * | 45.9 | 127.3 | 115.7 | -49.2 | 170.9 | 0 | 0 | 0 | 116.6 | |||||
| 72 | D | 31.3 | Very low | 29.7 | Very low | 129 Ų | 129 | 144 Ų | 144 | 69% | 0.69 | 74% | 0.74 | S | S | * | * | cis | -147.7 | 150.5 | 24.6 | -122.3 | -28.6 | 0 | 0 | 0 | 113.6 | ||||
| 73 | K | 31.6 | Very low | 29.7 | Very low | 166 Ų | 166 | 142.3 Ų | 142.3 | 72% | 0.722 | 74% | 0.737 | S | S | * | * | trans | 22.1 | 130 | 133.1 | -69.3 | -176.5 | 177.6 | -170.5 | 0 | 125.6 | ||||
| 74 | D | 28.5 | Very low | 29.7 | Very low | 133 Ų | 133 | 144.5 Ų | 144.5 | 71% | 0.711 | 74% | 0.743 | S | S | * | * | 72.9 | 126 | 120.4 | -50.4 | -21.8 | 0 | 0 | 0 | 124.3 | |||||
| 75 | E | 29.5 | Very low | 29.5 | Very low | 181 Ų | 181 | 144.7 Ų | 144.7 | 85% | 0.846 | 75% | 0.748 | S | S | * | * | trans | 62.5 | 164.3 | 159.1 | -56.1 | -160.7 | 123.1 | 0 | 0 | 119.1 | ||||
| 76 | V | 32.4 | Very low | 29.6 | Very low | 112 Ų | 112 | 146.1 Ų | 146.1 | 68% | 0.679 | 75% | 0.754 | S | S | * | * | cis | -148.9 | 168.2 | 19.2 | -158.2 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 77 | I | 31.5 | Very low | 29.7 | Very low | 147 Ų | 147 | 145.3 Ų | 145.3 | 75% | 0.754 | 76% | 0.758 | S | S | * | * | trans | 84.7 | 107.1 | 164.3 | -54 | 172.2 | 0 | 0 | 0 | 114.4 | ||||
| 78 | I | 27.8 | Very low | 29.8 | Very low | 154 Ų | 154 | 145.4 Ų | 145.4 | 79% | 0.79 | 76% | 0.758 | S | S | * | * | cis | 67.4 | 94.7 | 46.3 | -50.2 | 174 | 0 | 0 | 0 | 115 | ||||
| 79 | S | 26.5 | Very low | 29.8 | Very low | 103 Ų | 103 | 145.9 Ų | 145.9 | 72% | 0.72 | 76% | 0.757 | S | S | * | * | 178.7 | 156.9 | 127.2 | 59.1 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 80 | E | 32.8 | Very low | 29.8 | Very low | 177 Ų | 177 | 145.9 Ų | 145.9 | 83% | 0.827 | 75% | 0.753 | S | S | * | * | trans | 79.1 | 137.9 | 165.5 | -55.7 | -161.6 | 127 | 0 | 0 | 119.5 | ||||
| 81 | I | 29.1 | Very low | 30 | Very low | 130 Ų | 130 | 146.2 Ų | 146.2 | 67% | 0.667 | 75% | 0.754 | S | S | * | * | -176.6 | 134 | -60.3 | -94 | 162.2 | 0 | 0 | 0 | 110 | |||||
| 82 | R | 25.1 | Very low | 30.2 | Very low | 214 Ų | 214 | 146.6 Ų | 146.6 | 81% | 0.808 | 76% | 0.756 | S | S | * | * | trans | 75.5 | 160.6 | 155.1 | -162.6 | 174.3 | -67.2 | 144.1 | 4.4 | 119 | ||||
| 83 | D | 30.8 | Very low | 30.2 | Very low | 146 Ų | 146 | 146 Ų | 146 | 78% | 0.781 | 76% | 0.757 | S | S | * | * | trans | 80.9 | 117.9 | -174.7 | -56.7 | -16.2 | 0 | 0 | 0 | 113 | ||||
| 84 | E | 31.3 | Very low | 30.1 | Very low | 186 Ų | 186 | 144.1 Ų | 144.1 | 87% | 0.869 | 76% | 0.755 | S | S | * | * | cis | -136.6 | 140.8 | 3.9 | -63.5 | -179.8 | 109.4 | 0 | 0 | 113 | ||||
| 85 | I | 25.2 | Very low | 30.2 | Very low | 173 Ų | 173 | 145.6 Ų | 145.6 | 89% | 0.887 | 76% | 0.757 | S | S | * | * | trans | -141.5 | 98.5 | 150.6 | -61.5 | -179.9 | 0 | 0 | 0 | 107 | ||||
| 86 | Q | 28.8 | Very low | 30 | Very low | 181 Ų | 181 | 143.8 Ų | 143.8 | 85% | 0.846 | 75% | 0.752 | S | S | * | * | trans | -162.6 | 103.1 | 163.4 | -154.2 | 145 | 20.6 | 0 | 0 | 115.1 | ||||
| 87 | C | 32.4 | Very low | 30 | Very low | 117 Ų | 117 | 144.5 Ų | 144.5 | 79% | 0.791 | 76% | 0.759 | S | S | * | * | trans | 173.5 | 113.8 | 139 | -90 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 88 | S | 32.6 | Very low | 29.7 | Very low | 97 Ų | 97 | 143.4 Ų | 143.4 | 68% | 0.678 | 76% | 0.759 | S | S | * | * | 87.9 | 128.9 | 65.2 | -71 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 89 | N | 30.1 | Very low | 29.7 | Very low | 140 Ų | 140 | 142.5 Ų | 142.5 | 75% | 0.749 | 76% | 0.761 | S | S | * | * | cis | -166.2 | 177 | -7.3 | -138.6 | 48 | 0 | 0 | 0 | 113.1 | ||||
| 90 | D | 30.9 | Very low | 29.8 | Very low | 117 Ų | 117 | 145.3 Ų | 145.3 | 63% | 0.626 | 77% | 0.767 | S | S | * | * | trans | 95.5 | 110.8 | 154.2 | -63.6 | -8.3 | 0 | 0 | 0 | 121.9 | ||||
| 91 | N | 33.2 | Very low | 29.8 | Very low | 134 Ų | 134 | 144 Ų | 144 | 72% | 0.717 | 76% | 0.764 | S | S | * | * | trans | 64.9 | 100.7 | 150.5 | -52.2 | -36.2 | 0 | 0 | 0 | 119.1 | ||||
| 92 | I | 33.3 | Very low | 29.9 | Very low | 141 Ų | 141 | 147.4 Ų | 147.4 | 72% | 0.723 | 77% | 0.774 | S | S | * | * | cis | 76.8 | 133.4 | 29.6 | -38.8 | 156.1 | 0 | 0 | 0 | 110.8 | ||||
| 93 | V | 30.1 | Very low | 30.4 | Very low | 118 Ų | 118 | 142.5 Ų | 142.5 | 72% | 0.715 | 77% | 0.772 | S | S | * | * | cis | -152.6 | 155.8 | 41.9 | -142.7 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 94 | N | 31.2 | Very low | 30.4 | Very low | 126 Ų | 126 | 142.2 Ų | 142.2 | 67% | 0.674 | 77% | 0.771 | S | S | * | * | trans | 70.7 | 139.2 | 147.1 | -84.7 | 17.6 | 0 | 0 | 0 | 121.8 | ||||
| 95 | E | 29.2 | Very low | 30.3 | Very low | 163 Ų | 163 | 140.1 Ų | 140.1 | 76% | 0.762 | 76% | 0.764 | S | S | * | * | cis | -151.6 | 148.6 | -4.6 | -146.4 | 162 | -127 | 0 | 0 | 112.3 | ||||
| 96 | I | 26.8 | Very low | 30.7 | Very low | 143 Ų | 143 | 138.8 Ų | 138.8 | 73% | 0.733 | 76% | 0.759 | S | S | * | * | trans | -129 | 131.4 | 174.9 | -64.4 | 176.3 | 0 | 0 | 0 | 108.1 | ||||
| 97 | P | 30.9 | Very low | 30.8 | Very low | 127 Ų | 127 | 133 Ų | 133 | 83% | 0.825 | 75% | 0.749 | S | S | * | * | trans | -68.2 | 139.6 | -179.3 | 28.6 | -35.2 | 0 | 0 | 0 | 111.9 | ||||
| 98 | T | 25.7 | Very low | 30.9 | Very low | 124 Ų | 124 | 134.7 Ų | 134.7 | 76% | 0.761 | 75% | 0.748 | S | S | * | * | trans | -126.9 | 162.4 | -171.3 | 12 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 99 | T | 28.1 | Very low | 30.8 | Very low | 136 Ų | 136 | 136.3 Ų | 136.3 | 83% | 0.834 | 75% | 0.749 | S | S | * | * | trans | 72.5 | 109.2 | 162.3 | 44 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 100 | I | 29.2 | Very low | 30.8 | Very low | 162 Ų | 162 | 136.9 Ų | 136.9 | 83% | 0.831 | 75% | 0.747 | S | S | * | * | trans | -94.7 | 178 | 147.2 | -59.3 | 172.8 | 0 | 0 | 0 | 107.8 | ||||
| 101 | I | 33 | Very low | 30.7 | Very low | 149 Ų | 149 | 135.7 Ų | 135.7 | 76% | 0.764 | 75% | 0.748 | S | S | * | * | trans | 98.4 | 87.6 | 160.7 | -47.8 | 175.4 | 0 | 0 | 0 | 116.9 | ||||
| 102 | K | 29.7 | Very low | 30.5 | Very low | 202 Ų | 202 | 135.3 Ų | 135.3 | 88% | 0.878 | 75% | 0.75 | S | S | * | * | -144.1 | 140.4 | 118.7 | -69.3 | -175.5 | -176.3 | 167.4 | 0 | 106.6 | |||||
| 103 | S | 35.1 | Very low | 30.5 | Very low | 110 Ų | 110 | 135.5 Ų | 135.5 | 77% | 0.769 | 75% | 0.752 | S | S | * | * | cis | -157.6 | 150.4 | -2.3 | 43.6 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 104 | N | 32.3 | Very low | 30.5 | Very low | 141 Ų | 141 | 138.1 Ų | 138.1 | 75% | 0.754 | 75% | 0.754 | S | S | * | * | trans | -84 | 152.7 | -177.6 | -85.6 | 9 | 0 | 0 | 0 | 114.3 | ||||
| 105 | L | 29.5 | Very low | 30.4 | Very low | 141 Ų | 141 | 137.7 Ų | 137.7 | 74% | 0.738 | 75% | 0.752 | S | S | * | * | trans | 54.3 | 154.4 | 137.3 | -59.3 | 170.4 | 0 | 0 | 0 | 118.7 | ||||
| 106 | D | 32.4 | Very low | 30.3 | Very low | 146 Ų | 146 | 136.5 Ų | 136.5 | 78% | 0.781 | 75% | 0.751 | S | S | * | * | cis | -148.7 | 173.7 | 2.8 | -97.5 | -45.5 | 0 | 0 | 0 | 107.2 | ||||
| 107 | G | 30.8 | Very low | 30.3 | Very low | 60 Ų | 60 | 136.6 Ų | 136.6 | 62% | 0.619 | 75% | 0.753 | S | S | * | * | cis | 155.4 | -163.2 | 2.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 108 | I | 34.1 | Very low | 30.3 | Very low | 152 Ų | 152 | 136.2 Ų | 136.2 | 78% | 0.779 | 75% | 0.748 | S | S | * | * | trans | 80.9 | 92.7 | 160.8 | -47 | 176.6 | 0 | 0 | 0 | 119.4 | ||||
| 109 | N | 32.1 | Very low | 30.4 | Very low | 130 Ų | 130 | 138.8 Ų | 138.8 | 70% | 0.695 | 75% | 0.749 | S | S | * | * | 54.7 | 162.2 | 119.2 | -51.1 | 10.3 | 0 | 0 | 0 | 121.7 | |||||
| 110 | E | 29.3 | Very low | 30.5 | Very low | 153 Ų | 153 | 138.8 Ų | 138.8 | 72% | 0.715 | 74% | 0.743 | S | S | * | * | cis | -158.5 | 160.5 | 14.9 | -147.2 | 144.2 | -100.9 | 0 | 0 | 114.2 | ||||
| 111 | S | 29.1 | Very low | 30.5 | Very low | 91 Ų | 91 | 138.4 Ų | 138.4 | 64% | 0.636 | 74% | 0.743 | S | S | * | * | trans | 46.2 | 102.7 | 150.6 | 66.4 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 112 | T | 29.8 | Very low | 30.3 | Very low | 126 Ų | 126 | 134.1 Ų | 134.1 | 77% | 0.773 | 74% | 0.735 | S | S | * | * | 70.6 | 133.4 | 89.4 | 57.2 | 0 | 0 | 0 | 0 | 118 | |||||
| 113 | L | 31.5 | Very low | 30.1 | Very low | 145 Ų | 145 | 129.6 Ų | 129.6 | 76% | 0.759 | 73% | 0.729 | S | S | * | * | trans | 163.7 | 128.7 | 130 | -104.5 | 80.8 | 0 | 0 | 0 | 114.1 | ||||
| 114 | F | 31.4 | Very low | 29.7 | Very low | 173 Ų | 173 | 130.7 Ų | 130.7 | 76% | 0.759 | 73% | 0.726 | S | S | * | * | trans | 58.2 | 133.3 | 152.2 | -68.6 | -101.1 | 0 | 0 | 0 | 124.3 | ||||
| 115 | D | 28.5 | Very low | 29.7 | Very low | 117 Ų | 117 | 130 Ų | 130 | 63% | 0.626 | 72% | 0.722 | S | S | * | * | trans | 74.4 | 112.6 | 133.2 | -57.6 | 0.7 | 0 | 0 | 0 | 124.8 | ||||
| 116 | D | 27.3 | Very low | 30 | Very low | 138 Ų | 138 | 130.4 Ų | 130.4 | 74% | 0.738 | 73% | 0.726 | S | S | * | * | 68.5 | 121.6 | 114.1 | -56.3 | -6 | 0 | 0 | 0 | 124 | |||||
| 117 | D | 26.6 | Very low | 30 | Very low | 145 Ų | 145 | 131 Ų | 131 | 78% | 0.775 | 73% | 0.728 | S | S | * | * | 96.3 | 155.3 | 122.6 | -106.2 | -14.9 | 0 | 0 | 0 | 125.2 | |||||
| 118 | V | 31.1 | Very low | 30.1 | Very low | 119 Ų | 119 | 135.6 Ų | 135.6 | 72% | 0.721 | 74% | 0.739 | S | S | * | * | trans | 76.2 | 75.5 | 165 | -152.6 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 119 | F | 27.9 | Very low | 29.8 | Very low | 179 Ų | 179 | 132.2 Ų | 132.2 | 79% | 0.785 | 73% | 0.734 | S | S | * | * | 35.7 | 144.3 | 108.8 | -92.5 | -69.6 | 0 | 0 | 0 | 124.3 | |||||
| 120 | L | 30.5 | Very low | 29.7 | Very low | 136 Ų | 136 | 133.3 Ų | 133.3 | 71% | 0.712 | 74% | 0.74 | S | S | * | * | trans | 90.9 | 141.7 | 140.5 | -78 | 176 | 0 | 0 | 0 | 123.2 | ||||
| 121 | N | 29.1 | Very low | 29.9 | Very low | 154 Ų | 154 | 134 Ų | 134 | 82% | 0.824 | 74% | 0.743 | S | S | * | * | trans | 74 | 133.4 | 167.7 | -46.6 | -57.3 | 0 | 0 | 0 | 116.6 | ||||
| 122 | G | 27.2 | Very low | 29.9 | Very low | 59 Ų | 59 | 140.1 Ų | 140.1 | 61% | 0.608 | 76% | 0.758 | S | S | * | * | cis | -165.1 | 143.8 | -5.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 123 | S | 27 | Very low | 30.1 | Very low | 106 Ų | 106 | 141.7 Ų | 141.7 | 74% | 0.741 | 76% | 0.76 | S | S | * | * | 80.4 | 126.9 | 87.3 | 69.6 | 0 | 0 | 0 | 0 | 114 | |||||
| 124 | N | 27 | Very low | 29.8 | Very low | 133 Ų | 133 | 145.1 Ų | 145.1 | 71% | 0.711 | 76% | 0.763 | S | S | * | * | trans | 72.3 | 142.7 | 161.7 | -67.6 | 58.3 | 0 | 0 | 0 | 116 | ||||
| 125 | D | 31.6 | Very low | 29.6 | Very low | 126 Ų | 126 | 142.6 Ų | 142.6 | 67% | 0.674 | 76% | 0.756 | S | S | * | * | cis | -152.1 | -166.3 | -2.8 | -96.5 | -27.3 | 0 | 0 | 0 | 109.2 | ||||
| 126 | D | 35 | Very low | 29.5 | Very low | 151 Ų | 151 | 143.5 Ų | 143.5 | 81% | 0.807 | 76% | 0.756 | S | S | * | * | trans | 79.7 | 86.2 | 163.5 | -56.6 | -22.5 | 0 | 0 | 0 | 118.3 | ||||
| 127 | D | 32.3 | Very low | 29.6 | Very low | 157 Ų | 157 | 143.8 Ų | 143.8 | 84% | 0.84 | 75% | 0.753 | S | S | * | * | 28.5 | 155 | 112.2 | -66.7 | -21.1 | 0 | 0 | 0 | 122.5 | |||||
| 128 | D | 32.8 | Very low | 29.6 | Very low | 158 Ų | 158 | 142.5 Ų | 142.5 | 85% | 0.845 | 75% | 0.746 | S | S | * | * | trans | 71.1 | 108.2 | 161.4 | -86.9 | -15.1 | 0 | 0 | 0 | 121 | ||||
| 129 | A | 27.8 | Very low | 29.6 | Very low | 81 Ų | 81 | 142.8 Ų | 142.8 | 67% | 0.669 | 74% | 0.743 | S | S | * | * | 53.4 | 100.6 | 128.9 | 0 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 130 | N | 30.7 | Very low | 29.6 | Very low | 153 Ų | 153 | 143.6 Ų | 143.6 | 82% | 0.818 | 74% | 0.743 | S | S | * | * | trans | -131.7 | 117.4 | 130.6 | -94.4 | -74.6 | 0 | 0 | 0 | 108.5 | ||||
| 131 | H | 33.1 | Very low | 29.8 | Very low | 168 Ų | 168 | 144.9 Ų | 144.9 | 78% | 0.778 | 75% | 0.745 | S | S | * | * | 47.4 | 103.7 | 74 | -95.6 | 53.6 | 0 | 0 | 0 | 112.5 | I133 | H131-I133 VanDerWaalsContact C-N 3.29Å; H131-I133 PolarHBondContact O-N 3.5Å | |||
| 132 | K | 30 | Very low | 30.1 | Very low | 218 Ų | 218 | 145.2 Ų | 145.2 | 95% | 0.948 | 74% | 0.736 | S | S | * | * | trans | -74.1 | 85.3 | 178.3 | -163.2 | 172.5 | -174.4 | 176.9 | 0 | 110.1 | ||||
| 133 | I | 34.2 | Very low | 30.2 | Very low | 159 Ų | 159 | 149.2 Ų | 149.2 | 82% | 0.815 | 74% | 0.739 | S | S | * | * | trans | 5.5 | 118.4 | 164.1 | -56 | 172.6 | 0 | 0 | 0 | 115.2 | H131 | H131-I133 VanDerWaalsContact C-N 3.29Å; H131-I133 PolarHBondContact O-N 3.5Å | ||
| 134 | R | 24.3 | Very low | 30.2 | Very low | 218 Ų | 218 | 149.2 Ų | 149.2 | 82% | 0.823 | 73% | 0.734 | S | S | * | * | trans | -131.3 | 151.8 | 155.1 | -161.7 | -176 | -180 | 173 | 4.3 | 107.2 | ||||
| 135 | I | 27.9 | Very low | 30.3 | Very low | 120 Ų | 120 | 148.7 Ų | 148.7 | 62% | 0.615 | 73% | 0.728 | S | S | * | * | trans | 70.3 | 129.4 | 164.5 | -80.2 | 147.7 | 0 | 0 | 0 | 114.2 | ||||
| 136 | E | 26.4 | Very low | 30.1 | Very low | 135 Ų | 135 | 151 Ų | 151 | 63% | 0.631 | 73% | 0.727 | S | S | * | * | cis | -178.1 | 173.6 | -9.8 | -140.4 | 154.5 | -137.9 | 0 | 0 | 108.6 | ||||
| 137 | H | 28.1 | Very low | 29.9 | Very low | 144 Ų | 144 | 150 Ų | 150 | 67% | 0.667 | 72% | 0.722 | S | S | * | * | trans | 62.5 | 158.5 | 153.8 | -69 | -55.5 | 0 | 0 | 0 | 117.4 | ||||
| 138 | D | 28 | Very low | 29.8 | Very low | 118 Ų | 118 | 149.2 Ų | 149.2 | 63% | 0.631 | 71% | 0.713 | S | S | * | * | cis | -155.8 | 179 | -14 | -108.6 | -15.2 | 0 | 0 | 0 | 106.1 | ||||
| 139 | D | 31.5 | Very low | 29.8 | Very low | 125 Ų | 125 | 147.8 Ų | 147.8 | 67% | 0.668 | 71% | 0.705 | S | S | * | * | cis | -161.6 | 168.3 | 33.5 | -139.6 | 2.8 | 0 | 0 | 0 | 111 | ||||
| 140 | Y | 27.7 | Very low | 30 | Very low | 197 Ų | 197 | 151 Ų | 151 | 77% | 0.773 | 71% | 0.707 | S | S | * | * | trans | -40.3 | 162.2 | 175.8 | -51.4 | -98.8 | 0 | 0 | 0 | 117.3 | ||||
| 141 | Q | 33.6 | Very low | 30.1 | Very low | 163 Ų | 163 | 150.5 Ų | 150.5 | 76% | 0.762 | 70% | 0.703 | S | S | * | * | -163.8 | 136.2 | 112.3 | -86.4 | -116.2 | -36.4 | 0 | 0 | 114.1 | |||||
| 142 | Y | 35.2 | Very low | 30.1 | Very low | 160 Ų | 160 | 148.6 Ų | 148.6 | 63% | 0.627 | 70% | 0.697 | S | S | * | * | trans | 64 | 106.6 | 142.1 | -81.2 | -113.3 | 0 | 0 | 0 | 119.3 | ||||
| 143 | E | 30.7 | Very low | 30.3 | Very low | 143 Ų | 143 | 145.7 Ų | 145.7 | 67% | 0.668 | 69% | 0.685 | S | S | * | * | 94.6 | 122.5 | 86.4 | -84 | -162.8 | 178.6 | 0 | 0 | 110.7 | |||||
| 144 | T | 26 | Very low | 30.2 | Very low | 106 Ų | 106 | 143.8 Ų | 143.8 | 65% | 0.65 | 67% | 0.672 | S | S | * | * | 39.7 | 130.4 | 94.9 | 45 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 145 | E | 29.2 | Very low | 30.6 | Very low | 122 Ų | 122 | 140.2 Ų | 140.2 | 57% | 0.57 | 67% | 0.665 | S | S | * | * | cis | -167.7 | 169.4 | 30.6 | -132.6 | 179.7 | -152.4 | 0 | 0 | 112.7 | ||||
| 146 | R | 27.5 | Very low | 30.9 | Very low | 175 Ų | 175 | 142.3 Ų | 142.3 | 66% | 0.66 | 67% | 0.672 | S | S | * | * | trans | 27.8 | 122.2 | 144.7 | -71.4 | 168.6 | -160.5 | 136.1 | 16.7 | 118.2 | ||||
| 147 | N | 31.7 | Very low | 31.1 | Very low | 130 Ų | 130 | 141.1 Ų | 141.1 | 70% | 0.695 | 67% | 0.67 | S | S | * | * | 178.4 | 160.1 | 76.8 | -88.7 | -51 | 0 | 0 | 0 | 109.2 | |||||
| 148 | Q | 30.2 | Very low | 31.3 | Very low | 141 Ų | 141 | 140.3 Ų | 140.3 | 66% | 0.659 | 67% | 0.669 | S | S | * | * | cis | -177.1 | 152 | -23.5 | -117.6 | 179.6 | 9.3 | 0 | 0 | 105.6 | ||||
| 149 | N | 32.5 | Very low | 31.6 | Very low | 128 Ų | 128 | 140.7 Ų | 140.7 | 68% | 0.684 | 68% | 0.678 | S | S | * | * | trans | 69.4 | 149.1 | 165.4 | -53 | -7.6 | 0 | 0 | 0 | 116.3 | ||||
| 150 | E | 31.7 | Very low | 31.5 | Very low | 149 Ų | 149 | 143.5 Ų | 143.5 | 70% | 0.696 | 69% | 0.685 | S | S | * | * | cis | -164.1 | 136.8 | -10.3 | -114.5 | 177 | 141.7 | 0 | 0 | 109.9 | ||||
| 151 | L | 32.7 | Very low | 31.5 | Very low | 141 Ų | 141 | 141.5 Ų | 141.5 | 74% | 0.738 | 69% | 0.686 | S | S | * | * | trans | 64.9 | 154.4 | 147.3 | -56.9 | 165.1 | 0 | 0 | 0 | 117.7 | ||||
| 152 | I | 33.2 | Very low | 31.2 | Very low | 129 Ų | 129 | 142 Ų | 142 | 66% | 0.662 | 69% | 0.69 | S | S | * | * | cis | -160.7 | 139.5 | 10.1 | -135.7 | 160.3 | 0 | 0 | 0 | 111.6 | ||||
| 153 | K | 33.1 | Very low | 30.7 | Very low | 157 Ų | 157 | 140.8 Ų | 140.8 | 68% | 0.683 | 70% | 0.695 | S | S | * | * | trans | 61.9 | 158.5 | 153.7 | -67.6 | 168.8 | 159.5 | -72.2 | 0 | 119.6 | ||||
| 154 | Q | 33.1 | Very low | 30.7 | Very low | 119 Ų | 119 | 141.9 Ų | 141.9 | 56% | 0.556 | 70% | 0.7 | S | S | * | * | cis | -175.3 | 166.6 | -9.3 | -104.2 | 179.6 | -43.6 | 0 | 0 | 109.5 | ||||
| 155 | E | 32.6 | Very low | 30.8 | Very low | 142 Ų | 142 | 143.7 Ų | 143.7 | 66% | 0.664 | 70% | 0.701 | S | S | * | * | cis | -169.8 | 130.4 | -25.5 | -124.5 | 157.9 | -135 | 0 | 0 | 108.6 | ||||
| 156 | E | 33.5 | Very low | 30.8 | Very low | 164 Ų | 164 | 140.7 Ų | 140.7 | 77% | 0.766 | 70% | 0.703 | S | S | * | * | trans | 65.5 | 152.9 | 154.6 | -70.7 | -178.5 | -148.8 | 0 | 0 | 122.1 | ||||
| 157 | N | 32.2 | Very low | 31 | Very low | 111 Ų | 111 | 139.1 Ų | 139.1 | 59% | 0.594 | 71% | 0.708 | S | S | * | * | cis | -147.3 | 138 | -1.3 | -95 | -43.9 | 0 | 0 | 0 | 109 | ||||
| 158 | I | 31.8 | Very low | 30.9 | Very low | 126 Ų | 126 | 136.7 Ų | 136.7 | 65% | 0.646 | 71% | 0.713 | S | S | * | * | 69.9 | 122.3 | 71.5 | -63.6 | -178.5 | 0 | 0 | 0 | 112.8 | F160 | I158-F160 HydrophobicContact CG2-CD2 3.78Å; I158-F160 HydrophobicContact CG2-CE2 4.11Å | |||
| 159 | P | 34 | Very low | 30.7 | Very low | 126 Ų | 126 | 137.2 Ų | 137.2 | 82% | 0.818 | 72% | 0.721 | S | S | * | * | -140.7 | -175.6 | 54.6 | 40.8 | -23.1 | 0 | 0 | 0 | 116.2 | |||||
| 160 | F | 29.5 | Very low | 30.6 | Very low | 184 Ų | 184 | 139.5 Ų | 139.5 | 81% | 0.807 | 73% | 0.727 | S | S | * | * | cis | -153.7 | 162.5 | -49.2 | -137.5 | -84.9 | 0 | 0 | 0 | 107.2 | I158 | I158-F160 HydrophobicContact CG2-CD2 3.78Å; I158-F160 HydrophobicContact CG2-CE2 4.11Å | ||
| 161 | I | 28.3 | Very low | 30.4 | Very low | 156 Ų | 156 | 138.8 Ų | 138.8 | 80% | 0.8 | 73% | 0.726 | S | S | * | * | trans | -116.3 | 166.2 | -160.7 | -69.6 | 173 | 0 | 0 | 0 | 114.5 | ||||
| 162 | M | 25.5 | Very low | 30.7 | Very low | 173 Ų | 173 | 137.2 Ų | 137.2 | 85% | 0.852 | 73% | 0.725 | S | S | * | * | trans | -49.9 | 173.9 | 178.3 | -51.2 | 170 | -174.6 | 0 | 0 | 117.7 | ||||
| 163 | N | 25.8 | Very low | 31 | Very low | 134 Ų | 134 | 135.9 Ų | 135.9 | 72% | 0.717 | 73% | 0.725 | S | S | * | * | trans | -22.2 | 150.1 | 154.8 | -55.4 | 39.3 | 0 | 0 | 0 | 115.9 | ||||
| 164 | E | 30.3 | Very low | 30.8 | Very low | 167 Ų | 167 | 138.8 Ų | 138.8 | 78% | 0.78 | 73% | 0.731 | S | S | * | * | cis | -158 | -169.7 | -3.2 | -116.4 | 170.9 | -84.5 | 0 | 0 | 108.3 | ||||
| 165 | E | 27.6 | Very low | 30.7 | Very low | 143 Ų | 143 | 143.8 Ų | 143.8 | 67% | 0.668 | 75% | 0.745 | S | S | * | * | cis | -143 | 175.6 | 17.9 | -175.8 | -83.8 | 137.6 | 0 | 0 | 108.6 | N167 | E165-N167 PolarHBondContact OE1-N 2.63Š| ||
| 166 | G | 30.2 | Very low | 30.4 | Very low | 60 Ų | 60 | 144 Ų | 144 | 62% | 0.619 | 74% | 0.744 | S | S | * | * | trans | 174.7 | 67.4 | 161.8 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 167 | N | 31.4 | Very low | 30.2 | Very low | 142 Ų | 142 | 144.5 Ų | 144.5 | 76% | 0.759 | 74% | 0.74 | S | S | * | * | trans | 54.8 | 108.4 | 157.7 | -81.4 | -90 | 0 | 0 | 0 | 119.5 | E165 | E165-N167 PolarHBondContact OE1-N 2.63Š| ||
| 168 | G | 29.9 | Very low | 29.8 | Very low | 79 Ų | 79 | 144.8 Ų | 144.8 | 81% | 0.814 | 75% | 0.746 | S | S | * | * | 103.2 | 103.7 | 101.8 | 0 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 169 | D | 25.7 | Very low | 29.7 | Very low | 151 Ų | 151 | 145.5 Ų | 145.5 | 81% | 0.807 | 75% | 0.75 | S | S | * | * | trans | -149.9 | 109.9 | 165.2 | -167.7 | 2.5 | 0 | 0 | 0 | 111 | ||||
| 170 | H | 30.8 | Very low | 29.3 | Very low | 176 Ų | 176 | 144.8 Ų | 144.8 | 82% | 0.815 | 74% | 0.744 | S | S | * | * | trans | -160.7 | 94.6 | 171 | -113.9 | 48.8 | 0 | 0 | 0 | 116.6 | ||||
| 171 | I | 28.1 | Very low | 29.1 | Very low | 134 Ų | 134 | 140.5 Ų | 140.5 | 69% | 0.687 | 74% | 0.737 | S | S | * | * | trans | 72.9 | -172.2 | 139.6 | -10.9 | -175.6 | 0 | 0 | 0 | 119 | ||||
| 172 | P | 39.2 | Very low | 29.1 | Very low | 108 Ų | 108 | 141.5 Ų | 141.5 | 70% | 0.701 | 74% | 0.735 | S | S | * | * | -122.8 | -148.7 | -119 | 46.7 | -27.2 | 0 | 0 | 0 | 113.6 | |||||
| 173 | P | 38.5 | Very low | 29.1 | Very low | 102 Ų | 102 | 140.5 Ų | 140.5 | 66% | 0.662 | 73% | 0.729 | S | S | * | * | cis | -144.2 | 174.8 | -7.2 | 39.9 | -19 | 0 | 0 | 0 | 120.2 | ||||
| 174 | R | 28.8 | Very low | 29.2 | Very low | 218 Ų | 218 | 140.8 Ų | 140.8 | 82% | 0.823 | 73% | 0.729 | S | S | * | * | trans | 83.3 | 131.5 | 137.7 | -94 | 170.3 | -179.9 | -177.4 | 2.4 | 122.7 | ||||
| 175 | R | 30.7 | Very low | 28.9 | Very low | 223 Ų | 223 | 137.4 Ų | 137.4 | 84% | 0.842 | 72% | 0.724 | S | S | * | * | trans | 80.8 | 139.5 | 154.1 | -66 | 175.8 | 179.9 | -173.3 | 2 | 118 | ||||
| 176 | K | 25.6 | Very low | 28.9 | Very low | 148 Ų | 148 | 137.3 Ų | 137.3 | 64% | 0.643 | 73% | 0.733 | S | S | * | * | cis | -172 | 155.9 | -19.8 | -149.7 | 169.1 | 173.3 | -161.3 | 0 | 110.8 | ||||
| 177 | Y | 29.6 | Very low | 29 | Very low | 174 Ų | 174 | 139.4 Ų | 139.4 | 68% | 0.682 | 74% | 0.738 | S | S | * | * | trans | 84.1 | 113.5 | 159.1 | -63.1 | -64.3 | 0 | 0 | 0 | 122.4 | ||||
| 178 | T | 24.8 | Very low | 29.4 | Very low | 117 Ų | 117 | 138 Ų | 138 | 72% | 0.718 | 74% | 0.737 | S | S | * | * | 51.3 | 148 | 128.9 | 57.6 | 0 | 0 | 0 | 0 | 122.4 | |||||
| 179 | L | 29.1 | Very low | 29.7 | Very low | 141 Ų | 141 | 138.9 Ų | 138.9 | 74% | 0.738 | 73% | 0.728 | S | S | * | * | cis | -162.2 | 154.2 | 9.4 | -120.3 | 164.6 | 0 | 0 | 0 | 111.6 | ||||
| 180 | T | 26.7 | Very low | 29.8 | Very low | 111 Ų | 111 | 138.8 Ų | 138.8 | 68% | 0.681 | 73% | 0.727 | S | S | * | * | trans | 27 | 114.9 | 155.3 | 47.5 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 181 | S | 25.4 | Very low | 29.6 | Very low | 94 Ų | 94 | 136.1 Ų | 136.1 | 66% | 0.657 | 72% | 0.724 | S | S | * | * | 26.9 | 120.7 | 127.3 | 60.1 | 0 | 0 | 0 | 0 | 121.9 | |||||
| 182 | F | 28.3 | Very low | 29.7 | Very low | 177 Ų | 177 | 135.1 Ų | 135.1 | 78% | 0.776 | 73% | 0.728 | S | S | * | * | -175 | 142.2 | 103.8 | -117.5 | -95.1 | 0 | 0 | 0 | 112.5 | |||||
| 183 | E | 25.4 | Very low | 29.4 | Very low | 152 Ų | 152 | 136.7 Ų | 136.7 | 71% | 0.71 | 73% | 0.729 | S | S | * | * | trans | 48.8 | 149.3 | 151.2 | -88.8 | 173.1 | -150.6 | 0 | 0 | 126.7 | ||||
| 184 | L | 27.6 | Very low | 29.1 | Very low | 140 Ų | 140 | 138.1 Ų | 138.1 | 73% | 0.733 | 74% | 0.738 | S | S | * | * | trans | 68.6 | 82.8 | 148.1 | -67.6 | 166.5 | 0 | 0 | 0 | 122.7 | ||||
| 185 | S | 24.3 | Very low | 29.1 | Very low | 95 Ų | 95 | 136.1 Ų | 136.1 | 66% | 0.664 | 74% | 0.736 | S | S | * | * | 57.2 | 137.9 | 113.4 | 72.8 | 0 | 0 | 0 | 0 | 124.4 | |||||
| 186 | V | 26.8 | Very low | 29.1 | Very low | 142 Ų | 142 | 132.4 Ų | 132.4 | 86% | 0.861 | 73% | 0.732 | S | S | * | * | trans | 89.1 | 139.6 | 157.1 | -162.6 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 187 | S | 33.4 | Very low | 29.4 | Very low | 104 Ų | 104 | 131.7 Ų | 131.7 | 73% | 0.727 | 74% | 0.743 | S | S | * | * | trans | -81.7 | -162.2 | -179.7 | -6.8 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 188 | P | 39.4 | Very low | 29.6 | Very low | 113 Ų | 113 | 126.6 Ų | 126.6 | 73% | 0.734 | 74% | 0.742 | S | S | * | * | cis | -109.6 | -96.3 | -3.1 | 29.6 | -7.6 | 0 | 0 | 0 | 114.2 | ||||
| 189 | P | 34.9 | Very low | 30.1 | Very low | 97 Ų | 97 | 126.4 Ų | 126.4 | 63% | 0.63 | 75% | 0.746 | S | S | * | * | cis | -134.1 | 139.9 | -9.6 | 35.6 | -14.1 | 0 | 0 | 0 | 118.6 | ||||
| 190 | N | 28.7 | Very low | 30.5 | Very low | 148 Ų | 148 | 124.6 Ų | 124.6 | 79% | 0.791 | 75% | 0.745 | S | S | * | * | trans | 66.1 | 153.1 | 133.9 | -63.9 | -16.8 | 0 | 0 | 0 | 122.1 | ||||
| 191 | V | 27 | Very low | 30.5 | Very low | 121 Ų | 121 | 129.9 Ų | 129.9 | 73% | 0.733 | 75% | 0.753 | S | S | * | * | cis | -165.7 | 168.3 | -8.5 | 122.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 192 | S | 29.9 | Very low | 30.4 | Very low | 112 Ų | 112 | 131.1 Ų | 131.1 | 78% | 0.783 | 75% | 0.752 | S | S | * | * | trans | 96.8 | 155.8 | 161.4 | -79.9 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 193 | I | 33.1 | Very low | 30.3 | Very low | 141 Ų | 141 | 130 Ų | 130 | 72% | 0.723 | 75% | 0.747 | S | S | * | * | trans | -135.3 | 136.9 | -155.8 | -58.8 | 162.2 | 0 | 0 | 0 | 111.4 | K195 | I193-K195 HydrophobicContact CG2-CG 4.22Š| ||
| 194 | P | 31.5 | Very low | 30.4 | Very low | 132 Ų | 132 | 128.6 Ų | 128.6 | 86% | 0.857 | 75% | 0.748 | S | S | * | * | -122.6 | 175.4 | 129.6 | -0.3 | 22 | 0 | 0 | 0 | 113 | |||||
| 195 | K | 29.8 | Very low | 30.4 | Very low | 176 Ų | 176 | 126.9 Ų | 126.9 | 77% | 0.765 | 74% | 0.739 | S | S | * | * | trans | -137.9 | 157.7 | -177.8 | -78.1 | -176.8 | 174.4 | 177 | 0 | 112.4 | I193 | I193-K195 HydrophobicContact CG2-CG 4.22Š| ||
| 196 | L | 29.7 | Very low | 30.7 | Very low | 146 Ų | 146 | 128.3 Ų | 128.3 | 76% | 0.764 | 75% | 0.747 | S | S | * | * | trans | 69.8 | 164.2 | 159 | -72.2 | 158.2 | 0 | 0 | 0 | 115.1 | ||||
| 197 | P | 32.1 | Very low | 30.8 | Very low | 133 Ų | 133 | 126.5 Ų | 126.5 | 86% | 0.864 | 73% | 0.731 | S | S | * | * | cis | -73 | 175.8 | 7.1 | 33.8 | -37.4 | 0 | 0 | 0 | 113.5 | ||||
| 198 | G | 33.2 | Very low | 30.8 | Very low | 66 Ų | 66 | 129 Ų | 129 | 68% | 0.68 | 74% | 0.735 | S | S | * | * | cis | 129.6 | 147 | 14.1 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 199 | S | 35.7 | Very low | 30.1 | Very low | 113 Ų | 113 | 131.8 Ų | 131.8 | 79% | 0.79 | 74% | 0.735 | S | S | * | * | cis | -135.2 | -170.1 | 12.7 | -165.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 200 | S | 38.4 | Very low | 29.6 | Very low | 103 Ų | 103 | 137.6 Ų | 137.6 | 72% | 0.72 | 75% | 0.745 | S | S | * | * | trans | 18.5 | 116.6 | 167.4 | -57.9 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 201 | R | 26.1 | Very low | 29.4 | Very low | 222 Ų | 222 | 139.7 Ų | 139.7 | 84% | 0.838 | 75% | 0.747 | S | S | * | * | cis | 63.5 | 123.9 | 10.6 | -131.5 | -176.7 | -162.9 | -177.4 | 7.4 | 116.1 | ||||
| 202 | N | 24.1 | Very low | 29.6 | Very low | 120 Ų | 120 | 138.8 Ų | 138.8 | 64% | 0.642 | 74% | 0.743 | S | S | * | * | trans | 78.4 | 143.9 | 170.2 | -51.6 | -66.6 | 0 | 0 | 0 | 115.5 | ||||
| 203 | K | 25.1 | Very low | 29.7 | Very low | 155 Ų | 155 | 142.4 Ų | 142.4 | 67% | 0.674 | 75% | 0.745 | S | S | * | * | cis | -152.7 | 165.9 | -7.5 | -99.7 | 150 | -162.6 | 150.9 | 0 | 105.5 | L205 | K203-L205 HydrophobicContact CG-CD1 4.24Š| ||
| 204 | T | 28.1 | Very low | 29.6 | Very low | 121 Ų | 121 | 144.1 Ų | 144.1 | 74% | 0.742 | 75% | 0.747 | S | S | * | * | cis | -159.7 | 143.8 | 42.5 | -29.2 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 205 | L | 26.7 | Very low | 29.4 | Very low | 104 Ų | 104 | 142.9 Ų | 142.9 | 55% | 0.545 | 74% | 0.737 | S | S | . | * | cis | 60.4 | 146.7 | 48.4 | -52.5 | 179.7 | 0 | 0 | 0 | 111.4 | K203 I207 | K203-L205 HydrophobicContact CG-CD1 4.24Å; L205-I207 HydrophobicContact CB-CG1 4.17Å | ||
| 206 | P | 30.7 | Very low | 29.2 | Very low | 126 Ų | 126 | 139.6 Ų | 139.6 | 82% | 0.818 | 74% | 0.736 | S | S | * | * | S | Bend | cis | -78.5 | 114.7 | 40.9 | 27.6 | -36 | 0 | 0 | 0 | 114.1 | ||
| 207 | I | 28.5 | Very low | 29.2 | Very low | 104 Ų | 104 | 137.4 Ų | 137.4 | 53% | 0.533 | 73% | 0.733 | S | S | . | * | 92.3 | 88.6 | 77.2 | -74.3 | 157.2 | 0 | 0 | 0 | 110.3 | L205 K209 | L205-I207 HydrophobicContact CB-CG1 4.17Å; I207-K209 HydrophobicContact CG2-CD 4.25Å; I207-K209 HydrophobicContact CG2-CG 4.03Å | |||
| 208 | I | 33.3 | Very low | 29.1 | Very low | 157 Ų | 157 | 140 Ų | 140 | 81% | 0.805 | 73% | 0.731 | S | S | * | * | trans | -72 | 123.2 | 147.7 | -64.2 | 174.2 | 0 | 0 | 0 | 108 | ||||
| 209 | K | 25.5 | Very low | 29.1 | Very low | 171 Ų | 171 | 143.2 Ų | 143.2 | 74% | 0.743 | 73% | 0.733 | S | S | * | * | trans | -126.1 | 109.1 | 149.8 | -78.9 | 174.9 | -178.5 | 172.5 | 0 | 106.6 | I207 | I207-K209 HydrophobicContact CG2-CD 4.25Å; I207-K209 HydrophobicContact CG2-CG 4.03Å | ||
| 210 | R | 24.2 | Very low | 28.8 | Very low | 219 Ų | 219 | 143.7 Ų | 143.7 | 83% | 0.826 | 73% | 0.733 | S | S | * | * | 50.2 | 100.2 | 93.5 | -73.2 | -177.8 | 170.9 | -168.4 | -2.7 | 109.9 | |||||
| 211 | K | 25.5 | Very low | 28.4 | Very low | 192 Ų | 192 | 145.9 Ų | 145.9 | 84% | 0.835 | 74% | 0.737 | S | S | * | * | 169.5 | 173.5 | 67.9 | -102.5 | 174.1 | 175.7 | -176.4 | 0 | 108.2 | |||||
| 212 | P | 30.2 | Very low | 28.6 | Very low | 101 Ų | 101 | 143.5 Ų | 143.5 | 66% | 0.656 | 74% | 0.735 | S | S | * | * | -135.9 | -153.8 | -50.6 | 37.7 | -16.2 | 0 | 0 | 0 | 110.4 | |||||
| 213 | K | 31.8 | Very low | 29 | Very low | 189 Ų | 189 | 144.9 Ų | 144.9 | 82% | 0.822 | 75% | 0.747 | S | S | * | * | trans | 85.2 | 146.2 | 167.9 | -60.8 | 179.9 | -176.1 | 177.1 | 0 | 116.9 | ||||
| 214 | K | 31.6 | Very low | 29.1 | Very low | 177 Ų | 177 | 144.3 Ų | 144.3 | 77% | 0.77 | 75% | 0.747 | S | S | * | * | cis | -165.6 | 130.8 | -30.8 | -124.6 | -168.3 | 177.3 | -164.3 | 0 | 110.5 | ||||
| 215 | T | 27.8 | Very low | 29.4 | Very low | 106 Ų | 106 | 144.8 Ų | 144.8 | 65% | 0.65 | 75% | 0.749 | S | S | * | * | trans | 33 | 113.4 | 136.6 | 59.7 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 216 | S | 25.1 | Very low | 29.5 | Very low | 106 Ų | 106 | 150.9 Ų | 150.9 | 74% | 0.741 | 77% | 0.765 | S | S | * | * | trans | 48.5 | 125.9 | 131.4 | 64.5 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 217 | S | 30.4 | Very low | 29.4 | Very low | 100 Ų | 100 | 147.9 Ų | 147.9 | 70% | 0.699 | 76% | 0.758 | S | S | * | * | 173.4 | 165.1 | 93.9 | 49.8 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 218 | F | 30 | Very low | 29.5 | Very low | 188 Ų | 188 | 152.7 Ų | 152.7 | 83% | 0.825 | 78% | 0.775 | S | S | * | * | trans | 74.3 | 115 | 163.7 | -75.5 | -75.4 | 0 | 0 | 0 | 122.5 | ||||
| 219 | N | 31.8 | Very low | 29.4 | Very low | 133 Ų | 133 | 155.9 Ų | 155.9 | 71% | 0.711 | 78% | 0.776 | S | S | * | * | trans | 59.8 | 122.8 | 130.6 | -116.6 | 17.8 | 0 | 0 | 0 | 121.7 | ||||
| 220 | P | 30.2 | Very low | 29.7 | Very low | 123 Ų | 123 | 156.2 Ų | 156.2 | 80% | 0.799 | 78% | 0.778 | S | S | * | * | trans | -83.1 | 110.8 | 160.7 | 33.5 | -28.7 | 0 | 0 | 0 | 110.3 | ||||
| 221 | N | 28.8 | Very low | 30.1 | Very low | 149 Ų | 149 | 155 Ų | 155 | 80% | 0.797 | 78% | 0.779 | S | S | * | * | trans | -151.7 | 143.3 | 158.7 | -122.4 | -17.7 | 0 | 0 | 0 | 108.4 | ||||
| 222 | Q | 31.2 | Very low | 30.1 | Very low | 173 Ų | 173 | 150.4 Ų | 150.4 | 81% | 0.808 | 77% | 0.771 | S | S | * | * | trans | 65.9 | 104 | -165.5 | -56.8 | -175 | -22.3 | 0 | 0 | 115.4 | ||||
| 223 | V | 31.8 | Very low | 30.2 | Very low | 148 Ų | 148 | 152.9 Ų | 152.9 | 90% | 0.897 | 78% | 0.779 | S | S | * | * | trans | -71.3 | 123.6 | 139.9 | 173.8 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 224 | H | 28.9 | Very low | 30 | Very low | 143 Ų | 143 | 150.4 Ų | 150.4 | 66% | 0.662 | 77% | 0.774 | S | S | * | * | trans | -148.5 | 129.8 | 169.7 | -152.9 | 75.5 | 0 | 0 | 0 | 112.6 | ||||
| 225 | V | 34 | Very low | 29.8 | Very low | 131 Ų | 131 | 147.9 Ų | 147.9 | 79% | 0.794 | 77% | 0.77 | S | S | * | * | trans | -66 | 134.3 | 176.3 | 177.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 226 | R | 28.7 | Very low | 29.9 | Very low | 232 Ų | 232 | 153.4 Ų | 153.4 | 88% | 0.875 | 78% | 0.78 | S | S | * | * | trans | -166.7 | 141.3 | 166 | -108.4 | 163 | -176.3 | -170.1 | 1.3 | 109.8 | ||||
| 227 | G | 29 | Very low | 30.1 | Very low | 64 Ų | 64 | 153 Ų | 153 | 66% | 0.66 | 78% | 0.777 | S | S | * | * | cis | 132.5 | 152.3 | -1.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 228 | K | 29.6 | Very low | 30.1 | Very low | 205 Ų | 205 | 155.3 Ų | 155.3 | 89% | 0.891 | 78% | 0.78 | S | S | * | * | trans | -125.3 | 107.8 | 166.8 | -65.1 | 176.1 | -178.3 | 172.4 | 0 | 106 | ||||
| 229 | R | 31 | Very low | 30 | Very low | 223 Ų | 223 | 154.6 Ų | 154.6 | 84% | 0.842 | 78% | 0.777 | S | S | * | * | 56.7 | 127.7 | 86.2 | -66.9 | -171.4 | 177.7 | -153.4 | -1.3 | 111.3 | |||||
| 230 | F | 32.4 | Very low | 29.9 | Very low | 178 Ų | 178 | 155.7 Ų | 155.7 | 78% | 0.781 | 78% | 0.778 | S | S | * | * | cis | -130 | 133.6 | 40.7 | -77.3 | -102.2 | 0 | 0 | 0 | 112.9 | ||||
| 231 | K | 31.9 | Very low | 29.9 | Very low | 194 Ų | 194 | 157.9 Ų | 157.9 | 84% | 0.843 | 78% | 0.777 | S | S | * | * | 86.9 | 155.7 | 100.2 | -79.8 | -161 | 173.4 | -167.8 | 0 | 115.5 | |||||
| 232 | S | 26.4 | Very low | 29.8 | Very low | 96 Ų | 96 | 154.9 Ų | 154.9 | 67% | 0.671 | 77% | 0.768 | S | S | * | * | trans | -103.9 | 167.3 | -169.4 | 51.8 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 233 | D | 32.1 | Very low | 29.5 | Very low | 153 Ų | 153 | 152.6 Ų | 152.6 | 82% | 0.818 | 77% | 0.766 | S | S | * | * | -167.9 | -169.7 | 103.9 | -83.1 | -9.3 | 0 | 0 | 0 | 109.7 | |||||
| 234 | N | 28.2 | Very low | 29.2 | Very low | 136 Ų | 136 | 152.8 Ų | 152.8 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -122.2 | 161.3 | -144.3 | -132.9 | 54.3 | 0 | 0 | 0 | 115.2 | ||||
| 235 | D | 26.7 | Very low | 29.3 | Very low | 125 Ų | 125 | 155.9 Ų | 155.9 | 67% | 0.668 | 77% | 0.773 | S | S | * | * | trans | 78.1 | 150.5 | 152.1 | -59.4 | -45.4 | 0 | 0 | 0 | 123.7 | ||||
| 236 | Y | 30.8 | Very low | 29.3 | Very low | 221 Ų | 221 | 156.8 Ų | 156.8 | 87% | 0.867 | 77% | 0.773 | S | S | * | * | trans | 84.1 | 121.3 | 164.7 | -69.7 | -73.2 | 0 | 0 | 0 | 122.2 | ||||
| 237 | S | 27.4 | Very low | 29.4 | Very low | 97 Ų | 97 | 151.1 Ų | 151.1 | 68% | 0.678 | 77% | 0.766 | S | S | * | * | trans | -70.3 | 156.3 | 176.3 | 53.5 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 238 | I | 30.6 | Very low | 29.6 | Very low | 149 Ų | 149 | 153.3 Ų | 153.3 | 76% | 0.764 | 77% | 0.768 | S | S | * | * | 179.1 | 150.8 | 124.6 | -95.4 | 156.1 | 0 | 0 | 0 | 110.5 | |||||
| 239 | F | 28.8 | Very low | 29.6 | Very low | 173 Ų | 173 | 151.7 Ų | 151.7 | 76% | 0.759 | 77% | 0.768 | S | S | * | * | trans | -5.2 | 152.9 | 159.3 | -61.6 | -111.2 | 0 | 0 | 0 | 118.7 | ||||
| 240 | E | 30.1 | Very low | 29.6 | Very low | 156 Ų | 156 | 148.4 Ų | 148.4 | 73% | 0.729 | 77% | 0.765 | S | S | * | * | cis | -162.2 | 165 | 21.1 | -142.9 | 150.4 | -143.8 | 0 | 0 | 111.9 | ||||
| 241 | E | 28.5 | Very low | 29.4 | Very low | 169 Ų | 169 | 145.1 Ų | 145.1 | 79% | 0.79 | 76% | 0.764 | S | S | * | * | trans | 33.9 | 140.1 | 150.5 | -86 | -171.1 | -164.7 | 0 | 0 | 126.2 | ||||
| 242 | S | 27.1 | Very low | 29.3 | Very low | 86 Ų | 86 | 145.3 Ų | 145.3 | 60% | 0.601 | 77% | 0.765 | S | S | * | * | trans | 79.7 | 89.9 | 133.8 | -64.2 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 243 | T | 24.7 | Very low | 29.7 | Very low | 126 Ų | 126 | 147.9 Ų | 147.9 | 77% | 0.773 | 77% | 0.771 | S | S | * | * | trans | 74.2 | 143.6 | 132.5 | 67.3 | 0 | 0 | 0 | 0 | 123 | ||||
| 244 | L | 27 | Very low | 29.8 | Very low | 152 Ų | 152 | 145.2 Ų | 145.2 | 80% | 0.796 | 76% | 0.763 | S | S | * | * | trans | 57.3 | 105.5 | 148.9 | -80.6 | 161.4 | 0 | 0 | 0 | 120.2 | ||||
| 245 | K | 29.7 | Very low | 29.8 | Very low | 208 Ų | 208 | 144.9 Ų | 144.9 | 90% | 0.904 | 76% | 0.761 | S | S | * | * | -162.4 | 115.2 | 124.2 | -112 | 155.6 | -171.8 | 167.8 | 0 | 114.7 | |||||
| 246 | L | 33.6 | Very low | 30 | Very low | 150 Ų | 150 | 145.7 Ų | 145.7 | 79% | 0.785 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 153 | 150.2 | -74.1 | 156.2 | 0 | 0 | 0 | 109.5 | ||
| 247 | P | 32.7 | Very low | 30 | Very low | 113 Ų | 113 | 142.6 Ų | 142.6 | 73% | 0.734 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -65.3 | 159.5 | 160.6 | 30.6 | -33.3 | 0 | 0 | 0 | 110.7 | ||
| 248 | P | 31.4 | Very low | 30 | Very low | 110 Ų | 110 | 142.5 Ų | 142.5 | 71% | 0.714 | 75% | 0.753 | S | S | * | * | P | Polyproline II helix | trans | -92.8 | 125.2 | -145.2 | 32.9 | -35.7 | 0 | 0 | 0 | 115.7 | I250 | P248-I250 HydrophobicContact CB-CG1 4.18Š|
| 249 | I | 30.7 | Very low | 29.8 | Very low | 171 Ų | 171 | 144.2 Ų | 144.2 | 88% | 0.877 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -97.3 | 116.8 | 143.7 | -63.2 | 177.9 | 0 | 0 | 0 | 106.6 | S251 | I249-S251 PolarHBondContact O-N 2.81Š|
| 250 | I | 30.7 | Very low | 29.8 | Very low | 154 Ų | 154 | 141.3 Ų | 141.3 | 79% | 0.79 | 75% | 0.752 | S | S | * | * | trans | -89.9 | 106.1 | 179.8 | -60.5 | -179.9 | 0 | 0 | 0 | 109.1 | P248 | P248-I250 HydrophobicContact CB-CG1 4.18Š| ||
| 251 | S | 28.5 | Very low | 29.6 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 76% | 0.762 | 75% | 0.752 | S | S | * | * | trans | -122.3 | 108.3 | 157.1 | -177.9 | 0 | 0 | 0 | 0 | 109.2 | I249 | I249-S251 PolarHBondContact O-N 2.81Š| ||
| 252 | K | 28.8 | Very low | 29.7 | Very low | 197 Ų | 197 | 139.3 Ų | 139.3 | 86% | 0.857 | 75% | 0.745 | S | S | * | * | trans | -151.1 | 110.3 | 160.6 | -80.9 | -152.8 | 175.1 | -168.6 | 0 | 109.8 | ||||
| 253 | N | 35.8 | Very low | 29.6 | Very low | 150 Ų | 150 | 141.8 Ų | 141.8 | 80% | 0.802 | 75% | 0.751 | S | S | * | * | trans | -111.1 | 129.8 | 156.8 | -165.2 | 16.2 | 0 | 0 | 0 | 107.5 | ||||
| 254 | P | 34.6 | Very low | 30 | Very low | 98 Ų | 98 | 144.6 Ų | 144.6 | 64% | 0.636 | 76% | 0.756 | S | S | * | * | trans | -124.1 | 134.9 | 143 | 34.8 | -25.2 | 0 | 0 | 0 | 108.8 | ||||
| 255 | N | 28.2 | Very low | 30.2 | Very low | 128 Ų | 128 | 144.6 Ų | 144.6 | 68% | 0.684 | 76% | 0.756 | S | S | * | * | 46.8 | 123.7 | 84.8 | -70.7 | 19.7 | 0 | 0 | 0 | 111.8 | |||||
| 256 | E | 30.3 | Very low | 30.3 | Very low | 143 Ų | 143 | 141.6 Ų | 141.6 | 67% | 0.668 | 75% | 0.75 | S | S | * | * | cis | -162.4 | 169 | 26.4 | -132.1 | 172.5 | -105.7 | 0 | 0 | 112.3 | ||||
| 257 | Q | 30.4 | Very low | 30.4 | Very low | 156 Ų | 156 | 140.4 Ų | 140.4 | 73% | 0.729 | 74% | 0.741 | S | S | * | * | trans | 56.3 | 105.4 | 159.6 | -61.1 | 176.6 | 43.6 | 0 | 0 | 117.8 | ||||
| 258 | S | 27.7 | Very low | 30.5 | Very low | 94 Ų | 94 | 142.9 Ų | 142.9 | 66% | 0.657 | 74% | 0.74 | S | S | * | * | cis | 98.5 | 152.5 | 43.1 | 70.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 259 | F | 26.7 | Very low | 30.3 | Very low | 185 Ų | 185 | 140.8 Ų | 140.8 | 81% | 0.811 | 74% | 0.738 | S | S | * | * | trans | 77.5 | 103.4 | 167 | -78.3 | -85.8 | 0 | 0 | 0 | 120.1 | ||||
| 260 | V | 28.8 | Very low | 30.2 | Very low | 113 Ų | 113 | 139.8 Ų | 139.8 | 69% | 0.685 | 74% | 0.735 | S | S | * | * | 70.7 | 139.3 | 116.1 | 154.2 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 261 | Q | 26.6 | Very low | 30.2 | Very low | 158 Ų | 158 | 137.9 Ų | 137.9 | 74% | 0.738 | 73% | 0.726 | S | S | * | * | cis | -176.3 | -171.2 | -13.9 | -164.6 | 175.8 | 21.4 | 0 | 0 | 107.4 | ||||
| 262 | I | 29.6 | Very low | 30.4 | Very low | 125 Ų | 125 | 140.6 Ų | 140.6 | 64% | 0.641 | 72% | 0.724 | S | S | * | * | trans | 82.4 | 97.4 | 156.8 | -61.1 | 159.4 | 0 | 0 | 0 | 115.3 | ||||
| 263 | N | 25.8 | Very low | 30.6 | Very low | 137 Ų | 137 | 137.3 Ų | 137.3 | 73% | 0.733 | 72% | 0.716 | S | S | * | * | 66.3 | 156.3 | 129.6 | -58.7 | 3.4 | 0 | 0 | 0 | 117.8 | |||||
| 264 | E | 33.3 | Very low | 30.4 | Very low | 186 Ų | 186 | 138.4 Ų | 138.4 | 87% | 0.869 | 71% | 0.713 | S | S | * | * | cis | -123.7 | 142.8 | 26.5 | -67.9 | 168.6 | 144.1 | 0 | 0 | 114.8 | ||||
| 265 | N | 30 | Very low | 30.3 | Very low | 151 Ų | 151 | 141 Ų | 141 | 81% | 0.807 | 72% | 0.717 | S | S | * | * | trans | -86.9 | 134.3 | 155.7 | -68.1 | -62.4 | 0 | 0 | 0 | 107.7 | ||||
| 266 | D | 32.8 | Very low | 30.4 | Very low | 145 Ų | 145 | 139.2 Ų | 139.2 | 78% | 0.775 | 71% | 0.714 | S | S | * | * | trans | -170.6 | 149.3 | 157 | -98.4 | -13.7 | 0 | 0 | 0 | 106.8 | ||||
| 267 | E | 34.7 | Very low | 30.5 | Very low | 126 Ų | 126 | 137.4 Ų | 137.4 | 59% | 0.589 | 72% | 0.717 | S | S | * | * | cis | -157.2 | 158.8 | -0 | -135.3 | -174.9 | 167.8 | 0 | 0 | 108.7 | ||||
| 268 | K | 34.5 | Very low | 30.7 | Very low | 164 Ų | 164 | 137 Ų | 137 | 71% | 0.713 | 72% | 0.72 | S | S | * | * | trans | 44.9 | 115.8 | 155.9 | -61.9 | 152.1 | -174.5 | 155.5 | 0 | 118.3 | ||||
| 269 | G | 28.7 | Very low | 31.1 | Very low | 66 Ų | 66 | 135.9 Ų | 135.9 | 68% | 0.68 | 72% | 0.717 | S | S | * | * | cis | 100.6 | 148.6 | 13.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 270 | N | 28.1 | Very low | 31.3 | Very low | 150 Ų | 150 | 133.5 Ų | 133.5 | 80% | 0.802 | 71% | 0.712 | S | S | * | * | trans | 72.1 | 146.4 | 177.1 | -58.4 | -53.6 | 0 | 0 | 0 | 115.5 | ||||
| 271 | N | 30.5 | Very low | 31.4 | Very low | 114 Ų | 114 | 133.8 Ų | 133.8 | 61% | 0.61 | 71% | 0.71 | S | S | * | * | cis | -164.2 | 166.4 | 7.1 | -137.4 | -40.7 | 0 | 0 | 0 | 111.1 | ||||
| 272 | K | 32.1 | Very low | 31.7 | Very low | 167 Ų | 167 | 132.6 Ų | 132.6 | 73% | 0.726 | 71% | 0.709 | S | S | * | * | trans | 68.7 | 148 | 151 | -72.9 | 165 | -168.8 | 173.9 | 0 | 117 | ||||
| 273 | L | 33.5 | Very low | 31.9 | Very low | 128 Ų | 128 | 133.4 Ų | 133.4 | 67% | 0.67 | 71% | 0.712 | S | S | * | * | cis | -153.8 | 154.6 | 1.6 | -101.3 | 147.1 | 0 | 0 | 0 | 108.5 | ||||
| 274 | K | 31.2 | Very low | 32.2 | Very low | 172 Ų | 172 | 132.5 Ų | 132.5 | 75% | 0.748 | 71% | 0.707 | S | S | * | * | trans | 39.4 | 141.1 | 142 | -67.6 | 176.5 | -178.3 | -171.1 | 0 | 119.9 | ||||
| 275 | Q | 32.2 | Very low | 32.1 | Very low | 153 Ų | 153 | 128.6 Ų | 128.6 | 72% | 0.715 | 69% | 0.692 | S | S | * | * | cis | -172.8 | 165 | 22.9 | -131.2 | 165.5 | -57.4 | 0 | 0 | 110.8 | ||||
| 276 | S | 31.2 | Very low | 32.3 | Very low | 90 Ų | 90 | 128 Ų | 128 | 63% | 0.629 | 69% | 0.689 | S | S | * | * | trans | 43.8 | 105.4 | 148.8 | 62.8 | 0 | 0 | 0 | 0 | 119 | ||||
| 277 | S | 32.9 | Very low | 32.3 | Very low | 105 Ų | 105 | 127.1 Ų | 127.1 | 73% | 0.734 | 68% | 0.684 | S | S | * | * | 93.5 | 147.8 | 88.9 | 73.6 | 0 | 0 | 0 | 0 | 113 | |||||
| 278 | N | 33.4 | Very low | 32.3 | Very low | 148 Ų | 148 | 126.8 Ų | 126.8 | 79% | 0.791 | 69% | 0.69 | S | S | * | * | cis | -154.6 | 146.2 | 13.3 | -147.9 | 21.9 | 0 | 0 | 0 | 111.7 | ||||
| 279 | A | 36.4 | Very low | 32.4 | Very low | 70 Ų | 70 | 125.3 Ų | 125.3 | 58% | 0.579 | 69% | 0.69 | S | S | * | * | trans | 50.5 | 146 | 144.2 | 0 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 280 | N | 31.5 | Very low | 32.6 | Very low | 135 Ų | 135 | 128.7 Ų | 128.7 | 72% | 0.722 | 69% | 0.692 | S | S | * | * | cis | -167.8 | 151.6 | -16.8 | -107.3 | -9.5 | 0 | 0 | 0 | 109.7 | ||||
| 281 | N | 30.8 | Very low | 32.9 | Very low | 119 Ų | 119 | 127.5 Ų | 127.5 | 64% | 0.636 | 69% | 0.686 | S | S | * | * | 24.1 | 141.4 | 129.6 | -46.4 | -5.9 | 0 | 0 | 0 | 119.3 | |||||
| 282 | N | 33.3 | Very low | 33.1 | Very low | 134 Ų | 134 | 130.4 Ų | 130.4 | 72% | 0.717 | 70% | 0.696 | S | S | * | * | cis | -144.2 | 149.2 | 37.4 | -102 | -16.3 | 0 | 0 | 0 | 109.8 | ||||
| 283 | M | 32.6 | Very low | 33.2 | Very low | 142 Ų | 142 | 128.8 Ų | 128.8 | 70% | 0.7 | 70% | 0.696 | S | S | * | * | 62 | 131.8 | 64 | -63.2 | -172.7 | 174.6 | 0 | 0 | 113.3 | |||||
| 284 | N | 33.3 | Very low | 33.2 | Very low | 118 Ų | 118 | 128.9 Ų | 128.9 | 63% | 0.631 | 70% | 0.697 | S | S | * | * | cis | -154.3 | 149.4 | 6.6 | -103.8 | -1.1 | 0 | 0 | 0 | 111.5 | ||||
| 285 | N | 29.9 | Very low | 33.2 | Very low | 104 Ų | 104 | 129 Ų | 129 | 56% | 0.556 | 70% | 0.7 | S | S | * | * | 34.7 | 152.4 | 124 | -38.6 | 10.7 | 0 | 0 | 0 | 120.1 | |||||
| 286 | N | 35.2 | Very low | 33.3 | Very low | 138 Ų | 138 | 126.7 Ų | 126.7 | 74% | 0.738 | 70% | 0.701 | S | S | * | * | cis | -150.4 | 128.3 | 28.9 | -45.2 | -98.5 | 0 | 0 | 0 | 112.1 | ||||
| 287 | D | 32.6 | Very low | 33.3 | Very low | 127 Ų | 127 | 130.8 Ų | 130.8 | 68% | 0.679 | 71% | 0.71 | S | S | * | * | 41.6 | 153.3 | 105.7 | -38.7 | -25.5 | 0 | 0 | 0 | 122.8 | |||||
| 288 | V | 34.6 | Very low | 33.3 | Very low | 118 Ų | 118 | 133 Ų | 133 | 72% | 0.715 | 71% | 0.709 | S | S | * | * | trans | 95.4 | 88.2 | 155.9 | -162.4 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 289 | D | 36.1 | Very low | 33.2 | Very low | 134 Ų | 134 | 131.8 Ų | 131.8 | 72% | 0.717 | 70% | 0.702 | S | S | * | * | 43.7 | 126.2 | 109.9 | -41.9 | -25.8 | 0 | 0 | 0 | 121.7 | |||||
| 290 | N | 32.6 | Very low | 32.9 | Very low | 136 Ų | 136 | 134.8 Ų | 134.8 | 73% | 0.727 | 71% | 0.713 | S | S | * | * | 26.6 | 142 | 107 | -72.4 | 54.5 | 0 | 0 | 0 | 119 | |||||
| 291 | D | 34.7 | Very low | 32.8 | Very low | 126 Ų | 126 | 135.9 Ų | 135.9 | 67% | 0.674 | 72% | 0.717 | S | S | * | * | cis | -161.7 | 170.8 | 9 | -96.4 | -31 | 0 | 0 | 0 | 112 | ||||
| 292 | E | 34.3 | Very low | 32.7 | Very low | 174 Ų | 174 | 135.1 Ų | 135.1 | 81% | 0.813 | 73% | 0.727 | S | S | * | * | trans | 58.2 | 110 | 150.6 | -73.4 | 177 | -174.9 | 0 | 0 | 123.3 | ||||
| 293 | D | 34.5 | Very low | 32.4 | Very low | 134 Ų | 134 | 132 Ų | 132 | 72% | 0.717 | 73% | 0.727 | S | S | * | * | 65.3 | 125.7 | 120 | -80.1 | 31.3 | 0 | 0 | 0 | 126.6 | |||||
| 294 | N | 33.2 | Very low | 32.4 | Very low | 130 Ų | 130 | 132.2 Ų | 132.2 | 70% | 0.695 | 73% | 0.73 | S | S | * | * | trans | 70.6 | 146.5 | 142.5 | -62.1 | -38.5 | 0 | 0 | 0 | 120.1 | ||||
| 295 | E | 32.3 | Very low | 32 | Very low | 173 Ų | 173 | 134.2 Ų | 134.2 | 81% | 0.808 | 74% | 0.735 | S | S | * | * | cis | -154.9 | 177.5 | 7.4 | -140.5 | 173.2 | -149.7 | 0 | 0 | 112.4 | ||||
| 296 | S | 33.6 | Very low | 32 | Very low | 105 Ų | 105 | 137 Ų | 137 | 73% | 0.734 | 74% | 0.744 | S | S | * | * | trans | 75.5 | 141.2 | 168.2 | 80.3 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 297 | E | 32.1 | Very low | 31.6 | Very low | 176 Ų | 176 | 134.6 Ų | 134.6 | 82% | 0.822 | 74% | 0.738 | S | S | * | * | cis | -160.2 | 169.1 | -7.5 | -127.7 | 173.7 | -174.2 | 0 | 0 | 112.8 | ||||
| 298 | E | 31.6 | Very low | 31.6 | Very low | 152 Ų | 152 | 135.9 Ų | 135.9 | 71% | 0.71 | 74% | 0.744 | S | S | * | * | trans | 66.4 | 106.5 | 157.3 | -70.9 | -146.7 | 123.3 | 0 | 0 | 123.1 | ||||
| 299 | N | 32.1 | Very low | 31.1 | Very low | 122 Ų | 122 | 135.1 Ų | 135.1 | 65% | 0.652 | 75% | 0.745 | S | S | * | * | 112 | 109.5 | 110.7 | -79.4 | -24.5 | 0 | 0 | 0 | 123.8 | |||||
| 300 | V | 30.3 | Very low | 30.7 | Very low | 134 Ų | 134 | 138.6 Ų | 138.6 | 81% | 0.812 | 75% | 0.754 | S | S | * | * | 95.6 | 143.7 | 129.3 | 174.5 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 301 | I | 28.9 | Very low | 30.3 | Very low | 158 Ų | 158 | 138.9 Ų | 138.9 | 81% | 0.81 | 76% | 0.755 | S | S | * | * | trans | -123.5 | 154.9 | -161.9 | -65.7 | 170.6 | 0 | 0 | 0 | 111.1 | ||||
| 302 | A | 29.1 | Very low | 29.8 | Very low | 102 Ų | 102 | 138.8 Ų | 138.8 | 84% | 0.843 | 76% | 0.759 | S | S | * | * | trans | 72.4 | 145.9 | 165.3 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 303 | G | 27.8 | Very low | 30 | Very low | 69 Ų | 69 | 136.2 Ų | 136.2 | 71% | 0.711 | 76% | 0.758 | S | S | * | * | trans | -173.4 | 2.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 124 | ||||
| 304 | I | 31.1 | Very low | 29.6 | Very low | 147 Ų | 147 | 137.1 Ų | 137.1 | 75% | 0.754 | 77% | 0.768 | S | S | * | * | trans | 68.3 | 131.8 | 157.4 | -67.3 | 173.3 | 0 | 0 | 0 | 119.8 | ||||
| 305 | E | 25.6 | Very low | 29 | Very low | 160 Ų | 160 | 139.9 Ų | 139.9 | 75% | 0.748 | 77% | 0.774 | S | S | * | * | trans | 52.1 | 130.1 | 157.4 | -67.5 | 157 | -147.5 | 0 | 0 | 120.1 | ||||
| 306 | H | 30.9 | Very low | 28.5 | Very low | 161 Ų | 161 | 136.8 Ų | 136.8 | 75% | 0.745 | 77% | 0.77 | S | S | * | * | -154.5 | 148.4 | 54.4 | -107.3 | -81.5 | 0 | 0 | 0 | 115.4 | |||||
| 307 | S | 25.9 | Very low | 28 | Very low | 88 Ų | 88 | 136.3 Ų | 136.3 | 62% | 0.615 | 77% | 0.766 | S | S | * | * | trans | -12.6 | 145.7 | 149.3 | 58.5 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 308 | L | 31.7 | Very low | 27.6 | Very low | 154 Ų | 154 | 135.5 Ų | 135.5 | 81% | 0.806 | 77% | 0.765 | S | S | * | * | cis | -151 | 147.6 | 46 | -76.6 | 162.5 | 0 | 0 | 0 | 113.8 | ||||
| 309 | S | 25.4 | Very low | 27.2 | Very low | 103 Ų | 103 | 135.8 Ų | 135.8 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | trans | -91.5 | 152.5 | 158.9 | 59.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 310 | F | 28.1 | Very low | 27 | Very low | 207 Ų | 207 | 134.7 Ų | 134.7 | 91% | 0.908 | 77% | 0.768 | S | S | * | * | trans | -143.8 | 163.2 | 148 | -101 | -70 | 0 | 0 | 0 | 111.8 | ||||
| 311 | N | 23.6 | Very low | 26.7 | Very low | 142 Ų | 142 | 134.4 Ų | 134.4 | 76% | 0.759 | 77% | 0.766 | S | S | * | * | trans | -133.3 | 172.2 | -158.9 | -167.7 | 3.7 | 0 | 0 | 0 | 111 | ||||
| 312 | T | 24.4 | Very low | 26.5 | Very low | 123 Ų | 123 | 132.8 Ų | 132.8 | 76% | 0.755 | 76% | 0.759 | S | S | * | * | trans | 82.7 | 148.3 | 165.2 | 71.7 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 313 | P | 37.8 | Very low | 26.5 | Very low | 121 Ų | 121 | 135.9 Ų | 135.9 | 79% | 0.786 | 75% | 0.754 | S | S | * | * | trans | -114.6 | 159.5 | -167.9 | 41.6 | -31.9 | 0 | 0 | 0 | 115.4 | ||||
| 314 | V | 25.9 | Very low | 26.9 | Very low | 153 Ų | 153 | 140.5 Ų | 140.5 | 93% | 0.927 | 76% | 0.761 | S | S | * | * | trans | -142 | 151.9 | 164.4 | -178.9 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 315 | K | 21.4 | Very low | 27 | Very low | 188 Ų | 188 | 137.6 Ų | 137.6 | 82% | 0.817 | 75% | 0.751 | S | S | * | * | trans | -69.8 | 157.1 | -173.7 | -80.1 | -176.1 | 171.8 | -174.3 | 0 | 118.2 | ||||
| 316 | C | 20.9 | Very low | 27.3 | Very low | 108 Ų | 108 | 138.5 Ų | 138.5 | 73% | 0.73 | 75% | 0.753 | S | S | * | * | trans | 84.9 | 111.6 | 134 | -79.9 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 317 | S | 24.2 | Very low | 27.1 | Very low | 94 Ų | 94 | 137.2 Ų | 137.2 | 66% | 0.657 | 75% | 0.75 | S | S | * | * | 79.2 | 131.8 | 115 | 69.6 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 318 | M | 22.4 | Very low | 27.3 | Very low | 160 Ų | 160 | 138.1 Ų | 138.1 | 79% | 0.788 | 75% | 0.753 | S | S | * | * | trans | 66.6 | 140.2 | 153.5 | -71.4 | 148.8 | 142.5 | 0 | 0 | 115.9 | ||||
| 319 | E | 24.8 | Very low | 27.1 | Very low | 157 Ų | 157 | 138 Ų | 138 | 73% | 0.734 | 75% | 0.753 | S | S | * | * | cis | -162 | 165.7 | 5.1 | -107 | 155.5 | -129.7 | 0 | 0 | 107.7 | ||||
| 320 | S | 26.1 | Very low | 27.5 | Very low | 99 Ų | 99 | 136.8 Ų | 136.8 | 69% | 0.692 | 74% | 0.744 | S | S | * | * | cis | -179.5 | -174.8 | -24.9 | -95.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 321 | V | 24.1 | Very low | 27.6 | Very low | 129 Ų | 129 | 134 Ų | 134 | 78% | 0.782 | 74% | 0.739 | S | S | * | * | trans | 85.6 | 130.9 | 162.2 | -174 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 322 | D | 25.2 | Very low | 28.1 | Very low | 123 Ų | 123 | 135 Ų | 135 | 66% | 0.658 | 74% | 0.739 | S | S | * | * | trans | 93 | 127.4 | 150.6 | -95.6 | -3.2 | 0 | 0 | 0 | 125.1 | ||||
| 323 | K | 29.6 | Very low | 28.4 | Very low | 168 Ų | 168 | 133.6 Ų | 133.6 | 73% | 0.73 | 73% | 0.727 | S | S | * | * | trans | 84.1 | 100.1 | 144.1 | -67 | 174.3 | 179.1 | 84.9 | 0 | 122.2 | ||||
| 324 | L | 35.9 | Very low | 28 | Very low | 166 Ų | 166 | 136.7 Ų | 136.7 | 87% | 0.869 | 73% | 0.728 | S | S | * | * | -68 | 150.6 | 124.1 | -68.2 | 167 | 0 | 0 | 0 | 109.3 | |||||
| 325 | P | 33.3 | Very low | 28 | Very low | 85 Ų | 85 | 134.6 Ų | 134.6 | 55% | 0.552 | 72% | 0.715 | S | S | * | * | -139.2 | 179.8 | 85.2 | 22.6 | 1.9 | 0 | 0 | 0 | 112 | |||||
| 326 | F | 31.8 | Very low | 28.2 | Very low | 180 Ų | 180 | 132 Ų | 132 | 79% | 0.789 | 72% | 0.715 | S | S | * | * | cis | -144.4 | 162.7 | 27.9 | -78.8 | -99.7 | 0 | 0 | 0 | 110 | ||||
| 327 | I | 26.6 | Very low | 28.4 | Very low | 133 Ų | 133 | 134.5 Ų | 134.5 | 68% | 0.682 | 72% | 0.718 | S | S | * | * | cis | 75.9 | 133.5 | 32.9 | -67.3 | 176.9 | 0 | 0 | 0 | 113.1 | ||||
| 328 | T | 29.9 | Very low | 28.4 | Very low | 108 Ų | 108 | 134.9 Ų | 134.9 | 66% | 0.663 | 72% | 0.721 | S | S | * | * | cis | -166.7 | 171.7 | -17.5 | 33.6 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 329 | D | 28.6 | Very low | 28.6 | Very low | 152 Ų | 152 | 133.5 Ų | 133.5 | 81% | 0.813 | 72% | 0.722 | S | S | * | * | trans | -175.4 | 153.5 | 134.4 | -99.8 | -21.5 | 0 | 0 | 0 | 111.1 | ||||
| 330 | S | 33.4 | Very low | 28.6 | Very low | 77 Ų | 77 | 133 Ų | 133 | 54% | 0.538 | 72% | 0.723 | S | S | . | * | cis | -166.7 | 145.7 | -26.5 | -112.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 331 | N | 30.7 | Very low | 28.7 | Very low | 149 Ų | 149 | 135.1 Ų | 135.1 | 80% | 0.797 | 73% | 0.726 | S | S | * | * | 52.2 | 149.9 | 88.9 | -61.7 | -49.3 | 0 | 0 | 0 | 115.4 | |||||
| 332 | E | 32.8 | Very low | 28.8 | Very low | 163 Ų | 163 | 136 Ų | 136 | 76% | 0.762 | 73% | 0.725 | S | S | * | * | cis | -134.9 | 179.4 | 33.2 | -96.5 | -142.2 | 120.9 | 0 | 0 | 113 | ||||
| 333 | N | 30.6 | Very low | 29 | Very low | 93 Ų | 93 | 136.5 Ų | 136.5 | 50% | 0.497 | 73% | 0.732 | S | S | . | * | cis | 161.5 | 131.2 | -28.9 | 177.5 | 19 | 0 | 0 | 0 | 109.9 | ||||
| 334 | K | 28.8 | Very low | 28.9 | Very low | 186 Ų | 186 | 135.2 Ų | 135.2 | 81% | 0.809 | 73% | 0.734 | S | S | * | * | trans | -176.1 | 120.9 | 140.1 | -97.4 | 144.3 | -167.2 | 166.7 | 0 | 110.7 | ||||
| 335 | V | 26.3 | Very low | 28.5 | Very low | 109 Ų | 109 | 136 Ų | 136 | 66% | 0.661 | 73% | 0.733 | S | S | * | * | 74.1 | 124.6 | 63.9 | 171.6 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 336 | T | 27.1 | Very low | 28.2 | Very low | 133 Ų | 133 | 137.7 Ų | 137.7 | 82% | 0.816 | 74% | 0.737 | S | S | * | * | cis | -119.2 | -153 | 25.6 | 50.5 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 337 | M | 24 | Very low | 28 | Very low | 161 Ų | 161 | 134.6 Ų | 134.6 | 79% | 0.793 | 73% | 0.732 | S | S | * | * | -179.6 | 137.4 | -79.6 | -165.3 | -177.6 | -171.6 | 0 | 0 | 112.5 | |||||
| 338 | S | 25.1 | Very low | 28.2 | Very low | 101 Ų | 101 | 138.5 Ų | 138.5 | 71% | 0.706 | 74% | 0.74 | S | S | * | * | trans | 78.3 | 148.7 | 170.7 | -31.4 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 339 | T | 26.6 | Very low | 28.1 | Very low | 132 Ų | 132 | 136.2 Ų | 136.2 | 81% | 0.81 | 73% | 0.729 | S | S | * | * | cis | -159.7 | 177.3 | 0.5 | -3.6 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 340 | L | 23.9 | Very low | 28.1 | Very low | 146 Ų | 146 | 136.4 Ų | 136.4 | 76% | 0.764 | 73% | 0.729 | S | S | * | * | trans | -47.7 | 165.8 | 163.6 | -75 | 68.6 | 0 | 0 | 0 | 113.2 | ||||
| 341 | N | 28.2 | Very low | 27.8 | Very low | 143 Ų | 143 | 140.6 Ų | 140.6 | 77% | 0.765 | 75% | 0.746 | S | S | * | * | cis | -165.5 | -177.9 | 37.4 | -148.1 | -2.4 | 0 | 0 | 0 | 114.9 | ||||
| 342 | I | 26.9 | Very low | 27.6 | Very low | 148 Ų | 148 | 140.2 Ų | 140.2 | 76% | 0.759 | 74% | 0.739 | S | S | * | * | trans | -88.3 | 157.1 | 177.7 | -52.7 | 171.2 | 0 | 0 | 0 | 112.3 | ||||
| 343 | V | 28.4 | Very low | 27.5 | Very low | 133 Ų | 133 | 138.9 Ų | 138.9 | 81% | 0.806 | 74% | 0.742 | S | S | * | * | trans | 125.1 | 133.6 | 152.7 | 177.6 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 344 | N | 28.7 | Very low | 27.3 | Very low | 142 Ų | 142 | 139.9 Ų | 139.9 | 76% | 0.759 | 76% | 0.755 | S | S | * | * | trans | -73.1 | 155.6 | -176.4 | -55.7 | -1.8 | 0 | 0 | 0 | 114.5 | ||||
| 345 | H | 26.5 | Very low | 27.5 | Very low | 183 Ų | 183 | 138.9 Ų | 138.9 | 85% | 0.847 | 76% | 0.758 | S | S | * | * | -159.3 | 177.5 | 125.9 | -124.4 | -34.7 | 0 | 0 | 0 | 112 | |||||
| 346 | D | 26.9 | Very low | 27.5 | Very low | 120 Ų | 120 | 141.6 Ų | 141.6 | 64% | 0.642 | 77% | 0.769 | S | S | * | * | trans | -114.6 | 152.8 | -148.4 | -57 | -86.4 | 0 | 0 | 0 | 116.2 | ||||
| 347 | V | 27.6 | Very low | 27.5 | Very low | 114 Ų | 114 | 138.8 Ų | 138.8 | 69% | 0.691 | 77% | 0.766 | S | S | * | * | trans | 51.8 | 120.2 | 140 | 175.4 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 348 | Y | 30.4 | Very low | 27.7 | Very low | 216 Ų | 216 | 138.1 Ų | 138.1 | 85% | 0.847 | 77% | 0.766 | S | S | * | * | -165.6 | 102.6 | 122.6 | -105.3 | -79.3 | 0 | 0 | 0 | 105 | |||||
| 349 | S | 29.7 | Very low | 27.7 | Very low | 60 Ų | 60 | 141.7 Ų | 141.7 | 42% | 0.42 | 77% | 0.769 | S | S | . | * | 56.4 | 111.7 | 65.1 | 82.5 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 350 | D | 28.6 | Very low | 27.7 | Very low | 155 Ų | 155 | 143 Ų | 143 | 83% | 0.829 | 77% | 0.771 | S | S | * | * | trans | -149.6 | 94.5 | 143.7 | -109 | -19 | 0 | 0 | 0 | 108.3 | ||||
| 351 | D | 26.1 | Very low | 27.7 | Very low | 165 Ų | 165 | 139.5 Ų | 139.5 | 88% | 0.882 | 77% | 0.77 | S | S | * | * | -155 | 124.7 | 118.6 | -122.2 | -21.4 | 0 | 0 | 0 | 108.5 | |||||
| 352 | H | 26.5 | Very low | 27.7 | Very low | 142 Ų | 142 | 138.6 Ų | 138.6 | 66% | 0.657 | 77% | 0.772 | S | S | * | * | trans | -139.7 | 128.1 | -169.5 | -99.4 | -45 | 0 | 0 | 0 | 111 | ||||
| 353 | T | 30.3 | Very low | 27.6 | Very low | 134 Ų | 134 | 139.9 Ų | 139.9 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | trans | -175.6 | 144.6 | 142.8 | 36.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 354 | C | 27.5 | Very low | 27.4 | Very low | 115 Ų | 115 | 139 Ų | 139 | 78% | 0.777 | 78% | 0.775 | S | S | * | * | cis | -155.4 | 163.7 | -18.2 | -106.6 | 0 | 0 | 0 | 0 | 108 | ||||
| 355 | L | 32.1 | Very low | 27.2 | Very low | 164 Ų | 164 | 138.8 Ų | 138.8 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | trans | -121 | 160.5 | 169.5 | -78.4 | 175.4 | 0 | 0 | 0 | 111.7 | ||||
| 356 | D | 26.9 | Very low | 27.1 | Very low | 167 Ų | 167 | 136.4 Ų | 136.4 | 89% | 0.893 | 77% | 0.767 | S | S | * | * | trans | 104 | 122.5 | 171.2 | -63.1 | -13.2 | 0 | 0 | 0 | 117 | ||||
| 357 | G | 27.1 | Very low | 27.1 | Very low | 74 Ų | 74 | 138.8 Ų | 138.8 | 76% | 0.763 | 78% | 0.78 | S | S | * | * | trans | 156.1 | 82.8 | 169.4 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 358 | D | 27 | Very low | 27.1 | Very low | 146 Ų | 146 | 140.9 Ų | 140.9 | 78% | 0.781 | 79% | 0.787 | S | S | * | * | trans | 40.8 | 111 | 147.5 | -67.4 | -16.3 | 0 | 0 | 0 | 124.6 | ||||
| 359 | F | 25.4 | Very low | 27 | Very low | 176 Ų | 176 | 135.1 Ų | 135.1 | 77% | 0.772 | 78% | 0.778 | S | S | * | * | 56.9 | 130.6 | 120.7 | -80.6 | -82.5 | 0 | 0 | 0 | 124.6 | |||||
| 360 | N | 26.7 | Very low | 26.9 | Very low | 161 Ų | 161 | 140.4 Ų | 140.4 | 86% | 0.861 | 80% | 0.8 | S | S | * | * | trans | 74.7 | 129.3 | 167.8 | -40.7 | -71 | 0 | 0 | 0 | 115.3 | ||||
| 361 | G | 25.2 | Very low | 26.7 | Very low | 72 Ų | 72 | 140.3 Ų | 140.3 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | cis | 138.2 | 158.9 | 3.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 362 | P | 27.9 | Very low | 26.6 | Very low | 124 Ų | 124 | 139.9 Ų | 139.9 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | cis | -113.4 | 165.1 | 9.4 | 40.3 | -30.5 | 0 | 0 | 0 | 114.8 | ||||
| 363 | L | 23.6 | Very low | 26.4 | Very low | 174 Ų | 174 | 142.6 Ų | 142.6 | 91% | 0.911 | 81% | 0.806 | S | S | * | * | trans | -117.7 | 133.7 | 161.8 | -79.4 | 168.1 | 0 | 0 | 0 | 108.9 | ||||
| 364 | T | 24 | Very low | 26.1 | Very low | 116 Ų | 116 | 142.9 Ų | 142.9 | 71% | 0.712 | 81% | 0.807 | S | S | * | * | trans | -154.4 | 130.3 | 165.1 | 47.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 365 | N | 24.8 | Very low | 25.9 | Very low | 136 Ų | 136 | 144.1 Ų | 144.1 | 73% | 0.727 | 81% | 0.805 | S | S | * | * | trans | 68.8 | 138.6 | 171.7 | -60.9 | 60.8 | 0 | 0 | 0 | 116 | ||||
| 366 | D | 25.5 | Very low | 25.6 | Very low | 134 Ų | 134 | 143.5 Ų | 143.5 | 72% | 0.717 | 80% | 0.803 | S | S | * | * | cis | -151 | 130.1 | -18.9 | -88.4 | -38.7 | 0 | 0 | 0 | 106.9 | ||||
| 367 | D | 25.4 | Very low | 25.4 | Very low | 169 Ų | 169 | 140.7 Ų | 140.7 | 90% | 0.904 | 80% | 0.797 | S | S | * | * | trans | -166.7 | 118.1 | 158.4 | -121.2 | -20.2 | 0 | 0 | 0 | 112.7 | ||||
| 368 | D | 29.5 | Very low | 25.4 | Very low | 159 Ų | 159 | 143 Ų | 143 | 85% | 0.85 | 80% | 0.796 | S | S | * | * | trans | -146.3 | 126.7 | 162.8 | -116.3 | -20.6 | 0 | 0 | 0 | 104 | ||||
| 369 | S | 28 | Very low | 25.4 | Very low | 94 Ų | 94 | 142.7 Ų | 142.7 | 66% | 0.657 | 79% | 0.794 | S | S | * | * | cis | -162.3 | 151.2 | 3.6 | 55.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 370 | I | 26.9 | Very low | 25.6 | Very low | 172 Ų | 172 | 141.9 Ų | 141.9 | 88% | 0.882 | 80% | 0.798 | S | S | * | * | trans | -74.3 | 126.6 | 163.2 | -61.7 | 167.5 | 0 | 0 | 0 | 108.1 | ||||
| 371 | L | 24 | Very low | 25.7 | Very low | 152 Ų | 152 | 141.6 Ų | 141.6 | 80% | 0.796 | 79% | 0.789 | S | S | * | * | trans | -159.3 | 149.4 | 152.9 | -112.6 | 172.8 | 0 | 0 | 0 | 115.4 | ||||
| 372 | L | 24 | Very low | 25.8 | Very low | 157 Ų | 157 | 149 Ų | 149 | 82% | 0.822 | 80% | 0.795 | S | S | * | * | trans | -53.3 | 156.6 | -169.8 | -66.2 | 158.4 | 0 | 0 | 0 | 118.2 | ||||
| 373 | K | 23.2 | Very low | 25.7 | Very low | 199 Ų | 199 | 151.9 Ų | 151.9 | 87% | 0.865 | 80% | 0.797 | S | S | * | * | trans | -48.3 | 133.1 | 164.1 | -60.4 | 178 | 177.1 | -176.2 | 0 | 113.2 | ||||
| 374 | V | 23.2 | Very low | 25.8 | Very low | 139 Ų | 139 | 148.7 Ų | 148.7 | 84% | 0.842 | 79% | 0.789 | S | S | * | * | trans | -147 | 127.9 | 141.4 | 176.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 375 | D | 23.5 | Very low | 25.9 | Very low | 141 Ų | 141 | 151.2 Ų | 151.2 | 75% | 0.754 | 80% | 0.797 | S | S | * | * | trans | -68.8 | 151.8 | 173.8 | -61.7 | -81.5 | 0 | 0 | 0 | 112.9 | ||||
| 376 | N | 25.6 | Very low | 25.7 | Very low | 152 Ų | 152 | 152.1 Ų | 152.1 | 81% | 0.813 | 80% | 0.8 | S | S | * | * | trans | -163.5 | 113.9 | 134.8 | -107.6 | -68.6 | 0 | 0 | 0 | 111.4 | ||||
| 377 | S | 24 | Very low | 25.7 | Very low | 108 Ų | 108 | 152.8 Ų | 152.8 | 76% | 0.755 | 80% | 0.802 | S | S | * | * | trans | -84.5 | 139.6 | 162.4 | 57.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 378 | T | 26.4 | Very low | 25.5 | Very low | 121 Ų | 121 | 151.9 Ų | 151.9 | 74% | 0.742 | 80% | 0.797 | S | S | * | * | trans | -168 | 79.4 | 158.6 | 7.1 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 379 | N | 27.5 | Very low | 25.2 | Very low | 140 Ų | 140 | 152.8 Ų | 152.8 | 75% | 0.749 | 80% | 0.801 | S | S | * | * | 161.4 | 104.3 | 129.3 | -87.2 | -61.1 | 0 | 0 | 0 | 110.2 | |||||
| 380 | D | 29.2 | Very low | 25.1 | Very low | 159 Ų | 159 | 157.1 Ų | 157.1 | 85% | 0.85 | 81% | 0.811 | S | S | * | * | trans | -136.6 | 157.6 | 135.2 | -152.6 | -15.3 | 0 | 0 | 0 | 109.1 | ||||
| 381 | K | 27.3 | Very low | 25.3 | Very low | 156 Ų | 156 | 154.6 Ų | 154.6 | 68% | 0.678 | 81% | 0.806 | S | S | * | * | trans | -146.6 | 131.8 | -173.6 | -80.1 | -176.5 | 175.9 | 169.4 | 0 | 112.4 | ||||
| 382 | R | 29.2 | Very low | 25.2 | Very low | 227 Ų | 227 | 154.6 Ų | 154.6 | 86% | 0.857 | 81% | 0.805 | S | S | * | * | trans | 82.6 | 104.7 | -173.6 | -50.6 | 155.5 | -171 | -109.6 | 3.8 | 109.8 | ||||
| 383 | H | 24.8 | Very low | 25.2 | Very low | 185 Ų | 185 | 154.6 Ų | 154.6 | 86% | 0.856 | 81% | 0.805 | S | S | * | * | 56.2 | 129 | 56.5 | -50.1 | 22 | 0 | 0 | 0 | 110.9 | |||||
| 384 | S | 25.7 | Very low | 25.3 | Very low | 106 Ų | 106 | 149.9 Ų | 149.9 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | cis | -150.9 | 140.6 | 36.4 | 52.2 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 385 | I | 25.6 | Very low | 25.3 | Very low | 170 Ų | 170 | 151 Ų | 151 | 87% | 0.872 | 79% | 0.794 | S | S | * | * | trans | -115 | 150.5 | 151.8 | -69.5 | 177.5 | 0 | 0 | 0 | 107.4 | ||||
| 386 | I | 21.9 | Very low | 25.4 | Very low | 155 Ų | 155 | 151.4 Ų | 151.4 | 80% | 0.795 | 80% | 0.795 | S | S | * | * | trans | -111.3 | 115.8 | -175.1 | -59.3 | 167.5 | 0 | 0 | 0 | 109.6 | ||||
| 387 | I | 24 | Very low | 25.4 | Very low | 147 Ų | 147 | 152.7 Ų | 152.7 | 75% | 0.754 | 80% | 0.796 | S | S | * | * | trans | -144.1 | 137.4 | 146.7 | -67.4 | -166.1 | 0 | 0 | 0 | 108.8 | ||||
| 388 | N | 23 | Very low | 25.4 | Very low | 150 Ų | 150 | 153.5 Ų | 153.5 | 80% | 0.802 | 80% | 0.796 | S | S | * | * | trans | 23.6 | 129 | 163 | -56.3 | -9.2 | 0 | 0 | 0 | 121.9 | ||||
| 389 | L | 22.9 | Very low | 25.4 | Very low | 178 Ų | 178 | 154.1 Ų | 154.1 | 93% | 0.932 | 80% | 0.795 | S | S | * | * | trans | -121.5 | 100.3 | 157.7 | -91 | 170.5 | 0 | 0 | 0 | 109.8 | ||||
| 390 | E | 24.7 | Very low | 25.4 | Very low | 185 Ų | 185 | 154.4 Ų | 154.4 | 86% | 0.864 | 80% | 0.797 | S | S | * | * | trans | -148.4 | 160.1 | 157.1 | -78.7 | -152.8 | 171 | 0 | 0 | 107.5 | ||||
| 391 | P | 30.9 | Very low | 25.2 | Very low | 120 Ų | 120 | 154.1 Ų | 154.1 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | cis | -123.7 | -156.7 | 8.8 | 42.5 | -27.8 | 0 | 0 | 0 | 114.1 | ||||
| 392 | I | 23.5 | Very low | 25.3 | Very low | 152 Ų | 152 | 154.8 Ų | 154.8 | 78% | 0.779 | 81% | 0.806 | S | S | * | * | trans | -83.1 | 168.4 | -175.6 | -58.5 | 157.7 | 0 | 0 | 0 | 110.8 | ||||
| 393 | L | 23.2 | Very low | 25.3 | Very low | 157 Ų | 157 | 149.6 Ų | 149.6 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | trans | 90.2 | 154.6 | 171.6 | -51.2 | 174.5 | 0 | 0 | 0 | 115.8 | ||||
| 394 | P | 25.2 | Very low | 25.4 | Very low | 100 Ų | 100 | 148.8 Ų | 148.8 | 65% | 0.649 | 80% | 0.803 | S | S | * | * | -124.2 | 172.5 | -51.9 | 36.7 | -25.3 | 0 | 0 | 0 | 111.9 | I396 | P394-I396 PolarHBondContact O-N 3.49Å; P394-I396 VanDerWaalsContact O-N 3.08Å | |||
| 395 | I | 23.3 | Very low | 25.3 | Very low | 163 Ų | 163 | 149 Ų | 149 | 84% | 0.836 | 80% | 0.8 | S | S | * | * | trans | -72.2 | 105.2 | 176.1 | -57.3 | 172.9 | 0 | 0 | 0 | 109.6 | ||||
| 396 | I | 25.1 | Very low | 25.3 | Very low | 148 Ų | 148 | 150.7 Ų | 150.7 | 76% | 0.759 | 80% | 0.801 | S | S | * | * | trans | -119.9 | 125.4 | 160.8 | -62.8 | -178.5 | 0 | 0 | 0 | 107.4 | P394 | P394-I396 PolarHBondContact O-N 3.49Å; P394-I396 VanDerWaalsContact O-N 3.08Å | ||
| 397 | E | 27.1 | Very low | 25.4 | Very low | 180 Ų | 180 | 151 Ų | 151 | 84% | 0.841 | 80% | 0.799 | S | S | * | * | trans | -76.8 | 131.2 | -170.4 | -62.7 | -176.7 | 128.3 | 0 | 0 | 112.1 | N399 | E397-N399 PolarHBondContact O-N 3.1Š| ||
| 398 | T | 23.7 | Very low | 25.4 | Very low | 125 Ų | 125 | 148.9 Ų | 148.9 | 77% | 0.767 | 79% | 0.793 | S | S | * | * | trans | -64.2 | 127.5 | 165.5 | 52.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 399 | N | 26.5 | Very low | 25.6 | Very low | 133 Ų | 133 | 150 Ų | 150 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | trans | 167 | 143.5 | 140.8 | -85.4 | -39.3 | 0 | 0 | 0 | 109.2 | E397 | E397-N399 PolarHBondContact O-N 3.1Š| ||
| 400 | N | 26 | Very low | 25.8 | Very low | 147 Ų | 147 | 151.7 Ų | 151.7 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | -156.7 | 158.5 | 56.7 | -84.8 | -80.1 | 0 | 0 | 0 | 114 | |||||
| 401 | N | 26.4 | Very low | 25.7 | Very low | 153 Ų | 153 | 151.8 Ų | 151.8 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -75.4 | 142.1 | 157 | -68 | -57.7 | 0 | 0 | 0 | 110.3 | ||||
| 402 | N | 29.4 | Very low | 25.4 | Very low | 169 Ų | 169 | 152.5 Ų | 152.5 | 90% | 0.904 | 78% | 0.78 | S | S | * | * | trans | -75.4 | 122.3 | 178.5 | -84.9 | -34.9 | 0 | 0 | 0 | 112.8 | ||||
| 403 | S | 28.7 | Very low | 25.6 | Very low | 119 Ų | 119 | 150.6 Ų | 150.6 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | 176.2 | 158.9 | 108.9 | -162 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 404 | M | 26.4 | Very low | 26.2 | Very low | 167 Ų | 167 | 151.2 Ų | 151.2 | 82% | 0.823 | 78% | 0.783 | S | S | * | * | trans | -72.5 | 160.1 | 177.1 | -63.4 | 178.2 | 90.6 | 0 | 0 | 112.4 | ||||
| 405 | V | 23.3 | Very low | 26.4 | Very low | 111 Ų | 111 | 151.5 Ų | 151.5 | 67% | 0.673 | 79% | 0.785 | S | S | * | * | cis | -163.7 | 147.1 | -10.3 | 126.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 406 | F | 25.8 | Very low | 26.5 | Very low | 206 Ų | 206 | 151.9 Ų | 151.9 | 90% | 0.904 | 79% | 0.788 | S | S | * | * | trans | -168.9 | 133.6 | 139.3 | -116.3 | -73.5 | 0 | 0 | 0 | 111.5 | ||||
| 407 | E | 24.9 | Very low | 26.6 | Very low | 161 Ų | 161 | 149.6 Ų | 149.6 | 75% | 0.752 | 79% | 0.785 | S | S | * | * | trans | -82 | 177.4 | 166.3 | -51.1 | -170.1 | 145.3 | 0 | 0 | 111 | ||||
| 408 | T | 23.3 | Very low | 26.3 | Very low | 102 Ų | 102 | 151 Ų | 151 | 63% | 0.626 | 79% | 0.788 | S | S | * | * | cis | -155.9 | 159.7 | 6.5 | -21.4 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 409 | F | 27.4 | Very low | 26.4 | Very low | 173 Ų | 173 | 151 Ų | 151 | 76% | 0.759 | 79% | 0.793 | S | S | * | * | 170.1 | 113.5 | 123.7 | -107.2 | -87.7 | 0 | 0 | 0 | 116 | |||||
| 410 | R | 27 | Very low | 26.8 | Very low | 214 Ų | 214 | 154.1 Ų | 154.1 | 81% | 0.808 | 80% | 0.801 | S | S | * | * | trans | 34.6 | 109 | 143.8 | -63.2 | -174.1 | 179.9 | -177.9 | -0.7 | 122.8 | ||||
| 411 | K | 23.5 | Very low | 27 | Very low | 187 Ų | 187 | 152.8 Ų | 152.8 | 81% | 0.813 | 80% | 0.8 | S | S | * | * | 59.1 | 135.3 | 104.7 | -85 | -168 | 174.7 | -175.9 | 0 | 123.1 | |||||
| 412 | N | 24.5 | Very low | 26.9 | Very low | 135 Ų | 135 | 155.8 Ų | 155.8 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | trans | 80.9 | 111.3 | 141.1 | -67.3 | 18.6 | 0 | 0 | 0 | 121 | ||||
| 413 | S | 27.6 | Very low | 26.7 | Very low | 113 Ų | 113 | 151.1 Ų | 151.1 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | 154.5 | 104.5 | 102.2 | -79.6 | 0 | 0 | 0 | 0 | 115.3 | |||||
| 414 | I | 34.5 | Very low | 26.6 | Very low | 169 Ų | 169 | 155.5 Ų | 155.5 | 87% | 0.867 | 80% | 0.797 | S | S | * | * | trans | -147.5 | 142.3 | 160 | -56 | -176.8 | 0 | 0 | 0 | 103.9 | ||||
| 415 | P | 30.2 | Very low | 26.4 | Very low | 107 Ų | 107 | 156.2 Ų | 156.2 | 70% | 0.695 | 79% | 0.791 | S | S | * | * | cis | -131.9 | 177.4 | 27 | 43.4 | -28.4 | 0 | 0 | 0 | 116.6 | ||||
| 416 | L | 26.2 | Very low | 26.8 | Very low | 171 Ų | 171 | 156.2 Ų | 156.2 | 90% | 0.895 | 79% | 0.793 | S | S | * | * | -167.9 | 150.8 | 119.4 | -103.1 | 172 | 0 | 0 | 0 | 110.1 | |||||
| 417 | S | 25.6 | Very low | 26.9 | Very low | 99 Ų | 99 | 151.8 Ų | 151.8 | 69% | 0.692 | 78% | 0.779 | S | S | * | * | trans | -118.2 | 123.9 | -178.5 | -70.4 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 418 | F | 22 | Very low | 26.8 | Very low | 209 Ų | 209 | 152.2 Ų | 152.2 | 92% | 0.917 | 78% | 0.778 | S | S | * | * | trans | 161.6 | 97.5 | 131.2 | -92.3 | -65.6 | 0 | 0 | 0 | 112 | ||||
| 419 | S | 25.9 | Very low | 26.8 | Very low | 125 Ų | 125 | 153.8 Ų | 153.8 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | trans | -177.4 | 127.7 | 136.1 | 36.5 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 420 | K | 34.5 | Very low | 26.6 | Very low | 200 Ų | 200 | 149.7 Ų | 149.7 | 87% | 0.87 | 79% | 0.786 | S | S | * | * | trans | -121 | 148.2 | 157.7 | -74.9 | 176.7 | 178 | 170.3 | 0 | 104.4 | ||||
| 421 | P | 29.1 | Very low | 26.5 | Very low | 118 Ų | 118 | 150.6 Ų | 150.6 | 77% | 0.766 | 79% | 0.79 | S | S | * | * | -156.4 | 140.6 | 73 | 38 | -16.1 | 0 | 0 | 0 | 119.7 | |||||
| 422 | K | 24.9 | Very low | 26.6 | Very low | 216 Ų | 216 | 148.8 Ų | 148.8 | 94% | 0.939 | 79% | 0.787 | S | S | * | * | 40 | 130.2 | 129.5 | -60.3 | -179.1 | 175.4 | 179 | 0 | 122.7 | |||||
| 423 | G | 25.6 | Very low | 26.8 | Very low | 71 Ų | 71 | 148 Ų | 148 | 73% | 0.732 | 78% | 0.783 | S | S | * | * | trans | 148 | 140.3 | 145.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 424 | Y | 26 | Very low | 26.8 | Very low | 212 Ų | 212 | 149.7 Ų | 149.7 | 83% | 0.831 | 78% | 0.776 | S | S | * | * | cis | -143 | 142.9 | -4.6 | -120.4 | -121.4 | 0 | 0 | 0 | 106.5 | ||||
| 425 | W | 23.2 | Very low | 26.2 | Very low | 182 Ų | 182 | 148.5 Ų | 148.5 | 69% | 0.689 | 77% | 0.771 | S | S | * | * | 51.8 | 141.7 | 102.1 | -78 | 80.7 | 0 | 0 | 0 | 116.4 | N427 | W425-N427 WeakPolarHBondContact CZ3-OD1 3.2Š| |||
| 426 | P | 31.7 | Very low | 26 | Very low | 111 Ų | 111 | 148.2 Ų | 148.2 | 72% | 0.721 | 77% | 0.767 | S | S | * | * | -147.4 | 163.5 | 50.3 | 42 | -22.9 | 0 | 0 | 0 | 120.4 | |||||
| 427 | N | 27 | Very low | 26.2 | Very low | 113 Ų | 113 | 147.8 Ų | 147.8 | 60% | 0.604 | 76% | 0.761 | S | S | * | * | trans | 35.8 | 117.5 | 143.6 | -68.6 | -31.2 | 0 | 0 | 0 | 120.4 | W425 | W425-N427 WeakPolarHBondContact CZ3-OD1 3.2Š| ||
| 428 | K | 23 | Very low | 26.1 | Very low | 169 Ų | 169 | 150.5 Ų | 150.5 | 74% | 0.735 | 76% | 0.761 | S | S | * | * | 75.5 | 117.4 | 72.1 | -84.8 | -169.1 | 171.5 | -175.6 | 0 | 115.4 | |||||
| 429 | T | 23.1 | Very low | 26.4 | Very low | 136 Ų | 136 | 143.7 Ų | 143.7 | 83% | 0.834 | 74% | 0.743 | S | S | * | * | trans | 63.9 | 140.1 | 144.5 | 50.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 430 | A | 24.5 | Very low | 26.3 | Very low | 86 Ų | 86 | 145.5 Ų | 145.5 | 71% | 0.711 | 74% | 0.735 | S | S | * | * | cis | -158.5 | 179.3 | -1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 431 | R | 24.5 | Very low | 26.6 | Very low | 234 Ų | 234 | 142 Ų | 142 | 88% | 0.883 | 73% | 0.73 | S | S | * | * | trans | -3.9 | 148.8 | 155.5 | -52.4 | 171.5 | 169.4 | 168.3 | -7 | 116.7 | ||||
| 432 | I | 24.7 | Very low | 26.6 | Very low | 148 Ų | 148 | 141.6 Ų | 141.6 | 76% | 0.759 | 73% | 0.728 | S | S | * | * | cis | -161.6 | 131.8 | 49.4 | -67.2 | 165.9 | 0 | 0 | 0 | 108.4 | ||||
| 433 | D | 28.2 | Very low | 26.8 | Very low | 118 Ų | 118 | 138.2 Ų | 138.2 | 63% | 0.631 | 72% | 0.718 | S | S | * | * | -171.4 | 147.4 | 113.2 | -127.3 | 0.9 | 0 | 0 | 0 | 115.6 | |||||
| 434 | K | 27.6 | Very low | 26.9 | Very low | 149 Ų | 149 | 140.8 Ų | 140.8 | 65% | 0.648 | 72% | 0.715 | S | S | * | * | trans | 12.3 | 120.4 | 154.5 | -66.2 | 171.9 | -159.3 | 76.3 | 0 | 120.9 | ||||
| 435 | D | 23.7 | Very low | 27 | Very low | 144 Ų | 144 | 139.5 Ų | 139.5 | 77% | 0.77 | 72% | 0.717 | S | S | * | * | 47.2 | 142.7 | 101 | -52.4 | -34.9 | 0 | 0 | 0 | 121.5 | |||||
| 436 | V | 24.8 | Very low | 27.1 | Very low | 101 Ų | 101 | 134.9 Ų | 134.9 | 61% | 0.612 | 71% | 0.712 | S | S | * | * | trans | 63.6 | 86.4 | 152.6 | 173.8 | 0 | 0 | 0 | 0 | 113.7 | F438 | V436-F438 HydrophobicContact CG1-CD2 3.65Å; V436-F438 HydrophobicContact CG1-CE2 3.61Å | ||
| 437 | Q | 30.7 | Very low | 26.8 | Very low | 163 Ų | 163 | 135.9 Ų | 135.9 | 76% | 0.762 | 71% | 0.712 | S | S | * | * | 73.2 | 178.8 | 86.8 | -74.5 | -178.5 | -9.2 | 0 | 0 | 113.1 | |||||
| 438 | F | 24.4 | Very low | 26.9 | Very low | 156 Ų | 156 | 134.3 Ų | 134.3 | 68% | 0.684 | 71% | 0.714 | S | S | * | * | trans | 73.6 | 138.5 | 172.5 | -59.7 | -77.9 | 0 | 0 | 0 | 116.8 | V436 F440 | V436-F438 HydrophobicContact CG1-CD2 3.65Å; V436-F438 HydrophobicContact CG1-CE2 3.61Å; F438-F440 HydrophobicContact CB-CE2 4.45Å; F438-F440 HydrophobicContact CD1-CZ 4.31Å | ||
| 439 | A | 27 | Very low | 26.9 | Very low | 66 Ų | 66 | 131 Ų | 131 | 55% | 0.545 | 71% | 0.713 | S | S | . | * | cis | -168.5 | -161.4 | -26.5 | 0 | 0 | 0 | 0 | 0 | 104.9 | ||||
| 440 | F | 24.8 | Very low | 27 | Very low | 163 Ų | 163 | 130.6 Ų | 130.6 | 72% | 0.715 | 71% | 0.705 | S | S | * | * | cis | -160.8 | 133.2 | 29.7 | -92 | -80.4 | 0 | 0 | 0 | 105.3 | F438 | F438-F440 HydrophobicContact CB-CE2 4.45Å; F438-F440 HydrophobicContact CD1-CZ 4.31Å | ||
| 441 | V | 40.6 | Very low | 27 | Very low | 126 Ų | 126 | 132.9 Ų | 132.9 | 76% | 0.764 | 70% | 0.696 | S | S | * | * | 43 | 81.1 | 62.9 | -172.5 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 442 | P | 28.5 | Very low | 27 | Very low | 109 Ų | 109 | 123.4 Ų | 123.4 | 71% | 0.708 | 67% | 0.665 | S | S | * | * | -127.2 | 157.3 | 113.6 | 40.6 | -34.7 | 0 | 0 | 0 | 109.5 | |||||
| 443 | I | 28.6 | Very low | 27.1 | Very low | 145 Ų | 145 | 118 Ų | 118 | 74% | 0.744 | 64% | 0.643 | S | S | * | * | S | Bend | cis | -139.4 | 135.3 | 33.5 | -75.3 | 168.8 | 0 | 0 | 0 | 109.4 | ||
| 444 | N | 27.8 | Very low | 27.1 | Very low | 125 Ų | 125 | 118 Ų | 118 | 67% | 0.668 | 64% | 0.643 | S | S | * | * | trans | 48.4 | 120.4 | 150.3 | -66.5 | 20.6 | 0 | 0 | 0 | 119 | ||||
| 445 | Q | 28.5 | Very low | 27.2 | Very low | 185 Ų | 185 | 118 Ų | 118 | 86% | 0.864 | 65% | 0.645 | S | S | * | * | cis | 47.3 | 128.9 | 27.6 | -97.5 | -166 | 9.3 | 0 | 0 | 113.8 | ||||
| 446 | S | 25.6 | Very low | 27.7 | Very low | 85 Ų | 85 | 115.5 Ų | 115.5 | 59% | 0.594 | 64% | 0.637 | S | S | * | * | trans | 73.2 | 135.8 | -162.4 | 80 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 447 | D | 25.7 | Very low | 28 | Very low | 132 Ų | 132 | 114.2 Ų | 114.2 | 71% | 0.706 | 63% | 0.629 | S | S | * | * | cis | -144.8 | 154.7 | -5.1 | -96 | -22.1 | 0 | 0 | 0 | 107.7 | S449 | D447-S449 PolarHBondContact O-N 3.17Š| ||
| 448 | A | 28 | Very low | 27.8 | Very low | 80 Ų | 80 | 110.3 Ų | 110.3 | 66% | 0.661 | 63% | 0.633 | S | S | * | * | cis | 59.1 | 18.2 | 46.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | L450 | A448-L450 PolarHBondContact O-N 3.38Š| ||
| 449 | S | 24.3 | Very low | 28.5 | Very low | 101 Ų | 101 | 113.8 Ų | 113.8 | 71% | 0.706 | 64% | 0.641 | S | S | * | * | -59 | 95.1 | 125.7 | 56.7 | 0 | 0 | 0 | 0 | 105.2 | D447 | D447-S449 PolarHBondContact O-N 3.17Š| |||
| 450 | L | 23.9 | Very low | 28.9 | Very low | 126 Ų | 126 | 117.8 Ų | 117.8 | 66% | 0.66 | 64% | 0.642 | S | S | * | * | 56.2 | 116.4 | 90.7 | -67.9 | 171.7 | 0 | 0 | 0 | 109.3 | A448 | A448-L450 PolarHBondContact O-N 3.38Š| |||
| 451 | Y | 24.7 | Very low | 29.1 | Very low | 135 Ų | 135 | 114.5 Ų | 114.5 | 53% | 0.529 | 64% | 0.638 | S | S | . | * | trans | 59.4 | 125.5 | 140.7 | -77.1 | -112.8 | 0 | 0 | 0 | 116.7 | R472 | Y451-R472 HydrophobicContact CE1-CB 4.08Å; Y451-R472 HydrophobicContact CE1-CG 4.45Å; Y451-R472 VanDerWaalsContact CE2-NH1 3.29Å; Y451-R472 VanDerWaalsContact CZ-CD 3.5Å; Y451-R472 VanDerWaalsContact CZ-NH1 3.34Å; Y451-R472 WeakPolarHBondContact OH-CD 3.33Å; Y451-R472 PolarHBondContact OH-NH1 2.9Å | ||
| 452 | S | 24.3 | Very low | 29 | Very low | 34 Ų | 34 | 115.8 Ų | 115.8 | 24% | 0.238 | 64% | 0.639 | C | S | . | * | cis | 150 | 145.2 | 36.1 | 167 | 0 | 0 | 0 | 0 | 111.5 | T470 I471 | S452-T470 WeakPolarHBondContact OG-CA 3.47Å; S452-T470 WeakPolarHBondContact OG-CB 3.48Å; S452-T470 WeakPolarHBondContact OG-CG2 3.42Å; S452-I471 VanDerWaalsContact OG-C 3.32Å; S452-I471 WeakPolarHBondContact OG-CA 3.33Å; S452-I471 WeakPolarHBondContact OG-CB 3.18Å; S452-I471 PolarHBondContact OG-N 2.69Å; S452-I471 PolarHBondContact OG-O 3.31Å | ||
| 453 | A | 28.5 | Very low | 29 | Very low | 35 Ų | 35 | 117.6 Ų | 117.6 | 29% | 0.289 | 64% | 0.638 | S | S | . | * | trans | 82 | 142 | 174 | 0 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 454 | N | 27 | Very low | 29 | Very low | 119 Ų | 119 | 115.7 Ų | 115.7 | 64% | 0.636 | 63% | 0.628 | S | S | * | * | 34.9 | 147.7 | 124.6 | -49.6 | 16.3 | 0 | 0 | 0 | 123.8 | |||||
| 455 | E | 29.7 | Very low | 29.4 | Very low | 149 Ų | 149 | 117.5 Ų | 117.5 | 70% | 0.696 | 63% | 0.63 | S | S | * | * | 99 | 145.2 | 128.5 | -93.9 | 157.8 | -108 | 0 | 0 | 118.8 | |||||
| 456 | P | 35.2 | Very low | 29.5 | Very low | 91 Ų | 91 | 114.3 Ų | 114.3 | 59% | 0.591 | 63% | 0.628 | S | S | * | * | trans | -85.7 | -178 | 177.3 | 36.6 | -32.2 | 0 | 0 | 0 | 110.9 | ||||
| 457 | T | 30.1 | Very low | 29.6 | Very low | 73 Ų | 73 | 118.5 Ų | 118.5 | 45% | 0.448 | 64% | 0.638 | S | S | . | * | trans | 78.8 | 143.3 | 171.3 | 74.7 | 0 | 0 | 0 | 0 | 114.7 | R459 R460 | T457-R459 WeakPolarHBondContact CB-O 3.48Å; T457-R459 HydrophobicContact CG2-CB 3.82Å; T457-R460 HydrophobicContact CG2-CG 3.97Å; T457-R460 PolarHBondContact OG1-NE 2.81Å; T457-R460 PolarHBondContact OG1-NH2 3.43Å | ||
| 458 | G | 26.7 | Very low | 29.7 | Very low | 82 Ų | 82 | 122.8 Ų | 122.8 | 85% | 0.845 | 65% | 0.645 | S | S | * | * | S | Bend | cis | -47.5 | 154.8 | 13.9 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||
| 459 | R | 38.9 | Very low | 29.6 | Very low | 228 Ų | 228 | 123.5 Ų | 123.5 | 86% | 0.86 | 65% | 0.645 | S | S | * | * | 51.9 | 166.4 | -73.5 | -84.2 | -170.1 | 178.2 | -142.9 | 0.8 | 120.6 | T457 | T457-R459 WeakPolarHBondContact CB-O 3.48Å; T457-R459 HydrophobicContact CG2-CB 3.82Å | |||
| 460 | R | 36.7 | Very low | 29.7 | Very low | 150 Ų | 150 | 122.9 Ų | 122.9 | 57% | 0.566 | 64% | 0.637 | S | S | * | * | trans | 72.6 | 146.5 | -168.1 | -43.6 | -171.4 | -147 | -133.1 | 9.1 | 111.3 | T457 | T457-R460 HydrophobicContact CG2-CG 3.97Å; T457-R460 PolarHBondContact OG1-NE 2.81Å; T457-R460 PolarHBondContact OG1-NH2 3.43Å | ||
| 461 | P | 28.7 | Very low | 29.8 | Very low | 95 Ų | 95 | 121.4 Ų | 121.4 | 62% | 0.617 | 63% | 0.629 | S | S | * | * | cis | -75.9 | 152.1 | 16.5 | -6 | 24.1 | 0 | 0 | 0 | 112.7 | E463 | P461-E463 HydrophobicContact CB-CB 4.14Å; P461-E463 HydrophobicContact CB-CG 3.5Å; P461-E463 HydrophobicContact CG-CG 4.06Å | ||
| 462 | I | 37.3 | Very low | 29.8 | Very low | 153 Ų | 153 | 123 Ų | 123 | 79% | 0.785 | 63% | 0.634 | S | S | * | * | S | Bend | cis | -10.4 | 98.9 | 29.3 | -48.4 | -177.2 | 0 | 0 | 0 | 115.5 | ||
| 463 | E | 29.8 | Very low | 30.3 | Very low | 147 Ų | 147 | 130.8 Ų | 130.8 | 69% | 0.687 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -71.3 | 145.7 | 167 | -78.9 | -129.9 | 144.7 | 0 | 0 | 110.1 | P461 | P461-E463 HydrophobicContact CB-CB 4.14Å; P461-E463 HydrophobicContact CB-CG 3.5Å; P461-E463 HydrophobicContact CG-CG 4.06Å |
| 464 | L | 28.4 | Very low | 30.4 | Very low | 104 Ų | 104 | 138.2 Ų | 138.2 | 55% | 0.545 | 69% | 0.692 | S | S | . | * | cis | -173.7 | 154.8 | -14.1 | -116.7 | -165.3 | 0 | 0 | 0 | 104.5 | ||||
| 465 | K | 35.7 | Very low | 31.1 | Very low | 163 Ų | 163 | 137.9 Ų | 137.9 | 71% | 0.709 | 70% | 0.697 | S | S | * | * | cis | -150.6 | 165.7 | 20.5 | -50.8 | -169.6 | -174.2 | -125.3 | 0 | 109.8 | ||||
| 466 | S | 30 | Very low | 30.9 | Very low | 118 Ų | 118 | 139 Ų | 139 | 83% | 0.825 | 71% | 0.706 | S | S | * | * | trans | 69.6 | 157.2 | 165.9 | 76.6 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 467 | E | 29.1 | Very low | 30.6 | Very low | 173 Ų | 173 | 138 Ų | 138 | 81% | 0.808 | 71% | 0.712 | S | S | * | * | cis | -166.6 | 140.3 | -46.6 | -119.1 | -178.7 | 173.1 | 0 | 0 | 111.4 | ||||
| 468 | R | 25.9 | Very low | 30.6 | Very low | 223 Ų | 223 | 142.9 Ų | 142.9 | 84% | 0.842 | 73% | 0.73 | S | S | * | * | trans | 49.4 | 110.6 | 156.7 | -76.7 | -179.5 | 163.5 | 169.5 | -3.7 | 123.3 | ||||
| 469 | S | 27.4 | Very low | 30.5 | Very low | 94 Ų | 94 | 145.5 Ų | 145.5 | 66% | 0.657 | 72% | 0.723 | S | S | * | * | 86.3 | 151 | 116.1 | 78.8 | 0 | 0 | 0 | 0 | 125.4 | |||||
| 470 | T | 25.8 | Very low | 29.9 | Very low | 89 Ų | 89 | 138.8 Ų | 138.8 | 55% | 0.546 | 71% | 0.711 | S | S | . | * | trans | 94.2 | 99.9 | 150.7 | 62.2 | 0 | 0 | 0 | 0 | 127.4 | S452 | S452-T470 WeakPolarHBondContact OG-CA 3.47Å; S452-T470 WeakPolarHBondContact OG-CB 3.48Å; S452-T470 WeakPolarHBondContact OG-CG2 3.42Å | ||
| 471 | I | 26.6 | Very low | 29.6 | Very low | 95 Ų | 95 | 139.7 Ų | 139.7 | 49% | 0.487 | 72% | 0.721 | S | S | . | * | trans | -22.6 | 140.3 | 144.9 | -88 | 164.3 | 0 | 0 | 0 | 117.1 | S452 | S452-I471 VanDerWaalsContact OG-C 3.32Å; S452-I471 WeakPolarHBondContact OG-CA 3.33Å; S452-I471 WeakPolarHBondContact OG-CB 3.18Å; S452-I471 PolarHBondContact OG-N 2.69Å; S452-I471 PolarHBondContact OG-O 3.31Å | ||
| 472 | R | 25 | Very low | 29.6 | Very low | 167 Ų | 167 | 141 Ų | 141 | 63% | 0.63 | 73% | 0.728 | S | S | * | * | 169.2 | 121.7 | 108.4 | -146.5 | -178.6 | -142.9 | -171.1 | 1.9 | 115.9 | Y451 | Y451-R472 HydrophobicContact CE1-CB 4.08Å; Y451-R472 HydrophobicContact CE1-CG 4.45Å; Y451-R472 VanDerWaalsContact CE2-NH1 3.29Å; Y451-R472 VanDerWaalsContact CZ-CD 3.5Å; Y451-R472 VanDerWaalsContact CZ-NH1 3.34Å; Y451-R472 WeakPolarHBondContact OH-CD 3.33Å; Y451-R472 PolarHBondContact OH-NH1 2.9Å | |||
| 473 | K | 33.5 | Very low | 29.3 | Very low | 199 Ų | 199 | 140.2 Ų | 140.2 | 87% | 0.865 | 73% | 0.725 | S | S | * | * | trans | 56.2 | 171 | 149.5 | -76.4 | -171.2 | 175.1 | -169.8 | 0 | 121.3 | ||||
| 474 | Q | 30.5 | Very low | 30 | Very low | 190 Ų | 190 | 136.7 Ų | 136.7 | 89% | 0.888 | 72% | 0.717 | S | S | * | * | trans | -68.6 | 169.1 | -178.3 | -91.9 | -176.8 | -9 | 0 | 0 | 114.7 | ||||
| 475 | P | 41.7 | Very low | 30.6 | Very low | 113 Ų | 113 | 138.5 Ų | 138.5 | 73% | 0.734 | 73% | 0.727 | S | S | * | * | trans | -99.4 | 176 | -147.3 | 38.5 | -39.1 | 0 | 0 | 0 | 118.4 | ||||
| 476 | I | 27 | Very low | 30.6 | Very low | 172 Ų | 172 | 136.2 Ų | 136.2 | 88% | 0.882 | 73% | 0.732 | S | S | * | * | trans | 94.7 | 127.4 | 166.6 | -53.1 | 174.7 | 0 | 0 | 0 | 116.5 | ||||
| 477 | G | 28.8 | Very low | 30.8 | Very low | 71 Ų | 71 | 138 Ų | 138 | 73% | 0.732 | 73% | 0.731 | S | S | * | * | trans | 118.8 | 83.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 478 | Q | 28.6 | Very low | 31.2 | Very low | 175 Ų | 175 | 137.5 Ų | 137.5 | 82% | 0.818 | 73% | 0.729 | S | S | * | * | 83.1 | 119.7 | 51.5 | -110.7 | -162.7 | 1.3 | 0 | 0 | 117.2 | |||||
| 479 | I | 25 | Very low | 31.8 | Very low | 137 Ų | 137 | 134.5 Ų | 134.5 | 70% | 0.703 | 73% | 0.729 | S | S | * | * | trans | 96.2 | 132.9 | 145 | -65.1 | 165 | 0 | 0 | 0 | 121.5 | ||||
| 480 | S | 27.5 | Very low | 32.4 | Very low | 86 Ų | 86 | 134 Ų | 134 | 60% | 0.601 | 73% | 0.731 | S | S | * | * | trans | 70.8 | 117.6 | 161.9 | -71.7 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 481 | Q | 30 | Very low | 32.9 | Very low | 169 Ų | 169 | 135 Ų | 135 | 79% | 0.79 | 74% | 0.736 | S | S | * | * | 79.2 | 138.9 | 66.8 | -72.2 | 166.6 | -25 | 0 | 0 | 112.6 | |||||
| 482 | T | 27.5 | Very low | 32.8 | Very low | 122 Ų | 122 | 137.7 Ų | 137.7 | 75% | 0.748 | 75% | 0.75 | S | S | * | * | cis | -163.7 | -178.7 | -2.9 | 17.6 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 483 | N | 31.1 | Very low | 32.8 | Very low | 137 Ų | 137 | 135.8 Ų | 135.8 | 73% | 0.733 | 75% | 0.752 | S | S | * | * | cis | -163.3 | 175.1 | 8.3 | -126.3 | 39.1 | 0 | 0 | 0 | 105.6 | ||||
| 484 | S | 45.2 | Very low | 32.4 | Very low | 74 Ų | 74 | 131.2 Ų | 131.2 | 52% | 0.517 | 75% | 0.745 | S | S | . | * | cis | -172.3 | -174.4 | -18.1 | 42.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 485 | D | 40.1 | Very low | 32.4 | Very low | 141 Ų | 141 | 128.2 Ų | 128.2 | 75% | 0.754 | 74% | 0.735 | S | S | * | * | trans | 70.1 | 92.5 | 154.2 | -51.3 | -51.1 | 0 | 0 | 0 | 121.7 | ||||
| 486 | S | 35.5 | Very low | 31.9 | Very low | 115 Ų | 115 | 129.8 Ų | 129.8 | 80% | 0.804 | 73% | 0.73 | S | S | * | * | -167.6 | 96.4 | 125.6 | 60.5 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 487 | L | 35.4 | Very low | 32 | Very low | 155 Ų | 155 | 130 Ų | 130 | 81% | 0.812 | 72% | 0.724 | S | S | * | * | 86.1 | 120.2 | 75.4 | -95.3 | 170.7 | 0 | 0 | 0 | 114.6 | |||||
| 488 | E | 36.4 | Very low | 32.6 | Very low | 163 Ų | 163 | 130.5 Ų | 130.5 | 76% | 0.762 | 71% | 0.713 | S | S | * | * | trans | 67.2 | 166.5 | 166.5 | -48.6 | -161.4 | 133.6 | 0 | 0 | 118.1 | ||||
| 489 | L | 38.6 | Very low | 32.8 | Very low | 161 Ų | 161 | 127.4 Ų | 127.4 | 84% | 0.843 | 70% | 0.699 | S | S | * | * | trans | 49 | 90.3 | 157 | -63.2 | 154.6 | 0 | 0 | 0 | 116.4 | ||||
| 490 | A | 41.3 | Very low | 33 | Very low | 84 Ų | 84 | 130.1 Ų | 130.1 | 69% | 0.694 | 71% | 0.706 | S | S | * | * | S | Bend | cis | -159.4 | 166.9 | 9.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 491 | V | 36.6 | Very low | 33 | Very low | 109 Ų | 109 | 128.5 Ų | 128.5 | 66% | 0.661 | 70% | 0.697 | S | S | * | * | trans | 60.9 | 94.3 | 167.5 | -174.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 492 | I | 22.6 | Very low | 33 | Very low | 151 Ų | 151 | 125.7 Ų | 125.7 | 77% | 0.774 | 69% | 0.691 | S | S | * | * | cis | 50.1 | 113.4 | 32.1 | -62.2 | 175.1 | 0 | 0 | 0 | 112.8 | ||||
| 493 | D | 25.1 | Very low | 33.4 | Very low | 128 Ų | 128 | 127.7 Ų | 127.7 | 68% | 0.684 | 69% | 0.69 | S | S | * | * | trans | 48.2 | 96.6 | 168.5 | -81.3 | -36.1 | 0 | 0 | 0 | 117.4 | ||||
| 494 | S | 26.1 | Very low | 33.7 | Very low | 103 Ų | 103 | 126.1 Ų | 126.1 | 72% | 0.72 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -156.1 | 64.3 | 160.6 | -76.1 | 0 | 0 | 0 | 0 | 111.7 | ||
| 495 | L | 30.6 | Very low | 33.5 | Very low | 126 Ų | 126 | 129.7 Ų | 129.7 | 66% | 0.66 | 70% | 0.695 | S | S | * | * | S | Bend | cis | -168.9 | 108.4 | 36.6 | -86.4 | 171.5 | 0 | 0 | 0 | 110.8 | K497 V498 | L495-K497 CarbonylContact C-O 2.79Å; L495-K497 WeakPolarHBondContact CA-O 3.4Å; L495-K497 WeakPolarHBondContact CB-O 3.34Å; L495-K497 WeakPolarHBondContact CD2-O 3.32Å; L495-V498 PolarHBondContact O-N 3.16Å |
| 496 | K | 30 | Very low | 33.3 | Very low | 147 Ų | 147 | 128.4 Ų | 128.4 | 64% | 0.639 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -116.6 | 6.5 | 168.4 | -141 | 174 | -170.2 | -95.6 | 0 | 117.3 | Q499 | K496-Q499 HydrophobicContact CG-CB 3.66Å; K496-Q499 WeakPolarHBondContact O-CB 3.48Å |
| 497 | K | 29 | Very low | 33.1 | Very low | 175 Ų | 175 | 130.2 Ų | 130.2 | 76% | 0.761 | 69% | 0.691 | S | S | * | * | S | Bend | -90.2 | 124.2 | 101.7 | -64.3 | 169.1 | -174.9 | 165.5 | 0 | 103.7 | L495 | L495-K497 CarbonylContact C-O 2.79Å; L495-K497 WeakPolarHBondContact CA-O 3.4Å; L495-K497 WeakPolarHBondContact CB-O 3.34Å; L495-K497 WeakPolarHBondContact CD2-O 3.32Å | |
| 498 | V | 42.2 | Very low | 33 | Very low | 82 Ų | 82 | 128.1 Ų | 128.1 | 50% | 0.497 | 69% | 0.685 | S | S | . | * | S | Bend | cis | -118.3 | 36.7 | 35.4 | 168.1 | 0 | 0 | 0 | 0 | 112.5 | L495 K500 A501 | L495-V498 PolarHBondContact O-N 3.16Å; V498-K500 PolarHBondContact O-N 3.19Å; V498-K500 VanDerWaalsContact O-N 3.17Å; V498-A501 HydrophobicContact CB-CB 4.39Å; V498-A501 HydrophobicContact CG1-CB 3.76Å; V498-A501 WeakPolarHBondContact CG1-O 3.49Å; V498-A501 HydrophobicContact CG2-CB 4.03Å |
| 499 | Q | 32.4 | Very low | 32.5 | Very low | 111 Ų | 111 | 128 Ų | 128 | 52% | 0.519 | 68% | 0.684 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -53.1 | 125 | 133.4 | -171.8 | -163.2 | 3.8 | 0 | 0 | 106.6 | K496 A501 | K496-Q499 HydrophobicContact CG-CB 3.66Å; K496-Q499 WeakPolarHBondContact O-CB 3.48Å; Q499-A501 PolarHBondContact O-N 3.4Å |
| 500 | K | 30.7 | Very low | 31.9 | Very low | 194 Ų | 194 | 127.3 Ų | 127.3 | 84% | 0.843 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 65.7 | 33.7 | 170.5 | -154 | 177.9 | -179 | 178.1 | 0 | 115.5 | V498 | V498-K500 PolarHBondContact O-N 3.19Å; V498-K500 VanDerWaalsContact O-N 3.17Å |
| 501 | A | 26.9 | Very low | 31.5 | Very low | 51 Ų | 51 | 129.2 Ų | 129.2 | 42% | 0.421 | 69% | 0.686 | S | S | . | * | trans | -116.8 | 125.2 | 141.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | V498 Q499 | V498-A501 HydrophobicContact CB-CB 4.39Å; V498-A501 HydrophobicContact CG1-CB 3.76Å; V498-A501 WeakPolarHBondContact CG1-O 3.49Å; V498-A501 HydrophobicContact CG2-CB 4.03Å; Q499-A501 PolarHBondContact O-N 3.4Å | ||
| 502 | V | 30.3 | Very low | 31.6 | Very low | 110 Ų | 110 | 129.2 Ų | 129.2 | 67% | 0.667 | 69% | 0.689 | S | S | * | * | cis | 64.1 | 88.9 | 34.6 | -167.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 503 | K | 34.8 | Very low | 32.2 | Very low | 165 Ų | 165 | 128.8 Ų | 128.8 | 72% | 0.717 | 69% | 0.687 | S | S | * | * | trans | 72.6 | 158.9 | 154.9 | -59.5 | 170.8 | 139.9 | -81.5 | 0 | 115.6 | ||||
| 504 | D | 38.3 | Very low | 32.9 | Very low | 103 Ų | 103 | 131.4 Ų | 131.4 | 55% | 0.551 | 69% | 0.692 | S | S | * | * | cis | -169.7 | 168.6 | -23.2 | -92.6 | -23.6 | 0 | 0 | 0 | 105.1 | ||||
| 505 | N | 40.3 | Very low | 33.9 | Very low | 150 Ų | 150 | 137.8 Ų | 137.8 | 80% | 0.802 | 70% | 0.7 | S | S | * | * | trans | 80 | 143.7 | 159.8 | -46.8 | -53.1 | 0 | 0 | 0 | 116 | ||||
| 506 | V | 36.7 | Very low | 34.9 | Very low | 113 Ų | 113 | 137.2 Ų | 137.2 | 69% | 0.685 | 70% | 0.704 | S | S | * | * | cis | -158.2 | 143.7 | 1.7 | 97.7 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 507 | L | 31.6 | Very low | 35.3 | Very low | 154 Ų | 154 | 136.2 Ų | 136.2 | 81% | 0.806 | 70% | 0.704 | S | S | * | * | trans | 52.9 | 143.2 | 158.3 | -68.7 | 152.7 | 0 | 0 | 0 | 118.4 | ||||
| 508 | T | 32 | Very low | 35.6 | Very low | 111 Ų | 111 | 136.2 Ų | 136.2 | 68% | 0.681 | 70% | 0.704 | S | S | * | * | cis | -136.7 | 164.3 | 18.8 | 40.1 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 509 | H | 26.2 | Very low | 35.8 | Very low | 161 Ų | 161 | 137.2 Ų | 137.2 | 75% | 0.745 | 71% | 0.712 | S | S | * | * | trans | 55.4 | 106.9 | 158.9 | -68.1 | -61.9 | 0 | 0 | 0 | 123.6 | ||||
| 510 | N | 26.7 | Very low | 35.9 | Very low | 146 Ų | 146 | 140.6 Ų | 140.6 | 78% | 0.781 | 72% | 0.72 | S | S | * | * | trans | 62.7 | 147.8 | 140.9 | -64.5 | -5.5 | 0 | 0 | 0 | 122 | ||||
| 511 | P | 33.2 | Very low | 36.1 | Very low | 123 Ų | 123 | 136.4 Ų | 136.4 | 80% | 0.799 | 71% | 0.713 | S | S | * | * | cis | -109.8 | -116.5 | -17.2 | 23.9 | -0.4 | 0 | 0 | 0 | 114.3 | ||||
| 512 | P | 38 | Very low | 36.5 | Very low | 109 Ų | 109 | 138.8 Ų | 138.8 | 71% | 0.708 | 72% | 0.718 | S | S | * | * | trans | -116.8 | 178.1 | -131.8 | 33 | -12.3 | 0 | 0 | 0 | 115.2 | ||||
| 513 | I | 34.2 | Very low | 37.5 | Very low | 143 Ų | 143 | 137.6 Ų | 137.6 | 73% | 0.733 | 71% | 0.713 | S | S | * | * | cis | -173.9 | 151.8 | -18.9 | -99.9 | 173.6 | 0 | 0 | 0 | 105.7 | ||||
| 514 | K | 41.4 | Very low | 37.3 | Very low | 182 Ų | 182 | 137.4 Ų | 137.4 | 79% | 0.791 | 72% | 0.72 | S | S | * | * | cis | -146.2 | -154.1 | -0.8 | -122.4 | 169.7 | -164.1 | 169.3 | 0 | 110.8 | ||||
| 515 | R | 47.4 | Very low | 37.1 | Very low | 238 Ų | 238 | 140 Ų | 140 | 90% | 0.898 | 73% | 0.734 | S | S | * | * | trans | -156.5 | 167 | -163.1 | -71.4 | 178.3 | -173.9 | 157.7 | 1.6 | 110.3 | ||||
| 516 | P | 50.7 | Low | 36.9 | Very low | 113 Ų | 113 | 142 Ų | 142 | 73% | 0.734 | 74% | 0.736 | S | S | * | * | cis | -151.6 | -156.5 | -26.2 | 42.1 | -19.2 | 0 | 0 | 0 | 115.9 | ||||
| 517 | I | 37.8 | Very low | 36.4 | Very low | 127 Ų | 127 | 141.4 Ų | 141.4 | 65% | 0.651 | 74% | 0.736 | S | S | * | * | trans | -36.4 | 155.7 | 158.6 | 18 | 173 | 0 | 0 | 0 | 114.9 | ||||
| 518 | K | 37 | Very low | 36.1 | Very low | 175 Ų | 175 | 141.7 Ų | 141.7 | 76% | 0.761 | 74% | 0.735 | S | S | * | * | -151.8 | 174.3 | 61.2 | -55.9 | -81.2 | 170 | 171.4 | 0 | 111.3 | |||||
| 519 | P | 44.4 | Very low | 35.8 | Very low | 102 Ų | 102 | 141.6 Ų | 141.6 | 66% | 0.662 | 73% | 0.734 | S | S | * | * | -147.3 | -164.4 | -50.5 | 44.6 | -26.6 | 0 | 0 | 0 | 114.4 | |||||
| 520 | R | 35.4 | Very low | 35.7 | Very low | 183 Ų | 183 | 142 Ų | 142 | 69% | 0.691 | 74% | 0.738 | S | S | * | * | trans | -75.8 | 140.5 | 147.6 | -163.4 | -94.7 | 179.1 | -151.3 | -9.2 | 107.9 | N522 | R520-N522 HydrophobicContact CG-CB 3.95Å; R520-N522 WeakPolarHBondContact CG-OD1 3.29Å; R520-N522 PolarHBondContact NE-OD1 3.05Å; R520-N522 VanDerWaalsContact NH2-CG 3.29Å; R520-N522 PolarHBondContact NH2-OD1 3.31Å | ||
| 521 | P | 34.9 | Very low | 35.6 | Very low | 105 Ų | 105 | 147.1 Ų | 147.1 | 68% | 0.682 | 75% | 0.747 | S | S | * | * | cis | -117.4 | 168.1 | 30.1 | 40.2 | -32.2 | 0 | 0 | 0 | 117.1 | ||||
| 522 | N | 35.2 | Very low | 35.2 | Very low | 101 Ų | 101 | 146.1 Ų | 146.1 | 54% | 0.54 | 74% | 0.743 | S | S | . | * | cis | -164.4 | -64.1 | -41.2 | -176.5 | 122.2 | 0 | 0 | 0 | 110.9 | R520 | R520-N522 HydrophobicContact CG-CB 3.95Å; R520-N522 WeakPolarHBondContact CG-OD1 3.29Å; R520-N522 PolarHBondContact NE-OD1 3.05Å; R520-N522 VanDerWaalsContact NH2-CG 3.29Å; R520-N522 PolarHBondContact NH2-OD1 3.31Å | ||
| 523 | P | 52.4 | Low | 34.6 | Very low | 86 Ų | 86 | 151.6 Ų | 151.6 | 56% | 0.558 | 75% | 0.751 | S | S | * | * | trans | -110.9 | 119 | -155.7 | 23.4 | -1.8 | 0 | 0 | 0 | 110.4 | ||||
| 524 | D | 29.9 | Very low | 34.2 | Very low | 160 Ų | 160 | 153.4 Ų | 153.4 | 86% | 0.856 | 76% | 0.756 | S | S | * | * | trans | 65.7 | 171.2 | 177.9 | -41.3 | -52.9 | 0 | 0 | 0 | 110.9 | ||||
| 525 | D | 34.5 | Very low | 33.5 | Very low | 159 Ų | 159 | 153 Ų | 153 | 85% | 0.85 | 76% | 0.757 | S | S | * | * | cis | -154.5 | -165.7 | 46.5 | -156.7 | -17.6 | 0 | 0 | 0 | 111.6 | ||||
| 526 | F | 36.1 | Very low | 32.4 | Very low | 190 Ų | 190 | 148.3 Ų | 148.3 | 83% | 0.833 | 76% | 0.755 | S | S | * | * | trans | -127.4 | -179.3 | -144.8 | -136.6 | -108 | 0 | 0 | 0 | 119 | ||||
| 527 | C | 26.1 | Very low | 31.4 | Very low | 102 Ų | 102 | 152.3 Ų | 152.3 | 69% | 0.689 | 76% | 0.76 | S | S | * | * | trans | 93.9 | 117.8 | 153.7 | -88.2 | 0 | 0 | 0 | 0 | 125 | ||||
| 528 | M | 24.6 | Very low | 31.1 | Very low | 159 Ų | 159 | 154.8 Ų | 154.8 | 78% | 0.783 | 77% | 0.77 | S | S | * | * | 83 | 130.3 | 127 | -73.1 | -66.6 | -153.8 | 0 | 0 | 126.2 | |||||
| 529 | T | 25.4 | Very low | 30.6 | Very low | 110 Ų | 110 | 155 Ų | 155 | 68% | 0.675 | 77% | 0.773 | S | S | * | * | trans | 80.4 | 131.9 | 140.1 | 46.9 | 0 | 0 | 0 | 0 | 125.6 | ||||
| 530 | M | 24.9 | Very low | 29.8 | Very low | 168 Ų | 168 | 159.6 Ų | 159.6 | 83% | 0.828 | 79% | 0.786 | S | S | * | * | trans | 19.7 | 127.1 | 145 | -53.9 | -169.2 | -51.2 | 0 | 0 | 121.3 | ||||
| 531 | W | 24.9 | Very low | 29.7 | Very low | 255 Ų | 255 | 155.7 Ų | 155.7 | 97% | 0.966 | 78% | 0.782 | S | S | * | * | trans | -139.3 | 162.3 | 143.1 | -87.5 | 86.5 | 0 | 0 | 0 | 110.9 | ||||
| 532 | S | 24.6 | Very low | 29.8 | Very low | 101 Ų | 101 | 155 Ų | 155 | 71% | 0.706 | 78% | 0.778 | S | S | * | * | trans | -118.4 | 151.4 | -147.2 | 53.6 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 533 | Y | 25.7 | Very low | 30.1 | Very low | 224 Ų | 224 | 156 Ų | 156 | 88% | 0.878 | 78% | 0.782 | S | S | * | * | trans | -60.3 | 142.1 | 159.9 | -83.9 | -105.9 | 0 | 0 | 0 | 112.2 | ||||
| 534 | Q | 25.2 | Very low | 29.6 | Very low | 181 Ų | 181 | 155.5 Ų | 155.5 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | -160.1 | 171.8 | 116 | -118.4 | 179 | -29.3 | 0 | 0 | 112.1 | |||||
| 535 | E | 27.4 | Very low | 30.5 | Very low | 174 Ų | 174 | 151.7 Ų | 151.7 | 81% | 0.813 | 76% | 0.756 | S | S | * | * | trans | -82.5 | 145.4 | -153.2 | -59.9 | 153.6 | 121.2 | 0 | 0 | 115.2 | ||||
| 536 | V | 23.8 | Very low | 31.1 | Very low | 140 Ų | 140 | 149.3 Ų | 149.3 | 85% | 0.848 | 74% | 0.743 | S | S | * | * | trans | -132.5 | 138.1 | 157.6 | -177.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 537 | K | 30.3 | Very low | 31.7 | Very low | 196 Ų | 196 | 143.2 Ų | 143.2 | 85% | 0.852 | 72% | 0.718 | S | S | * | * | trans | -66.1 | 150.2 | 177.6 | -55.1 | 172.8 | -176.4 | 177.5 | 0 | 110.5 | ||||
| 538 | Q | 29.5 | Very low | 32.7 | Very low | 180 Ų | 180 | 143.9 Ų | 143.9 | 84% | 0.841 | 71% | 0.71 | S | S | * | * | trans | -128.8 | 150.7 | 161.8 | -70.4 | -164.4 | -27.1 | 0 | 0 | 110.4 | ||||
| 539 | E | 27.4 | Very low | 34 | Very low | 180 Ų | 180 | 139.2 Ų | 139.2 | 84% | 0.841 | 69% | 0.687 | S | S | * | * | trans | -94.5 | 165.3 | -168.6 | -67.1 | 161 | 118.7 | 0 | 0 | 111.8 | V541 | E539-V541 PolarHBondContact O-N 3.07Š| ||
| 540 | E | 27.6 | Very low | 35 | Very low | 198 Ų | 198 | 138.7 Ų | 138.7 | 93% | 0.925 | 68% | 0.68 | S | S | * | * | trans | -63.9 | 130.9 | 168.9 | -63.8 | 179.4 | 137.4 | 0 | 0 | 109.8 | ||||
| 541 | V | 32.8 | Very low | 36 | Very low | 101 Ų | 101 | 132.3 Ų | 132.3 | 61% | 0.612 | 65% | 0.649 | S | S | * | * | trans | -113.9 | 123.1 | 178.2 | 178.2 | 0 | 0 | 0 | 0 | 108.6 | E539 E545 | E539-V541 PolarHBondContact O-N 3.07Å; V541-E545 HydrophobicContact CG1-CB 3.29Å; V541-E545 HydrophobicContact CG1-CG 3.67Å | ||
| 542 | P | 37.4 | Very low | 37.3 | Very low | 91 Ų | 91 | 122.2 Ų | 122.2 | 59% | 0.591 | 62% | 0.617 | S | S | * | * | trans | -74.6 | 164.1 | -171.9 | 30.5 | -36.2 | 0 | 0 | 0 | 113.2 | P544 E545 | P542-P544 VanDerWaalsContact C-N 3.29Å; P542-P544 WeakPolarHBondContact O-CD 3.5Å; P542-E545 PolarHBondContact O-N 3.14Å | ||
| 543 | L | 40.7 | Very low | 38.2 | Very low | 122 Ų | 122 | 118.1 Ų | 118.1 | 64% | 0.639 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -43 | -38.1 | -176.5 | -161 | 73.6 | 0 | 0 | 0 | 116.2 | E545 L546 L547 | L543-E545 PolarHBondContact O-N 3.46Å; L543-E545 VanDerWaalsContact O-N 3.16Å; L543-L546 PolarHBondContact O-N 3.01Å; L543-L547 HydrophobicContact CG-CD1 4.42Å; L543-L547 PolarHBondContact O-N 3.45Å; L543-L547 VanDerWaalsContact O-N 3.1Å |
| 544 | P | 43.7 | Very low | 39.2 | Very low | 75 Ų | 75 | 113.5 Ų | 113.5 | 49% | 0.487 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -58.7 | -24.9 | 178.4 | -27.2 | 37.4 | 0 | 0 | 0 | 115.1 | P542 K548 | P542-P544 VanDerWaalsContact C-N 3.29Å; P542-P544 WeakPolarHBondContact O-CD 3.5Å; P544-K548 VanDerWaalsContact O-CB 3.32Å; P544-K548 WeakPolarHBondContact O-CB 3.44Å; P544-K548 WeakPolarHBondContact O-CG 3.39Å; P544-K548 PolarHBondContact O-N 2.95Å |
| 545 | E | 47.7 | Very low | 40 | Very low | 79 Ų | 79 | 108.1 Ų | 108.1 | 37% | 0.369 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -77.3 | -33.5 | 179.2 | -134.2 | 69.2 | -139.8 | 0 | 0 | 112.5 | V541 P542 L543 K548 I549 | V541-E545 HydrophobicContact CG1-CB 3.29Å; V541-E545 HydrophobicContact CG1-CG 3.67Å; P542-E545 PolarHBondContact O-N 3.14Å; L543-E545 PolarHBondContact O-N 3.46Å; L543-E545 VanDerWaalsContact O-N 3.16Å; E545-K548 HydrophobicContact CG-CD 4.5Å; E545-K548 PolarHBondContact O-N 3.34Å; E545-K548 WeakPolarHBondContact OE1-CD 3.39Å; E545-K548 IonicContact OE1-NZ 2.58Å; E545-K548 PolarHBondContact OE1-NZ 3.49Å; E545-K548 IonicContact OE2-NZ 2.75Å; E545-K548 PolarHBondContact OE2-NZ 3.28Å; E545-I549 VanDerWaalsContact O-CG1 3.31Å; E545-I549 WeakPolarHBondContact O-CG1 3.34Å; E545-I549 PolarHBondContact O-N 2.93Å |
| 546 | L | 47.4 | Very low | 40.8 | Very low | 110 Ų | 110 | 106.2 Ų | 106.2 | 58% | 0.576 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -75.7 | -37.9 | 175.6 | -157.3 | 153.3 | 0 | 0 | 0 | 110.5 | L543 I549 L550 | L543-L546 PolarHBondContact O-N 3.01Å; L546-I549 PolarHBondContact O-N 2.87Å; L546-L550 HydrophobicContact CD2-CD1 3.85Å; L546-L550 HydrophobicContact CD2-CG 4.4Å; L546-L550 PolarHBondContact O-N 3.32Å; L546-L550 VanDerWaalsContact O-N 3.1Å |
| 547 | L | 47.7 | Very low | 42.1 | Very low | 61 Ų | 61 | 103.8 Ų | 103.8 | 32% | 0.319 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.7 | -48 | 166.4 | -95.3 | 160.2 | 0 | 0 | 0 | 111.8 | L543 I549 L550 L551 | L543-L547 HydrophobicContact CG-CD1 4.42Å; L543-L547 PolarHBondContact O-N 3.45Å; L543-L547 VanDerWaalsContact O-N 3.1Å; L547-I549 VanDerWaalsContact C-N 3.3Å; L547-I549 PolarHBondContact O-N 2.88Å; L547-L550 PolarHBondContact O-N 2.86Å; L547-L551 HydrophobicContact CD2-CD1 4.06Å; L547-L551 HydrophobicContact CD2-CG 4.35Å; L547-L551 VanDerWaalsContact O-CB 3.27Å; L547-L551 WeakPolarHBondContact O-CB 3.32Å; L547-L551 VanDerWaalsContact O-CG 3.25Å; L547-L551 WeakPolarHBondContact O-CG 3.22Å; L547-L551 PolarHBondContact O-N 3.47Å |
| 548 | K | 48 | Very low | 43 | Very low | 116 Ų | 116 | 96.6 Ų | 96.6 | 50% | 0.504 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -54.9 | -42.2 | 172.9 | -83.2 | 165.9 | 177.5 | 167.8 | 0 | 112.4 | P544 E545 S552 | P544-K548 VanDerWaalsContact O-CB 3.32Å; P544-K548 WeakPolarHBondContact O-CB 3.44Å; P544-K548 WeakPolarHBondContact O-CG 3.39Å; P544-K548 PolarHBondContact O-N 2.95Å; E545-K548 HydrophobicContact CG-CD 4.5Å; E545-K548 PolarHBondContact O-N 3.34Å; E545-K548 WeakPolarHBondContact OE1-CD 3.39Å; E545-K548 IonicContact OE1-NZ 2.58Å; E545-K548 PolarHBondContact OE1-NZ 3.49Å; E545-K548 IonicContact OE2-NZ 2.75Å; E545-K548 PolarHBondContact OE2-NZ 3.28Å; K548-S552 WeakPolarHBondContact O-CA 3.38Å; K548-S552 WeakPolarHBondContact O-CB 3.43Å; K548-S552 PolarHBondContact O-N 3.06Å |
| 549 | I | 52 | Low | 44 | Very low | 62 Ų | 62 | 90.3 Ų | 90.3 | 32% | 0.318 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.9 | -44.8 | -179.7 | -72.6 | 164.8 | 0 | 0 | 0 | 110.7 | E545 L546 L547 S552 I558 | E545-I549 VanDerWaalsContact O-CG1 3.31Å; E545-I549 WeakPolarHBondContact O-CG1 3.34Å; E545-I549 PolarHBondContact O-N 2.93Å; L546-I549 PolarHBondContact O-N 2.87Å; L547-I549 VanDerWaalsContact C-N 3.3Å; L547-I549 PolarHBondContact O-N 2.88Å; I549-S552 PolarHBondContact O-N 3.47Å; I549-S552 PolarHBondContact O-OG 3.5Å; I549-I558 HydrophobicContact CG2-CG1 4.05Å |
| 550 | L | 46.4 | Very low | 45.3 | Very low | 98 Ų | 98 | 87.7 Ų | 87.7 | 51% | 0.513 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -66.9 | -48.5 | 176.9 | -68 | 170.9 | 0 | 0 | 0 | 112 | L546 L547 S552 | L546-L550 HydrophobicContact CD2-CD1 3.85Å; L546-L550 HydrophobicContact CD2-CG 4.4Å; L546-L550 PolarHBondContact O-N 3.32Å; L546-L550 VanDerWaalsContact O-N 3.1Å; L547-L550 PolarHBondContact O-N 2.86Å; L550-S552 PolarHBondContact O-N 3.05Å |
| 551 | L | 46.6 | Very low | 46.6 | Very low | 35 Ų | 35 | 85 Ų | 85 | 18% | 0.183 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -70.3 | -10.3 | 177.8 | -63.4 | 174.9 | 0 | 0 | 0 | 113.6 | L547 G553 L732 V750 | L547-L551 HydrophobicContact CD2-CD1 4.06Å; L547-L551 HydrophobicContact CD2-CG 4.35Å; L547-L551 VanDerWaalsContact O-CB 3.27Å; L547-L551 WeakPolarHBondContact O-CB 3.32Å; L547-L551 VanDerWaalsContact O-CG 3.25Å; L547-L551 WeakPolarHBondContact O-CG 3.22Å; L547-L551 PolarHBondContact O-N 3.47Å; L551-G553 PolarHBondContact O-N 3Å; L551-L732 HydrophobicContact CD2-CD1 4.03Å; L551-V750 HydrophobicContact CD1-CG1 4.26Å |
| 552 | S | 51.1 | Low | 47.5 | Very low | 43 Ų | 43 | 82.6 Ų | 82.6 | 30% | 0.301 | 43% | 0.432 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | -13.4 | 179.9 | 71.8 | 0 | 0 | 0 | 0 | 114.1 | K548 I549 L550 K554 | K548-S552 WeakPolarHBondContact O-CA 3.38Å; K548-S552 WeakPolarHBondContact O-CB 3.43Å; K548-S552 PolarHBondContact O-N 3.06Å; I549-S552 PolarHBondContact O-N 3.47Å; I549-S552 PolarHBondContact O-OG 3.5Å; L550-S552 PolarHBondContact O-N 3.05Å; S552-K554 PolarHBondContact O-N 2.94Å; S552-K554 PolarHBondContact OG-N 3.02Å |
| 553 | G | 44.2 | Very low | 48.5 | Very low | 15 Ų | 15 | 79.7 Ų | 79.7 | 16% | 0.155 | 41% | 0.41 | C | S | . | . | trans | 61 | 5.9 | -176.1 | 0 | 0 | 0 | 0 | 0 | 115 | L551 P555 | L551-G553 PolarHBondContact O-N 3Å; G553-P555 WeakPolarHBondContact O-CD 3.27Å | ||
| 554 | K | 45.7 | Very low | 49.1 | Very low | 126 Ų | 126 | 75.6 Ų | 75.6 | 55% | 0.548 | 40% | 0.398 | S | S | . | . | trans | -90.8 | 100 | -172 | -78 | 167 | -175.4 | 171.5 | 0 | 110.9 | S552 D556 L557 I558 | S552-K554 PolarHBondContact O-N 2.94Å; S552-K554 PolarHBondContact OG-N 3.02Å; K554-D556 PolarHBondContact O-N 3.35Å; K554-L557 HydrophobicContact CB-CB 4.34Å; K554-L557 HydrophobicContact CB-CD1 4.14Å; K554-L557 HydrophobicContact CB-CG 4.32Å; K554-L557 HydrophobicContact CD-CD1 3.99Å; K554-L557 PolarHBondContact O-N 3.18Å; K554-L557 VanDerWaalsContact O-N 3.08Å; K554-I558 PolarHBondContact O-N 3.2Å | ||
| 555 | P | 42.6 | Very low | 49.5 | Very low | 69 Ų | 69 | 76.6 Ų | 76.6 | 45% | 0.448 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -60.3 | -31.6 | -178.2 | 26.3 | -35.7 | 0 | 0 | 0 | 111.6 | G553 L557 I558 S559 | G553-P555 WeakPolarHBondContact O-CD 3.27Å; P555-L557 PolarHBondContact O-N 3.4Å; P555-I558 PolarHBondContact O-N 3.41Å; P555-S559 WeakPolarHBondContact O-CA 3.33Å; P555-S559 WeakPolarHBondContact O-CB 3.29Å; P555-S559 PolarHBondContact O-N 3.43Å |
| 556 | D | 44 | Very low | 49.7 | Very low | 133 Ų | 133 | 76 Ų | 76 | 71% | 0.711 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -61.4 | -38.5 | 176.9 | -67.8 | -25.1 | 0 | 0 | 0 | 113.3 | K554 K560 | K554-D556 PolarHBondContact O-N 3.35Å; D556-K560 WeakPolarHBondContact O-CB 3.18Å; D556-K560 PolarHBondContact O-N 3.42Å |
| 557 | L | 51.6 | Low | 50.1 | Low | 90 Ų | 90 | 74.6 Ų | 74.6 | 47% | 0.471 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -74.9 | -43.7 | 179.8 | -73.1 | 174.2 | 0 | 0 | 0 | 111.2 | K554 P555 R561 | K554-L557 HydrophobicContact CB-CB 4.34Å; K554-L557 HydrophobicContact CB-CD1 4.14Å; K554-L557 HydrophobicContact CB-CG 4.32Å; K554-L557 HydrophobicContact CD-CD1 3.99Å; K554-L557 PolarHBondContact O-N 3.18Å; K554-L557 VanDerWaalsContact O-N 3.08Å; P555-L557 PolarHBondContact O-N 3.4Å; L557-R561 WeakPolarHBondContact O-CB 3.26Å; L557-R561 PolarHBondContact O-N 3.2Å |
| 558 | I | 49 | Very low | 50.4 | Low | 45 Ų | 45 | 76.1 Ų | 76.1 | 23% | 0.231 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -64.4 | -48.5 | 177.5 | -61.3 | 168.9 | 0 | 0 | 0 | 109.9 | I549 K554 P555 R561 V562 | I549-I558 HydrophobicContact CG2-CG1 4.05Å; K554-I558 PolarHBondContact O-N 3.2Å; P555-I558 PolarHBondContact O-N 3.41Å; I558-R561 PolarHBondContact O-N 3.37Å; I558-V562 WeakPolarHBondContact O-CB 3.46Å; I558-V562 WeakPolarHBondContact O-CG2 2.92Å; I558-V562 PolarHBondContact O-N 3.23Å |
| 559 | S | 49.8 | Very low | 50.7 | Low | 47 Ų | 47 | 79 Ų | 79 | 33% | 0.329 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -64.8 | -42.5 | 178.2 | -175.3 | 0 | 0 | 0 | 0 | 112.3 | P555 R561 F563 G564 | P555-S559 WeakPolarHBondContact O-CA 3.33Å; P555-S559 WeakPolarHBondContact O-CB 3.29Å; P555-S559 PolarHBondContact O-N 3.43Å; S559-R561 PolarHBondContact O-N 3.43Å; S559-F563 CarbonylContact O-C 3.43Å; S559-F563 WeakPolarHBondContact O-CA 3.34Å; S559-F563 WeakPolarHBondContact O-CB 3.24Å; S559-F563 PolarHBondContact O-N 3.07Å; S559-G564 PolarHBondContact O-N 3.43Å; S559-G564 VanDerWaalsContact O-N 3.07Å |
| 560 | K | 55.6 | Low | 51 | Low | 125 Ų | 125 | 80.9 Ų | 80.9 | 54% | 0.543 | 42% | 0.417 | S | S | . | . | I | π-helix | trans | -64.8 | -38.8 | 176.8 | -175.4 | 176.2 | 176.7 | -176.9 | 0 | 112.1 | D556 G564 E565 | D556-K560 WeakPolarHBondContact O-CB 3.18Å; D556-K560 PolarHBondContact O-N 3.42Å; K560-G564 CarbonylContact O-C 3.25Å; K560-G564 WeakPolarHBondContact O-CA 3.33Å; K560-G564 PolarHBondContact O-N 3.22Å; K560-E565 PolarHBondContact O-N 3.45Å |
| 561 | R | 55 | Low | 51.7 | Low | 141 Ų | 141 | 81 Ų | 81 | 53% | 0.532 | 42% | 0.418 | S | S | . | . | I | π-helix | trans | -71.4 | -44.6 | 177.7 | -153.1 | 64.8 | 163.1 | 172.4 | -2.5 | 112.3 | L557 I558 S559 E565 | L557-R561 WeakPolarHBondContact O-CB 3.26Å; L557-R561 PolarHBondContact O-N 3.2Å; I558-R561 PolarHBondContact O-N 3.37Å; S559-R561 PolarHBondContact O-N 3.43Å; R561-E565 VanDerWaalsContact CD-OE2 3.23Å; R561-E565 WeakPolarHBondContact CD-OE2 3.39Å; R561-E565 IonicContact CZ-OE2 2.68Å; R561-E565 IonicContact NE-OE2 2.68Å; R561-E565 IonicContact NH1-OE2 2.62Å; R561-E565 PolarHBondContact NH1-OE2 3.37Å |
| 562 | V | 51.8 | Low | 52.3 | Low | 51 Ų | 51 | 79.7 Ų | 79.7 | 31% | 0.309 | 41% | 0.411 | S | S | . | . | I | π-helix | trans | -85.3 | -36.9 | -174.4 | 179.6 | 0 | 0 | 0 | 0 | 113.3 | I558 | I558-V562 WeakPolarHBondContact O-CB 3.46Å; I558-V562 WeakPolarHBondContact O-CG2 2.92Å; I558-V562 PolarHBondContact O-N 3.23Å |
| 563 | F | 56.9 | Low | 52.4 | Low | 30 Ų | 30 | 78.7 Ų | 78.7 | 13% | 0.132 | 41% | 0.406 | C | S | . | . | I | π-helix | trans | -114.8 | -22.4 | -175.4 | -52.8 | -55.4 | 0 | 0 | 0 | 114.1 | S559 L572 A573 L713 | S559-F563 CarbonylContact O-C 3.43Å; S559-F563 WeakPolarHBondContact O-CA 3.34Å; S559-F563 WeakPolarHBondContact O-CB 3.24Å; S559-F563 PolarHBondContact O-N 3.07Å; F563-L572 HydrophobicContact CD1-CB 3.78Å; F563-L572 HydrophobicContact CD1-CD1 4.3Å; F563-L572 HydrophobicContact CE1-CB 4.18Å; F563-A573 HydrophobicContact CD2-CB 4.14Å; F563-A573 HydrophobicContact CE2-CB 4.37Å; F563-L713 HydrophobicContact CE2-CD2 4.41Å; F563-L713 HydrophobicContact CZ-CD2 4.06Å |
| 564 | G | 53.5 | Low | 53.2 | Low | 37 Ų | 37 | 82 Ų | 82 | 38% | 0.381 | 42% | 0.417 | S | S | . | . | I | π-helix | trans | -87.5 | -37.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | S559 K560 | S559-G564 PolarHBondContact O-N 3.43Å; S559-G564 VanDerWaalsContact O-N 3.07Å; K560-G564 CarbonylContact O-C 3.25Å; K560-G564 WeakPolarHBondContact O-CA 3.33Å; K560-G564 PolarHBondContact O-N 3.22Å |
| 565 | E | 53 | Low | 54.1 | Low | 95 Ų | 95 | 78.8 Ų | 78.8 | 44% | 0.444 | 40% | 0.404 | S | S | . | . | S | Bend | trans | -100.2 | -23.6 | -170.2 | -72.9 | 171.3 | -165.5 | 0 | 0 | 114 | K560 R561 | K560-E565 PolarHBondContact O-N 3.45Å; R561-E565 VanDerWaalsContact CD-OE2 3.23Å; R561-E565 WeakPolarHBondContact CD-OE2 3.39Å; R561-E565 IonicContact CZ-OE2 2.68Å; R561-E565 IonicContact NE-OE2 2.68Å; R561-E565 IonicContact NH1-OE2 2.62Å; R561-E565 PolarHBondContact NH1-OE2 3.37Å |
| 566 | I | 51.5 | Low | 55 | Low | 68 Ų | 68 | 76.1 Ų | 76.1 | 35% | 0.349 | 39% | 0.386 | S | S | . | . | S | Bend | trans | -86.7 | -43.9 | -172.7 | -59 | 177.9 | 0 | 0 | 0 | 113.1 | E688 | I566-E688 HydrophobicContact CD1-CB 4.36Å; I566-E688 HydrophobicContact CD1-CG 4.08Å; I566-E688 HydrophobicContact CG2-CG 4.18Å |
| 567 | Q | 55.8 | Low | 55.6 | Low | 80 Ų | 80 | 73.2 Ų | 73.2 | 37% | 0.374 | 37% | 0.365 | S | S | . | . | trans | -139 | 81.3 | 170.4 | -72.6 | -162 | 18.9 | 0 | 0 | 111.3 | H569 R570 | Q567-H569 PolarHBondContact O-N 3.06Å; Q567-R570 PolarHBondContact O-N 2.99Å | ||
| 568 | P | 54.7 | Low | 56.1 | Low | 92 Ų | 92 | 71.8 Ų | 71.8 | 60% | 0.597 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | 5.9 | -175.2 | 27.3 | -36.6 | 0 | 0 | 0 | 115.4 | ||
| 569 | H | 54.1 | Low | 56.6 | Low | 178 Ų | 178 | 69.7 Ų | 69.7 | 82% | 0.824 | 35% | 0.35 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.2 | -9.1 | 176.2 | -47.7 | -36 | 0 | 0 | 0 | 113 | Q567 | Q567-H569 PolarHBondContact O-N 3.06Š|
| 570 | R | 58.3 | Low | 57 | Low | 101 Ų | 101 | 68 Ų | 68 | 38% | 0.381 | 34% | 0.337 | S | S | . | . | trans | -124.7 | 115.1 | 176.7 | -76.2 | -170.3 | 174.4 | -121.1 | 9.9 | 110.2 | Q567 L572 E575 | Q567-R570 PolarHBondContact O-N 2.99Å; R570-L572 HydrophobicContact CB-CD2 4.09Å; R570-L572 HydrophobicContact CB-CG 4.07Å; R570-L572 PolarHBondContact O-N 3.45Å; R570-E575 WeakPolarHBondContact CB-OE1 3.44Å; R570-E575 WeakPolarHBondContact CD-OE1 3.49Å; R570-E575 VanDerWaalsContact CG-OE1 3.31Å; R570-E575 WeakPolarHBondContact CG-OE1 3.48Å; R570-E575 IonicContact CZ-OE2 3.04Å; R570-E575 IonicContact NH1-OE1 2.68Å; R570-E575 PolarHBondContact NH1-OE1 3.25Å; R570-E575 IonicContact NH1-OE2 3.34Å; R570-E575 PolarHBondContact NH1-OE2 3.03Å | ||
| 571 | N | 61.1 | Low | 57 | Low | 99 Ų | 99 | 67 Ų | 67 | 53% | 0.529 | 33% | 0.334 | S | S | . | . | trans | -77.5 | 79.7 | 166 | -173.8 | -17.2 | 0 | 0 | 0 | 108.4 | A573 Q574 E575 | N571-A573 PolarHBondContact O-N 2.66Å; N571-A573 PolarHBondContact OD1-N 2.7Å; N571-Q574 HydrophobicContact CB-CB 3.94Å; N571-Q574 VanDerWaalsContact CG-CB 3.42Å; N571-Q574 CarbonylContact O-C 3.24Å; N571-Q574 WeakPolarHBondContact O-CA 3.48Å; N571-Q574 WeakPolarHBondContact O-CB 3.33Å; N571-Q574 PolarHBondContact O-N 3.22Å; N571-Q574 PolarHBondContact OD1-N 2.84Å; N571-E575 PolarHBondContact O-N 3.2Å | ||
| 572 | L | 59.2 | Low | 57.2 | Low | 8 Ų | 8 | 62.6 Ų | 62.6 | 4% | 0.042 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -59.8 | -30.3 | -176.9 | -69 | 171.4 | 0 | 0 | 0 | 112.6 | F563 R570 E575 L576 I684 | F563-L572 HydrophobicContact CD1-CB 3.78Å; F563-L572 HydrophobicContact CD1-CD1 4.3Å; F563-L572 HydrophobicContact CE1-CB 4.18Å; R570-L572 HydrophobicContact CB-CD2 4.09Å; R570-L572 HydrophobicContact CB-CG 4.07Å; R570-L572 PolarHBondContact O-N 3.45Å; L572-E575 PolarHBondContact O-N 2.92Å; L572-L576 VanDerWaalsContact O-CB 3.3Å; L572-L576 WeakPolarHBondContact O-CB 3.31Å; L572-L576 PolarHBondContact O-N 3.21Å; L572-I684 HydrophobicContact CD1-CD1 3.98Å; L572-I684 HydrophobicContact CD1-CG2 3.98Å; L572-I684 HydrophobicContact CD2-CD1 3.75Å |
| 573 | A | 53.3 | Low | 57.3 | Low | 23 Ų | 23 | 61.2 Ų | 61.2 | 19% | 0.19 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -65 | -40.7 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | F563 N571 R577 | F563-A573 HydrophobicContact CD2-CB 4.14Å; F563-A573 HydrophobicContact CE2-CB 4.37Å; N571-A573 PolarHBondContact O-N 2.66Å; N571-A573 PolarHBondContact OD1-N 2.7Å; A573-R577 WeakPolarHBondContact O-CB 3.34Å; A573-R577 VanDerWaalsContact O-CG 3.31Å; A573-R577 WeakPolarHBondContact O-CG 3.36Å; A573-R577 PolarHBondContact O-N 3.23Å |
| 574 | Q | 60.3 | Low | 56.9 | Low | 83 Ų | 83 | 63.1 Ų | 63.1 | 39% | 0.388 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -72.8 | -34.8 | 173.1 | -171.6 | 59.9 | 39.9 | 0 | 0 | 112.6 | N571 L576 R577 T578 | N571-Q574 HydrophobicContact CB-CB 3.94Å; N571-Q574 VanDerWaalsContact CG-CB 3.42Å; N571-Q574 CarbonylContact O-C 3.24Å; N571-Q574 WeakPolarHBondContact O-CA 3.48Å; N571-Q574 WeakPolarHBondContact O-CB 3.33Å; N571-Q574 PolarHBondContact O-N 3.22Å; N571-Q574 PolarHBondContact OD1-N 2.84Å; Q574-L576 VanDerWaalsContact C-N 3.34Å; Q574-R577 PolarHBondContact O-N 3.14Å; Q574-T578 PolarHBondContact NE2-OG1 3.41Å; Q574-T578 VanDerWaalsContact O-CB 3.27Å; Q574-T578 WeakPolarHBondContact O-CB 3.41Å; Q574-T578 PolarHBondContact O-N 2.67Å; Q574-T578 PolarHBondContact O-OG1 3.06Å |
| 575 | E | 66 | Low | 56.9 | Low | 60 Ų | 60 | 71.9 Ų | 71.9 | 28% | 0.28 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 172.7 | -70.1 | 179.6 | -151.1 | 0 | 0 | 110.6 | R570 N571 L572 T578 A579 | R570-E575 WeakPolarHBondContact CB-OE1 3.44Å; R570-E575 WeakPolarHBondContact CD-OE1 3.49Å; R570-E575 VanDerWaalsContact CG-OE1 3.31Å; R570-E575 WeakPolarHBondContact CG-OE1 3.48Å; R570-E575 IonicContact CZ-OE2 3.04Å; R570-E575 IonicContact NH1-OE1 2.68Å; R570-E575 PolarHBondContact NH1-OE1 3.25Å; R570-E575 IonicContact NH1-OE2 3.34Å; R570-E575 PolarHBondContact NH1-OE2 3.03Å; N571-E575 PolarHBondContact O-N 3.2Å; L572-E575 PolarHBondContact O-N 2.92Å; E575-T578 PolarHBondContact O-N 2.91Å; E575-A579 PolarHBondContact O-N 3.14Å |
| 576 | L | 59.8 | Low | 56.8 | Low | 12 Ų | 12 | 69.6 Ų | 69.6 | 6% | 0.063 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -66.3 | -45.9 | 174.8 | -172.1 | 63.5 | 0 | 0 | 0 | 112.1 | L572 Q574 T578 A579 I580 V681 A717 | L572-L576 VanDerWaalsContact O-CB 3.3Å; L572-L576 WeakPolarHBondContact O-CB 3.31Å; L572-L576 PolarHBondContact O-N 3.21Å; Q574-L576 VanDerWaalsContact C-N 3.34Å; L576-T578 VanDerWaalsContact C-N 3.34Å; L576-T578 PolarHBondContact O-N 3.1Å; L576-A579 PolarHBondContact O-N 3.01Å; L576-I580 HydrophobicContact CD1-CD1 4.17Å; L576-I580 HydrophobicContact CG-CD1 3.86Å; L576-I580 WeakPolarHBondContact O-CB 3.42Å; L576-I580 VanDerWaalsContact O-CG1 3.27Å; L576-I580 WeakPolarHBondContact O-CG1 3.48Å; L576-I580 PolarHBondContact O-N 3.29Å; L576-V681 HydrophobicContact CB-CG1 4.39Å; L576-V681 HydrophobicContact CD1-CG1 4.33Å; L576-V681 HydrophobicContact CD2-CG1 4.41Å; L576-A717 HydrophobicContact CD2-CB 4.02Å; L576-A717 HydrophobicContact CG-CB 4.32Å |
| 577 | R | 57.8 | Low | 56.6 | Low | 72 Ų | 72 | 69 Ų | 69 | 27% | 0.272 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -56.9 | -45.1 | 172.5 | -79.2 | 179.8 | -176.2 | -145.6 | -2 | 111.8 | A573 Q574 A579 I580 E581 A717 D720 | A573-R577 WeakPolarHBondContact O-CB 3.34Å; A573-R577 VanDerWaalsContact O-CG 3.31Å; A573-R577 WeakPolarHBondContact O-CG 3.36Å; A573-R577 PolarHBondContact O-N 3.23Å; Q574-R577 PolarHBondContact O-N 3.14Å; R577-A579 PolarHBondContact O-N 2.77Å; R577-I580 CarbonylContact O-C 3.55Å; R577-I580 PolarHBondContact O-N 3.03Å; R577-E581 WeakPolarHBondContact O-CB 3.21Å; R577-E581 WeakPolarHBondContact O-CG 3.47Å; R577-E581 PolarHBondContact O-N 3.43Å; R577-A717 HydrophobicContact CG-CB 4.4Å; R577-D720 IonicContact CZ-OD1 3.38Å; R577-D720 IonicContact CZ-OD2 3.45Å; R577-D720 IonicContact NH1-OD1 2.7Å; R577-D720 PolarHBondContact NH1-OD1 2.69Å; R577-D720 IonicContact NH1-OD2 2.66Å; R577-D720 PolarHBondContact NH1-OD2 3.37Å; R577-D720 VanDerWaalsContact NH2-CG 3.31Å; R577-D720 IonicContact NH2-OD1 3.69Å; R577-D720 PolarHBondContact NH2-OD1 3.21Å; R577-D720 IonicContact NH2-OD2 2.69Å |
| 578 | T | 61.7 | Low | 55.9 | Low | 60 Ų | 60 | 69 Ų | 69 | 37% | 0.368 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -66.8 | -38.3 | -178.7 | -52.5 | 0 | 0 | 0 | 0 | 111.4 | Q574 E575 L576 T582 | Q574-T578 PolarHBondContact NE2-OG1 3.41Å; Q574-T578 VanDerWaalsContact O-CB 3.27Å; Q574-T578 WeakPolarHBondContact O-CB 3.41Å; Q574-T578 PolarHBondContact O-N 2.67Å; Q574-T578 PolarHBondContact O-OG1 3.06Å; E575-T578 PolarHBondContact O-N 2.91Å; L576-T578 VanDerWaalsContact C-N 3.34Å; L576-T578 PolarHBondContact O-N 3.1Å; T578-T582 WeakPolarHBondContact O-CB 3.31Å; T578-T582 PolarHBondContact O-N 3.49Å; T578-T582 PolarHBondContact O-OG1 3.01Å |
| 579 | A | 60.5 | Low | 55 | Low | 2 Ų | 2 | 74.3 Ų | 74.3 | 2% | 0.017 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -63 | -44.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | E575 L576 R577 T582 I583 L674 Q677 | E575-A579 PolarHBondContact O-N 3.14Å; L576-A579 PolarHBondContact O-N 3.01Å; R577-A579 PolarHBondContact O-N 2.77Å; A579-T582 WeakPolarHBondContact O-CA 3.3Å; A579-T582 VanDerWaalsContact O-CB 3.31Å; A579-T582 WeakPolarHBondContact O-CB 3.45Å; A579-T582 PolarHBondContact O-N 3.49Å; A579-T582 VanDerWaalsContact O-N 3.17Å; A579-I583 PolarHBondContact O-N 2.95Å; A579-I583 VanDerWaalsContact O-N 3.08Å; A579-L674 HydrophobicContact CB-CD2 4.09Å; A579-Q677 HydrophobicContact CB-CB 4.3Å |
| 580 | I | 56.7 | Low | 54.1 | Low | 10 Ų | 10 | 70.2 Ų | 70.2 | 5% | 0.051 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -65.7 | -46.2 | 178.4 | -72.7 | 168 | 0 | 0 | 0 | 111.9 | L576 R577 T582 I583 Y584 V714 A717 V718 | L576-I580 HydrophobicContact CD1-CD1 4.17Å; L576-I580 HydrophobicContact CG-CD1 3.86Å; L576-I580 WeakPolarHBondContact O-CB 3.42Å; L576-I580 VanDerWaalsContact O-CG1 3.27Å; L576-I580 WeakPolarHBondContact O-CG1 3.48Å; L576-I580 PolarHBondContact O-N 3.29Å; R577-I580 CarbonylContact O-C 3.55Å; R577-I580 PolarHBondContact O-N 3.03Å; I580-T582 PolarHBondContact O-N 3.36Å; I580-I583 WeakPolarHBondContact O-CA 3.49Å; I580-I583 VanDerWaalsContact O-CB 3.3Å; I580-I583 WeakPolarHBondContact O-CB 3.27Å; I580-I583 PolarHBondContact O-N 3.13Å; I580-Y584 HydrophobicContact CG2-CD2 3.87Å; I580-Y584 HydrophobicContact CG2-CE2 3.95Å; I580-Y584 WeakPolarHBondContact O-CD2 3.15Å; I580-Y584 PolarHBondContact O-N 3.03Å; I580-V714 HydrophobicContact CD1-CG1 4.07Å; I580-A717 HydrophobicContact CD1-CB 3.97Å; I580-V718 HydrophobicContact CD1-CG2 4.18Å; I580-V718 HydrophobicContact CG2-CB 4.45Å; I580-V718 HydrophobicContact CG2-CG2 3.61Å |
| 581 | E | 55.8 | Low | 53.3 | Low | 106 Ų | 106 | 71.9 Ų | 71.9 | 50% | 0.495 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -56.2 | -33.9 | 171.5 | -78.4 | -168.6 | 103.9 | 0 | 0 | 111.6 | R577 Y584 R585 | R577-E581 WeakPolarHBondContact O-CB 3.21Å; R577-E581 WeakPolarHBondContact O-CG 3.47Å; R577-E581 PolarHBondContact O-N 3.43Å; E581-Y584 PolarHBondContact O-N 3.42Å; E581-R585 WeakPolarHBondContact O-CB 3.3Å; E581-R585 WeakPolarHBondContact O-CG 3.42Å; E581-R585 PolarHBondContact O-N 3.11Å |
| 582 | T | 59.4 | Low | 52.5 | Low | 48 Ų | 48 | 67.5 Ų | 67.5 | 29% | 0.294 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -68.1 | -37.7 | 174.3 | -54.9 | 0 | 0 | 0 | 0 | 111.3 | T578 A579 I580 R585 V586 L674 | T578-T582 WeakPolarHBondContact O-CB 3.31Å; T578-T582 PolarHBondContact O-N 3.49Å; T578-T582 PolarHBondContact O-OG1 3.01Å; A579-T582 WeakPolarHBondContact O-CA 3.3Å; A579-T582 VanDerWaalsContact O-CB 3.31Å; A579-T582 WeakPolarHBondContact O-CB 3.45Å; A579-T582 PolarHBondContact O-N 3.49Å; A579-T582 VanDerWaalsContact O-N 3.17Å; I580-T582 PolarHBondContact O-N 3.36Å; T582-R585 PolarHBondContact O-N 2.72Å; T582-V586 WeakPolarHBondContact O-CB 3.32Å; T582-V586 WeakPolarHBondContact O-CG2 3.38Å; T582-V586 PolarHBondContact O-N 2.93Å; T582-L674 HydrophobicContact CG2-CD1 3.97Å |
| 583 | I | 54.3 | Low | 51.4 | Low | 21 Ų | 21 | 71.2 Ų | 71.2 | 11% | 0.108 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -59.8 | -50.2 | 168.9 | -53.8 | 173.5 | 0 | 0 | 0 | 110.2 | A579 I580 R585 V586 L587 I596 L674 I678 | A579-I583 PolarHBondContact O-N 2.95Å; A579-I583 VanDerWaalsContact O-N 3.08Å; I580-I583 WeakPolarHBondContact O-CA 3.49Å; I580-I583 VanDerWaalsContact O-CB 3.3Å; I580-I583 WeakPolarHBondContact O-CB 3.27Å; I580-I583 PolarHBondContact O-N 3.13Å; I583-R585 VanDerWaalsContact C-N 3.28Å; I583-R585 PolarHBondContact O-N 3.46Å; I583-V586 PolarHBondContact O-N 3.16Å; I583-L587 HydrophobicContact CG2-CD1 3.75Å; I583-L587 HydrophobicContact CG2-CG 4.36Å; I583-L587 PolarHBondContact O-N 3.44Å; I583-I596 HydrophobicContact CG2-CD1 4.32Å; I583-I596 HydrophobicContact CG2-CG1 4.32Å; I583-L674 HydrophobicContact CB-CD1 4.48Å; I583-L674 HydrophobicContact CD1-CD2 3.79Å; I583-L674 HydrophobicContact CG1-CD1 3.52Å; I583-L674 HydrophobicContact CG1-CD2 3.58Å; I583-L674 HydrophobicContact CG1-CG 4.2Å; I583-I678 HydrophobicContact CD1-CD1 4.47Å |
| 584 | Y | 47.9 | Very low | 51 | Low | 71 Ų | 71 | 72.1 Ų | 72.1 | 28% | 0.278 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -67.1 | -23 | -177.3 | -85.9 | -85.9 | 0 | 0 | 0 | 114.3 | I580 E581 A592 F593 I596 V718 | I580-Y584 HydrophobicContact CG2-CD2 3.87Å; I580-Y584 HydrophobicContact CG2-CE2 3.95Å; I580-Y584 WeakPolarHBondContact O-CD2 3.15Å; I580-Y584 PolarHBondContact O-N 3.03Å; E581-Y584 PolarHBondContact O-N 3.42Å; Y584-A592 HydrophobicContact CD1-CB 4.08Å; Y584-A592 HydrophobicContact CE1-CB 3.49Å; Y584-A592 VanDerWaalsContact CE1-CB 3.49Å; Y584-F593 HydrophobicContact CE1-CE2 4.44Å; Y584-F593 VanDerWaalsContact OH-CE1 3.25Å; Y584-F593 WeakPolarHBondContact OH-CE1 3.27Å; Y584-F593 WeakPolarHBondContact OH-CE2 3Å; Y584-F593 WeakPolarHBondContact OH-CZ 3.39Å; Y584-I596 HydrophobicContact CE2-CD1 3.76Å; Y584-V718 HydrophobicContact CE2-CG1 3.89Å; Y584-V718 HydrophobicContact CE2-CG2 4.35Å |
| 585 | R | 53.6 | Low | 50.3 | Low | 220 Ų | 220 | 70.5 Ų | 70.5 | 83% | 0.83 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -79.5 | -22.9 | 170.3 | -79.2 | -177.1 | 174.4 | -148.9 | -0.1 | 113.6 | E581 T582 I583 | E581-R585 WeakPolarHBondContact O-CB 3.3Å; E581-R585 WeakPolarHBondContact O-CG 3.42Å; E581-R585 PolarHBondContact O-N 3.11Å; T582-R585 PolarHBondContact O-N 2.72Å; I583-R585 VanDerWaalsContact C-N 3.28Å; I583-R585 PolarHBondContact O-N 3.46Å |
| 586 | V | 52.1 | Low | 49.3 | Very low | 47 Ų | 47 | 68.5 Ų | 68.5 | 29% | 0.285 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -97.6 | -25.9 | -173.9 | 172.8 | 0 | 0 | 0 | 0 | 112.4 | T582 I583 Q667 | T582-V586 WeakPolarHBondContact O-CB 3.32Å; T582-V586 WeakPolarHBondContact O-CG2 3.38Å; T582-V586 PolarHBondContact O-N 2.93Å; I583-V586 PolarHBondContact O-N 3.16Å; V586-Q667 HydrophobicContact CG1-CB 4.17Å; V586-Q667 HydrophobicContact CG1-CG 3.83Å; V586-Q667 PolarHBondContact O-NE2 2.95Å |
| 587 | L | 47.1 | Very low | 48.4 | Very low | 57 Ų | 57 | 70 Ų | 70 | 30% | 0.298 | 36% | 0.363 | S | S | . | . | S | Bend | trans | -102.7 | 141.5 | 179.7 | -65.2 | 179.2 | 0 | 0 | 0 | 113.6 | I583 | I583-L587 HydrophobicContact CG2-CD1 3.75Å; I583-L587 HydrophobicContact CG2-CG 4.36Å; I583-L587 PolarHBondContact O-N 3.44Å |
| 588 | P | 39.9 | Very low | 47.8 | Very low | 78 Ų | 78 | 73 Ų | 73 | 51% | 0.506 | 39% | 0.385 | S | S | . | . | trans | -60.5 | 140.4 | 172.6 | -23.9 | 34.7 | 0 | 0 | 0 | 113.1 | S590 H591 | P588-S590 PolarHBondContact O-N 3.38Å; P588-H591 PolarHBondContact O-N 3.15Å | ||
| 589 | K | 37 | Very low | 47 | Very low | 204 Ų | 204 | 73.7 Ų | 73.7 | 89% | 0.887 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | -20.6 | -167.7 | -67.3 | -174.4 | 175.7 | -176.1 | 0 | 115.9 | ||
| 590 | S | 34.9 | Very low | 46.5 | Very low | 93 Ų | 93 | 75.4 Ų | 75.4 | 65% | 0.65 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | -18.4 | -174.5 | 54 | 0 | 0 | 0 | 0 | 115.6 | P588 | P588-S590 PolarHBondContact O-N 3.38Š|
| 591 | H | 40.3 | Very low | 45.9 | Very low | 136 Ų | 136 | 76.4 Ų | 76.4 | 63% | 0.63 | 41% | 0.407 | S | S | * | . | S | Bend | trans | -128.3 | 11.1 | -173.5 | -62.9 | -62.7 | 0 | 0 | 0 | 114.9 | P588 F593 S595 | P588-H591 PolarHBondContact O-N 3.15Å; H591-F593 PolarHBondContact O-N 3.23Å; H591-S595 VanDerWaalsContact O-CB 3.3Å; H591-S595 WeakPolarHBondContact O-CB 3.25Å; H591-S595 PolarHBondContact O-N 2.94Å; H591-S595 PolarHBondContact O-OG 2.97Å |
| 592 | A | 44.1 | Very low | 44.8 | Very low | 6 Ų | 6 | 74.6 Ų | 74.6 | 5% | 0.05 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -58 | -49.1 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | Y584 S595 I596 | Y584-A592 HydrophobicContact CD1-CB 4.08Å; Y584-A592 HydrophobicContact CE1-CB 3.49Å; Y584-A592 VanDerWaalsContact CE1-CB 3.49Å; A592-S595 PolarHBondContact O-N 3.47Å; A592-I596 WeakPolarHBondContact O-CG1 3.34Å; A592-I596 PolarHBondContact O-N 3.17Å |
| 593 | F | 37.9 | Very low | 43.4 | Very low | 87 Ų | 87 | 78.4 Ų | 78.4 | 38% | 0.382 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -69.3 | -45.2 | -176.5 | -80.7 | -74.2 | 0 | 0 | 0 | 113.6 | Y584 H591 S595 I596 A597 V718 Y719 | Y584-F593 HydrophobicContact CE1-CE2 4.44Å; Y584-F593 VanDerWaalsContact OH-CE1 3.25Å; Y584-F593 WeakPolarHBondContact OH-CE1 3.27Å; Y584-F593 WeakPolarHBondContact OH-CE2 3Å; Y584-F593 WeakPolarHBondContact OH-CZ 3.39Å; H591-F593 PolarHBondContact O-N 3.23Å; F593-S595 PolarHBondContact O-N 3.11Å; F593-I596 PolarHBondContact O-N 3.33Å; F593-A597 VanDerWaalsContact O-CB 3.26Å; F593-A597 WeakPolarHBondContact O-CB 3.35Å; F593-A597 PolarHBondContact O-N 3.16Å; F593-V718 HydrophobicContact CE1-CG1 3.96Å; F593-V718 HydrophobicContact CZ-CG1 3.63Å; F593-Y719 HydrophobicContact CD1-CE2 4.49Å; F593-Y719 HydrophobicContact CE1-CD2 4.39Å; F593-Y719 HydrophobicContact CE1-CE1 4.31Å; F593-Y719 AromaticContact CE1-CE2 3.48Å; F593-Y719 HydrophobicContact CE1-CE2 3.48Å; F593-Y719 VanDerWaalsContact CE1-CE2 3.48Å; F593-Y719 AromaticContact CE1-CZ 3.46Å; F593-Y719 VanDerWaalsContact CE1-CZ 3.46Å; F593-Y719 WeakPolarHBondContact CE1-OH 3.34Å; F593-Y719 AromaticContact CE2-CE1 3.98Å; F593-Y719 HydrophobicContact CE2-CE1 3.98Å; F593-Y719 AromaticContact CE2-CZ 3.75Å; F593-Y719 WeakPolarHBondContact CE2-OH 3.28Å; F593-Y719 HydrophobicContact CZ-CD1 4.3Å; F593-Y719 HydrophobicContact CZ-CD2 4.32Å; F593-Y719 AromaticContact CZ-CE1 3.51Å; F593-Y719 HydrophobicContact CZ-CE1 3.51Å; F593-Y719 AromaticContact CZ-CE2 3.53Å; F593-Y719 HydrophobicContact CZ-CE2 3.53Å; F593-Y719 AromaticContact CZ-CZ 3.08Å; F593-Y719 WeakPolarHBondContact CZ-OH 3.28Å |
| 594 | G | 43.2 | Very low | 42.3 | Very low | 42 Ų | 42 | 83.7 Ų | 83.7 | 43% | 0.433 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.3 | -31.1 | 173 | 0 | 0 | 0 | 0 | 0 | 112.5 | N598 | G594-N598 WeakPolarHBondContact O-CB 3.4Å; G594-N598 PolarHBondContact O-N 3.02Å; G594-N598 PolarHBondContact O-ND2 3.18Å |
| 595 | S | 45.7 | Very low | 41.7 | Very low | 49 Ų | 49 | 84 Ų | 84 | 34% | 0.343 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -73 | -44.3 | 176.5 | -58.1 | 0 | 0 | 0 | 0 | 112.4 | H591 A592 F593 A597 N598 L599 | H591-S595 VanDerWaalsContact O-CB 3.3Å; H591-S595 WeakPolarHBondContact O-CB 3.25Å; H591-S595 PolarHBondContact O-N 2.94Å; H591-S595 PolarHBondContact O-OG 2.97Å; A592-S595 PolarHBondContact O-N 3.47Å; F593-S595 PolarHBondContact O-N 3.11Å; S595-A597 VanDerWaalsContact C-N 3.35Å; S595-N598 PolarHBondContact O-N 3.06Å; S595-L599 VanDerWaalsContact O-CB 3.32Å; S595-L599 WeakPolarHBondContact O-CB 3.42Å; S595-L599 PolarHBondContact O-N 3.06Å |
| 596 | I | 45.2 | Very low | 40.7 | Very low | 17 Ų | 17 | 81 Ų | 81 | 9% | 0.087 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -65 | -41.7 | 175.3 | -66.8 | 168 | 0 | 0 | 0 | 110.2 | I583 Y584 A592 F593 N598 L599 I600 | I583-I596 HydrophobicContact CG2-CD1 4.32Å; I583-I596 HydrophobicContact CG2-CG1 4.32Å; Y584-I596 HydrophobicContact CE2-CD1 3.76Å; A592-I596 WeakPolarHBondContact O-CG1 3.34Å; A592-I596 PolarHBondContact O-N 3.17Å; F593-I596 PolarHBondContact O-N 3.33Å; I596-N598 VanDerWaalsContact C-N 3.3Å; I596-N598 PolarHBondContact O-N 3.04Å; I596-L599 PolarHBondContact O-N 3.13Å; I596-L599 VanDerWaalsContact O-N 3.17Å; I596-I600 HydrophobicContact CG2-CD1 4.06Å; I596-I600 PolarHBondContact O-N 2.92Å; I596-I600 VanDerWaalsContact O-N 3.1Å |
| 597 | A | 41.7 | Very low | 39.8 | Very low | 44 Ų | 44 | 87.9 Ų | 87.9 | 36% | 0.364 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.5 | -33.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113 | F593 S595 G601 | F593-A597 VanDerWaalsContact O-CB 3.26Å; F593-A597 WeakPolarHBondContact O-CB 3.35Å; F593-A597 PolarHBondContact O-N 3.16Å; S595-A597 VanDerWaalsContact C-N 3.35Å; A597-G601 WeakPolarHBondContact O-CA 3.34Å; A597-G601 PolarHBondContact O-N 3.16Å |
| 598 | N | 45.1 | Very low | 39.4 | Very low | 135 Ų | 135 | 88.9 Ų | 88.9 | 72% | 0.722 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -87.9 | -11.7 | 174.4 | -78 | -72.5 | 0 | 0 | 0 | 114.4 | G594 S595 I596 | G594-N598 WeakPolarHBondContact O-CB 3.4Å; G594-N598 PolarHBondContact O-N 3.02Å; G594-N598 PolarHBondContact O-ND2 3.18Å; S595-N598 PolarHBondContact O-N 3.06Å; I596-N598 VanDerWaalsContact C-N 3.3Å; I596-N598 PolarHBondContact O-N 3.04Å |
| 599 | L | 45.5 | Very low | 39.2 | Very low | 75 Ų | 75 | 91.6 Ų | 91.6 | 39% | 0.393 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -88.1 | -27 | 176.7 | -164.1 | 75.2 | 0 | 0 | 0 | 112 | S595 I596 Y634 | S595-L599 VanDerWaalsContact O-CB 3.32Å; S595-L599 WeakPolarHBondContact O-CB 3.42Å; S595-L599 PolarHBondContact O-N 3.06Å; I596-L599 PolarHBondContact O-N 3.13Å; I596-L599 VanDerWaalsContact O-N 3.17Å; L599-Y634 HydrophobicContact CD1-CD2 4.4Å |
| 600 | I | 48.8 | Very low | 39.4 | Very low | 37 Ų | 37 | 85.7 Ų | 85.7 | 19% | 0.19 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -110.2 | -38.5 | 177.7 | -54.3 | 174 | 0 | 0 | 0 | 110.7 | I596 I602 M711 | I596-I600 HydrophobicContact CG2-CD1 4.06Å; I596-I600 PolarHBondContact O-N 2.92Å; I596-I600 VanDerWaalsContact O-N 3.1Å; I600-I602 PolarHBondContact O-N 2.73Å; I600-I602 VanDerWaalsContact O-N 3.11Å; I600-M711 HydrophobicContact CB-SD 3.79Å; I600-M711 HydrophobicContact CD1-SD 3.85Å; I600-M711 HydrophobicContact CG1-SD 4.4Å; I600-M711 HydrophobicContact CG2-CG 4.04Å; I600-M711 HydrophobicContact CG2-SD 3.63Å |
| 601 | G | 44.2 | Very low | 39.5 | Very low | 32 Ų | 32 | 89.3 Ų | 89.3 | 33% | 0.33 | 49% | 0.485 | S | S | . | . | S | Bend | trans | -74.1 | 101.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | A597 | A597-G601 WeakPolarHBondContact O-CA 3.34Å; A597-G601 PolarHBondContact O-N 3.16Å |
| 602 | I | 34 | Very low | 39.6 | Very low | 67 Ų | 67 | 88.3 Ų | 88.3 | 34% | 0.344 | 48% | 0.483 | S | S | . | . | P | Polyproline II helix | trans | -52.7 | 142.3 | 168.1 | -84.3 | 175.9 | 0 | 0 | 0 | 112 | I600 Y606 L608 | I600-I602 PolarHBondContact O-N 2.73Å; I600-I602 VanDerWaalsContact O-N 3.11Å; I602-Y606 WeakPolarHBondContact CG2-O 3.23Å; I602-L608 HydrophobicContact CD1-CB 3.64Å; I602-L608 HydrophobicContact CD1-CD1 3.77Å; I602-L608 HydrophobicContact CD1-CG 3.59Å |
| 603 | R | 29.8 | Very low | 39.8 | Very low | 128 Ų | 128 | 90.5 Ų | 90.5 | 48% | 0.483 | 49% | 0.493 | S | S | . | . | P | Polyproline II helix | trans | -61.1 | 135.1 | 177.7 | -156.1 | -173.2 | -155.8 | -166.8 | 7.7 | 110.6 | G605 Y606 F640 | R603-G605 PolarHBondContact O-N 3.08Å; R603-Y606 PolarHBondContact O-N 2.95Å; R603-F640 VanDerWaalsContact NH1-CD2 3.27Å |
| 604 | P | 31.1 | Very low | 40 | Very low | 133 Ų | 133 | 93.2 Ų | 93.2 | 86% | 0.864 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.5 | 118.8 | 170.7 | -27.7 | 35.3 | 0 | 0 | 0 | 110.8 | ||
| 605 | G | 35.6 | Very low | 40 | Very low | 78 Ų | 78 | 97.2 Ų | 97.2 | 80% | 0.804 | 51% | 0.512 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 113.7 | -23.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | R603 K607 | R603-G605 PolarHBondContact O-N 3.08Å; G605-K607 PolarHBondContact O-N 3.18Å |
| 606 | Y | 32.6 | Very low | 40.4 | Very low | 156 Ų | 156 | 98.2 Ų | 98.2 | 61% | 0.612 | 53% | 0.53 | S | S | * | . | trans | -96.9 | 71.7 | 179.2 | -93.5 | -89.5 | 0 | 0 | 0 | 112.3 | I602 R603 L608 | I602-Y606 WeakPolarHBondContact CG2-O 3.23Å; R603-Y606 PolarHBondContact O-N 2.95Å; Y606-L608 PolarHBondContact O-N 3.17Å; Y606-L608 VanDerWaalsContact O-N 3.14Å | ||
| 607 | K | 33.3 | Very low | 40.9 | Very low | 192 Ų | 192 | 99.7 Ų | 99.7 | 84% | 0.835 | 54% | 0.536 | S | S | * | . | trans | -52.9 | 125.5 | 178.5 | -75.5 | -174.5 | 177.1 | 179.3 | 0 | 111.4 | G605 E609 | G605-K607 PolarHBondContact O-N 3.18Å; K607-E609 PolarHBondContact O-N 3Å | ||
| 608 | L | 38.4 | Very low | 42 | Very low | 77 Ų | 77 | 101.1 Ų | 101.1 | 40% | 0.403 | 54% | 0.541 | S | S | . | . | trans | -63.5 | 103.8 | 167.1 | -143.4 | 178.1 | 0 | 0 | 0 | 107 | I602 Y606 T610 T629 | I602-L608 HydrophobicContact CD1-CB 3.64Å; I602-L608 HydrophobicContact CD1-CD1 3.77Å; I602-L608 HydrophobicContact CD1-CG 3.59Å; Y606-L608 PolarHBondContact O-N 3.17Å; Y606-L608 VanDerWaalsContact O-N 3.14Å; L608-T610 HydrophobicContact CD2-CG2 4.03Å; L608-T610 PolarHBondContact O-N 2.92Å; L608-T629 HydrophobicContact CD2-CG2 4.39Å | ||
| 609 | E | 35 | Very low | 42.9 | Very low | 136 Ų | 136 | 98.2 Ų | 98.2 | 64% | 0.636 | 52% | 0.523 | S | S | * | . | trans | -73.8 | 72.8 | -177.3 | -71.4 | -159.1 | 143 | 0 | 0 | 111.8 | K607 Q611 I612 | K607-E609 PolarHBondContact O-N 3Å; E609-Q611 PolarHBondContact O-N 3.47Å; E609-I612 PolarHBondContact O-N 3.32Å | ||
| 610 | T | 40.7 | Very low | 44.2 | Very low | 80 Ų | 80 | 101.9 Ų | 101.9 | 49% | 0.491 | 54% | 0.536 | S | S | . | . | G | 310 helix | trans | -64.9 | 0.9 | 174.6 | 51 | 0 | 0 | 0 | 0 | 113.6 | L608 I612 L613 | L608-T610 HydrophobicContact CD2-CG2 4.03Å; L608-T610 PolarHBondContact O-N 2.92Å; T610-I612 PolarHBondContact O-N 3.05Å; T610-L613 HydrophobicContact CG2-CD1 3.94Å; T610-L613 WeakPolarHBondContact O-CB 3.5Å; T610-L613 PolarHBondContact O-N 3.41Å |
| 611 | Q | 38.2 | Very low | 45.2 | Very low | 168 Ų | 168 | 104.2 Ų | 104.2 | 79% | 0.785 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -57.1 | -15.1 | 169 | -60.2 | -167.6 | 23.7 | 0 | 0 | 113.6 | E609 | E609-Q611 PolarHBondContact O-N 3.47Š|
| 612 | I | 42.6 | Very low | 46.3 | Very low | 116 Ų | 116 | 103.4 Ų | 103.4 | 60% | 0.595 | 53% | 0.533 | S | S | * | . | G | 310 helix | trans | -88.3 | -13.6 | 176.4 | -58.5 | -179.5 | 0 | 0 | 0 | 112.4 | E609 T610 K614 H617 | E609-I612 PolarHBondContact O-N 3.32Å; T610-I612 PolarHBondContact O-N 3.05Å; I612-K614 PolarHBondContact O-N 3.43Å; I612-K614 VanDerWaalsContact O-N 3.1Å; I612-H617 PolarHBondContact O-CE1 3.24Å |
| 613 | L | 47.2 | Very low | 48.2 | Very low | 51 Ų | 51 | 102.3 Ų | 102.3 | 27% | 0.267 | 53% | 0.526 | S | S | . | . | trans | -80.2 | 90 | 175.6 | -60.6 | 179.2 | 0 | 0 | 0 | 110.3 | T610 Y622 I625 | T610-L613 HydrophobicContact CG2-CD1 3.94Å; T610-L613 WeakPolarHBondContact O-CB 3.5Å; T610-L613 PolarHBondContact O-N 3.41Å; L613-Y622 HydrophobicContact CB-CE1 4.29Å; L613-Y622 HydrophobicContact CD1-CE1 4.17Å; L613-Y622 HydrophobicContact CD2-CD1 3.95Å; L613-Y622 HydrophobicContact CD2-CE1 3.83Å; L613-Y622 HydrophobicContact CG-CE1 4.31Å; L613-I625 HydrophobicContact CD2-CD1 3.86Å; L613-I625 HydrophobicContact CD2-CG2 4.19Å | ||
| 614 | K | 42.4 | Very low | 50.3 | Low | 144 Ų | 144 | 100.5 Ų | 100.5 | 63% | 0.626 | 53% | 0.525 | S | S | * | . | trans | -85.8 | 143.9 | 178.6 | -64.6 | 178.6 | 179.5 | 175.9 | 0 | 111.5 | I612 G616 H617 | I612-K614 PolarHBondContact O-N 3.43Å; I612-K614 VanDerWaalsContact O-N 3.1Å; K614-G616 PolarHBondContact O-N 2.84Å; K614-H617 PolarHBondContact O-CD2 3.5Å; K614-H617 PolarHBondContact O-N 2.89Å | ||
| 615 | H | 43.9 | Very low | 52.1 | Low | 127 Ų | 127 | 96.7 Ų | 96.7 | 59% | 0.588 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.7 | 132.7 | 168.7 | -171.1 | 78 | 0 | 0 | 0 | 110.2 | ||
| 616 | G | 53.3 | Low | 53.4 | Low | 69 Ų | 69 | 95.1 Ų | 95.1 | 71% | 0.711 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 92.7 | -0.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | K614 | K614-G616 PolarHBondContact O-N 2.84Š|
| 617 | H | 55.2 | Low | 55.3 | Low | 48 Ų | 48 | 88.7 Ų | 88.7 | 22% | 0.222 | 45% | 0.446 | C | S | . | . | trans | -62.7 | 136.5 | 167.8 | -83.4 | -143.5 | 0 | 0 | 0 | 111.1 | I612 K614 E621 Y622 | I612-H617 PolarHBondContact O-CE1 3.24Å; K614-H617 PolarHBondContact O-CD2 3.5Å; K614-H617 PolarHBondContact O-N 2.89Å; H617-E621 HydrophobicContact CB-CB 4.35Å; H617-Y622 HydrophobicContact CB-CD2 4.03Å; H617-Y622 HydrophobicContact CB-CE2 3.67Å; H617-Y622 WeakPolarHBondContact O-CE2 3.46Å | ||
| 618 | T | 66.5 | Low | 57 | Low | 75 Ų | 75 | 85.6 Ų | 85.6 | 46% | 0.46 | 43% | 0.433 | S | S | . | . | trans | -75 | 157 | 176.4 | 64.5 | 0 | 0 | 0 | 0 | 111.7 | K620 E621 Y622 | T618-K620 PolarHBondContact O-N 2.8Å; T618-E621 WeakPolarHBondContact CB-OE2 3.41Å; T618-E621 WeakPolarHBondContact CG2-OE2 3.39Å; T618-E621 PolarHBondContact N-OE2 3.27Å; T618-E621 WeakPolarHBondContact O-CA 3.38Å; T618-E621 WeakPolarHBondContact O-CB 3.44Å; T618-E621 PolarHBondContact O-N 2.91Å; T618-E621 PolarHBondContact OG1-N 2.93Å; T618-E621 PolarHBondContact OG1-OE2 2.93Å; T618-Y622 PolarHBondContact O-N 3.03Å | ||
| 619 | Q | 62.3 | Low | 58.1 | Low | 74 Ų | 74 | 84.6 Ų | 84.6 | 35% | 0.346 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -47.1 | -38.5 | 172.4 | -172.4 | -154 | -14.3 | 0 | 0 | 112.4 | E621 Y622 K623 I684 T687 | Q619-E621 VanDerWaalsContact C-N 3.35Å; Q619-E621 PolarHBondContact O-N 3.17Å; Q619-Y622 PolarHBondContact O-N 3.01Å; Q619-K623 VanDerWaalsContact O-CB 3.32Å; Q619-K623 WeakPolarHBondContact O-CB 3.45Å; Q619-K623 PolarHBondContact O-N 3.1Å; Q619-I684 HydrophobicContact CG-CG1 4.44Å; Q619-T687 WeakPolarHBondContact CA-OG1 3.25Å |
| 620 | K | 73.5 | Confident | 59.2 | Low | 151 Ų | 151 | 80 Ų | 80 | 66% | 0.657 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -66.1 | -34 | 178.5 | -173.2 | 177.7 | 179.3 | -178.3 | 0 | 112.8 | T618 N624 | T618-K620 PolarHBondContact O-N 2.8Å; K620-N624 WeakPolarHBondContact O-CB 3.43Å; K620-N624 PolarHBondContact O-N 3.07Å; K620-N624 PolarHBondContact O-ND2 3.33Å |
| 621 | E | 70.5 | Confident | 60.4 | Low | 87 Ų | 87 | 80.5 Ų | 80.5 | 41% | 0.407 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -76.4 | -43.1 | 176.7 | -71 | 158.3 | 127.5 | 0 | 0 | 111 | H617 T618 Q619 K623 N624 I625 | H617-E621 HydrophobicContact CB-CB 4.35Å; T618-E621 WeakPolarHBondContact CB-OE2 3.41Å; T618-E621 WeakPolarHBondContact CG2-OE2 3.39Å; T618-E621 PolarHBondContact N-OE2 3.27Å; T618-E621 WeakPolarHBondContact O-CA 3.38Å; T618-E621 WeakPolarHBondContact O-CB 3.44Å; T618-E621 PolarHBondContact O-N 2.91Å; T618-E621 PolarHBondContact OG1-N 2.93Å; T618-E621 PolarHBondContact OG1-OE2 2.93Å; Q619-E621 VanDerWaalsContact C-N 3.35Å; Q619-E621 PolarHBondContact O-N 3.17Å; E621-K623 VanDerWaalsContact C-N 3.35Å; E621-K623 PolarHBondContact O-N 2.77Å; E621-N624 PolarHBondContact O-N 2.81Å; E621-I625 WeakPolarHBondContact O-CB 3.3Å; E621-I625 VanDerWaalsContact O-CG1 3.29Å; E621-I625 WeakPolarHBondContact O-CG1 3.44Å; E621-I625 PolarHBondContact O-N 3.26Å |
| 622 | Y | 66.4 | Low | 61.2 | Low | 14 Ų | 14 | 75.9 Ų | 75.9 | 6% | 0.055 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -55 | -48.9 | 169.6 | -82 | -75 | 0 | 0 | 0 | 111.8 | L613 H617 T618 Q619 N624 I625 L626 A686 | L613-Y622 HydrophobicContact CB-CE1 4.29Å; L613-Y622 HydrophobicContact CD1-CE1 4.17Å; L613-Y622 HydrophobicContact CD2-CD1 3.95Å; L613-Y622 HydrophobicContact CD2-CE1 3.83Å; L613-Y622 HydrophobicContact CG-CE1 4.31Å; H617-Y622 HydrophobicContact CB-CD2 4.03Å; H617-Y622 HydrophobicContact CB-CE2 3.67Å; H617-Y622 WeakPolarHBondContact O-CE2 3.46Å; T618-Y622 PolarHBondContact O-N 3.03Å; Q619-Y622 PolarHBondContact O-N 3.01Å; Y622-N624 PolarHBondContact O-N 2.89Å; Y622-I625 PolarHBondContact O-N 3.39Å; Y622-L626 PolarHBondContact O-N 3.38Å; Y622-A686 HydrophobicContact CD1-CB 4.32Å |
| 623 | K | 73.4 | Confident | 61.6 | Low | 44 Ų | 44 | 73.4 Ų | 73.4 | 19% | 0.191 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -58.1 | -48.2 | 176.1 | -176.5 | 179.9 | -177.3 | 172 | 0 | 112.3 | Q619 E621 I625 L626 I627 A679 D680 | Q619-K623 VanDerWaalsContact O-CB 3.32Å; Q619-K623 WeakPolarHBondContact O-CB 3.45Å; Q619-K623 PolarHBondContact O-N 3.1Å; E621-K623 VanDerWaalsContact C-N 3.35Å; E621-K623 PolarHBondContact O-N 2.77Å; K623-I625 VanDerWaalsContact C-N 3.33Å; K623-I625 PolarHBondContact O-N 2.88Å; K623-L626 PolarHBondContact O-N 2.94Å; K623-I627 HydrophobicContact CD-CD1 4.42Å; K623-I627 HydrophobicContact CG-CD1 3.84Å; K623-I627 HydrophobicContact CG-CG1 4.38Å; K623-I627 WeakPolarHBondContact O-CG1 3.25Å; K623-I627 PolarHBondContact O-N 3.05Å; K623-A679 HydrophobicContact CG-CB 4.41Å; K623-D680 WeakPolarHBondContact CD-OD1 3.34Å; K623-D680 VanDerWaalsContact CE-CG 3.42Å; K623-D680 WeakPolarHBondContact CE-OD1 3.5Å; K623-D680 IonicContact NZ-OD1 3.58Å; K623-D680 PolarHBondContact NZ-OD1 2.98Å; K623-D680 IonicContact NZ-OD2 3.32Å; K623-D680 PolarHBondContact NZ-OD2 3.48Å |
| 624 | N | 75.2 | Confident | 61.8 | Low | 90 Ų | 90 | 74.6 Ų | 74.6 | 48% | 0.481 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -64.6 | -37.4 | -179.2 | -77.4 | -14.6 | 0 | 0 | 0 | 112.4 | K620 E621 Y622 K628 | K620-N624 WeakPolarHBondContact O-CB 3.43Å; K620-N624 PolarHBondContact O-N 3.07Å; K620-N624 PolarHBondContact O-ND2 3.33Å; E621-N624 PolarHBondContact O-N 2.81Å; Y622-N624 PolarHBondContact O-N 2.89Å; N624-K628 WeakPolarHBondContact O-CB 3.31Å; N624-K628 PolarHBondContact O-N 2.7Å |
| 625 | I | 68.5 | Low | 62.2 | Low | 53 Ų | 53 | 75.2 Ų | 75.2 | 27% | 0.272 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -65.5 | -47.6 | 174.5 | -68.1 | 167.4 | 0 | 0 | 0 | 109.9 | L613 E621 Y622 K623 K628 T629 | L613-I625 HydrophobicContact CD2-CD1 3.86Å; L613-I625 HydrophobicContact CD2-CG2 4.19Å; E621-I625 WeakPolarHBondContact O-CB 3.3Å; E621-I625 VanDerWaalsContact O-CG1 3.29Å; E621-I625 WeakPolarHBondContact O-CG1 3.44Å; E621-I625 PolarHBondContact O-N 3.26Å; Y622-I625 PolarHBondContact O-N 3.39Å; K623-I625 VanDerWaalsContact C-N 3.33Å; K623-I625 PolarHBondContact O-N 2.88Å; I625-K628 PolarHBondContact O-N 3.23Å; I625-T629 PolarHBondContact O-N 2.86Å; I625-T629 PolarHBondContact O-OG1 3.06Å; I625-T629 VanDerWaalsContact O-OG1 3.14Å |
| 626 | L | 63.2 | Low | 62.3 | Low | 45 Ų | 45 | 75 Ų | 75 | 24% | 0.236 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -60.9 | -47.1 | 176.8 | -108.5 | 77.3 | 0 | 0 | 0 | 113 | Y622 K623 K628 T629 L630 A679 C682 | Y622-L626 PolarHBondContact O-N 3.38Å; K623-L626 PolarHBondContact O-N 2.94Å; L626-K628 PolarHBondContact O-N 3.11Å; L626-T629 PolarHBondContact O-N 3.47Å; L626-L630 WeakPolarHBondContact O-CB 3.26Å; L626-L630 VanDerWaalsContact O-CG 3.29Å; L626-L630 WeakPolarHBondContact O-CG 2.96Å; L626-L630 PolarHBondContact O-N 3.34Å; L626-A679 HydrophobicContact CB-CB 3.88Å; L626-C682 HydrophobicContact CD2-CB 3.34Å |
| 627 | I | 71.5 | Confident | 61.6 | Low | 22 Ų | 22 | 80.6 Ų | 80.6 | 11% | 0.113 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -56.5 | -41.7 | 176 | -70.5 | 172.5 | 0 | 0 | 0 | 110.2 | K623 R631 I676 A679 | K623-I627 HydrophobicContact CD-CD1 4.42Å; K623-I627 HydrophobicContact CG-CD1 3.84Å; K623-I627 HydrophobicContact CG-CG1 4.38Å; K623-I627 WeakPolarHBondContact O-CG1 3.25Å; K623-I627 PolarHBondContact O-N 3.05Å; I627-R631 WeakPolarHBondContact O-CB 3.45Å; I627-R631 PolarHBondContact O-N 2.93Å; I627-R631 VanDerWaalsContact O-N 3.07Å; I627-I676 HydrophobicContact CD1-CG1 4.2Å; I627-I676 HydrophobicContact CD1-CG2 4.39Å; I627-A679 HydrophobicContact CD1-CB 4.31Å; I627-A679 HydrophobicContact CG1-CB 3.42Å; I627-A679 VanDerWaalsContact CG1-CB 3.42Å |
| 628 | K | 70.2 | Confident | 60.6 | Low | 127 Ų | 127 | 85.8 Ų | 85.8 | 55% | 0.552 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -66 | -53.4 | 178.3 | -165.7 | -167 | 174.8 | -149.4 | 0 | 111.2 | N624 I625 L626 L630 R631 D632 | N624-K628 WeakPolarHBondContact O-CB 3.31Å; N624-K628 PolarHBondContact O-N 2.7Å; I625-K628 PolarHBondContact O-N 3.23Å; L626-K628 PolarHBondContact O-N 3.11Å; K628-L630 PolarHBondContact O-N 3.42Å; K628-R631 PolarHBondContact O-N 3.08Å; K628-R631 VanDerWaalsContact O-N 3.16Å; K628-D632 WeakPolarHBondContact CE-OD2 3.4Å; K628-D632 IonicContact NZ-OD2 3.8Å; K628-D632 WeakPolarHBondContact O-CB 3.14Å; K628-D632 VanDerWaalsContact O-CG 3.25Å; K628-D632 PolarHBondContact O-N 3.31Å |
| 629 | T | 59.8 | Low | 58.7 | Low | 55 Ų | 55 | 87.1 Ų | 87.1 | 34% | 0.337 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61 | -42.2 | -177.9 | -53.9 | 0 | 0 | 0 | 0 | 112.3 | L608 I625 L626 D632 A633 | L608-T629 HydrophobicContact CD2-CG2 4.39Å; I625-T629 PolarHBondContact O-N 2.86Å; I625-T629 PolarHBondContact O-OG1 3.06Å; I625-T629 VanDerWaalsContact O-OG1 3.14Å; L626-T629 PolarHBondContact O-N 3.47Å; T629-D632 PolarHBondContact O-N 2.87Å; T629-A633 VanDerWaalsContact O-CB 3.27Å; T629-A633 WeakPolarHBondContact O-CB 2.96Å; T629-A633 PolarHBondContact O-N 3.47Å |
| 630 | L | 58 | Low | 57 | Low | 40 Ų | 40 | 91.3 Ų | 91.3 | 21% | 0.209 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -65.7 | -36.9 | 176.6 | -69.7 | 168.5 | 0 | 0 | 0 | 112.2 | L626 K628 Y634 I675 I678 A679 | L626-L630 WeakPolarHBondContact O-CB 3.26Å; L626-L630 VanDerWaalsContact O-CG 3.29Å; L626-L630 WeakPolarHBondContact O-CG 2.96Å; L626-L630 PolarHBondContact O-N 3.34Å; K628-L630 PolarHBondContact O-N 3.42Å; L630-Y634 PolarHBondContact O-N 3.03Å; L630-I675 HydrophobicContact CB-CG2 3.82Å; L630-I675 HydrophobicContact CD1-CG2 4.27Å; L630-I678 HydrophobicContact CD1-CG2 4.34Å; L630-A679 HydrophobicContact CD1-CB 4.47Å |
| 631 | R | 67.2 | Low | 54.8 | Low | 91 Ų | 91 | 88.6 Ų | 88.6 | 34% | 0.343 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -69.4 | -46.5 | 174.5 | -175.6 | -177.8 | -77.9 | 140.8 | -9.2 | 111.4 | I627 K628 A633 Y634 Y635 E672 | I627-R631 WeakPolarHBondContact O-CB 3.45Å; I627-R631 PolarHBondContact O-N 2.93Å; I627-R631 VanDerWaalsContact O-N 3.07Å; K628-R631 PolarHBondContact O-N 3.08Å; K628-R631 VanDerWaalsContact O-N 3.16Å; R631-A633 VanDerWaalsContact C-N 3.33Å; R631-A633 PolarHBondContact O-N 3.03Å; R631-Y634 PolarHBondContact O-N 3.26Å; R631-Y635 HydrophobicContact CG-CD2 3.76Å; R631-Y635 HydrophobicContact CG-CE2 3.86Å; R631-Y635 WeakPolarHBondContact O-CD2 3.3Å; R631-Y635 PolarHBondContact O-N 3.33Å; R631-Y635 VanDerWaalsContact O-N 3.07Å; R631-E672 IonicContact CZ-OE1 2.68Å; R631-E672 IonicContact NE-OE1 2.87Å; R631-E672 PolarHBondContact NE-OE1 3.1Å; R631-E672 IonicContact NH2-OE1 2.78Å; R631-E672 PolarHBondContact NH2-OE1 3.4Å |
| 632 | D | 54.3 | Low | 52.8 | Low | 70 Ų | 70 | 93.9 Ų | 93.9 | 37% | 0.374 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.6 | -40.4 | 179.9 | -68.4 | -8 | 0 | 0 | 0 | 110.7 | K628 T629 Y635 L636 | K628-D632 WeakPolarHBondContact CE-OD2 3.4Å; K628-D632 IonicContact NZ-OD2 3.8Å; K628-D632 WeakPolarHBondContact O-CB 3.14Å; K628-D632 VanDerWaalsContact O-CG 3.25Å; K628-D632 PolarHBondContact O-N 3.31Å; T629-D632 PolarHBondContact O-N 2.87Å; D632-Y635 PolarHBondContact O-N 2.94Å; D632-L636 WeakPolarHBondContact O-CD1 3.46Å; D632-L636 PolarHBondContact O-N 2.74Å; D632-L636 VanDerWaalsContact O-N 3.14Å |
| 633 | A | 50.2 | Low | 51 | Low | 64 Ų | 64 | 96.1 Ų | 96.1 | 53% | 0.529 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63 | -39.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | T629 R631 | T629-A633 VanDerWaalsContact O-CB 3.27Å; T629-A633 WeakPolarHBondContact O-CB 2.96Å; T629-A633 PolarHBondContact O-N 3.47Å; R631-A633 VanDerWaalsContact C-N 3.33Å; R631-A633 PolarHBondContact O-N 3.03Å |
| 634 | Y | 52.9 | Low | 49 | Very low | 76 Ų | 76 | 101 Ų | 101 | 30% | 0.298 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -67.3 | -41.7 | 176.9 | -177.6 | -100.9 | 0 | 0 | 0 | 112.5 | L599 L630 R631 L671 | L599-Y634 HydrophobicContact CD1-CD2 4.4Å; L630-Y634 PolarHBondContact O-N 3.03Å; R631-Y634 PolarHBondContact O-N 3.26Å; Y634-L671 HydrophobicContact CD2-CD2 4.12Å; Y634-L671 HydrophobicContact CE1-CD2 4.33Å; Y634-L671 HydrophobicContact CE2-CD2 3.41Å; Y634-L671 VanDerWaalsContact CE2-CD2 3.41Å |
| 635 | Y | 50.6 | Low | 47 | Very low | 158 Ų | 158 | 105.2 Ų | 105.2 | 62% | 0.62 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -82.5 | -14.4 | -176 | -78.6 | -72.6 | 0 | 0 | 0 | 115 | R631 D632 K637 | R631-Y635 HydrophobicContact CG-CD2 3.76Å; R631-Y635 HydrophobicContact CG-CE2 3.86Å; R631-Y635 WeakPolarHBondContact O-CD2 3.3Å; R631-Y635 PolarHBondContact O-N 3.33Å; R631-Y635 VanDerWaalsContact O-N 3.07Å; D632-Y635 PolarHBondContact O-N 2.94Å; Y635-K637 PolarHBondContact O-N 3.22Å |
| 636 | L | 44.7 | Very low | 45.6 | Very low | 122 Ų | 122 | 106 Ų | 106 | 64% | 0.639 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.6 | -3.1 | 175.4 | -113.9 | 87.4 | 0 | 0 | 0 | 114.8 | D632 N638 | D632-L636 WeakPolarHBondContact O-CD1 3.46Å; D632-L636 PolarHBondContact O-N 2.74Å; D632-L636 VanDerWaalsContact O-N 3.14Å; L636-N638 PolarHBondContact O-N 3.44Å |
| 637 | K | 39.1 | Very low | 44.2 | Very low | 186 Ų | 186 | 107.8 Ų | 107.8 | 81% | 0.809 | 54% | 0.537 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69 | 15.3 | -171.1 | -154.4 | 177.1 | 177.1 | 178.2 | 0 | 115.9 | Y635 | Y635-K637 PolarHBondContact O-N 3.22Š|
| 638 | N | 35 | Very low | 42.4 | Very low | 158 Ų | 158 | 109.4 Ų | 109.4 | 85% | 0.845 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.5 | 9.5 | -174.1 | -113.1 | 6.9 | 0 | 0 | 0 | 115 | L636 | L636-N638 PolarHBondContact O-N 3.44Š|
| 639 | S | 26.9 | Very low | 40.8 | Very low | 103 Ų | 103 | 107.6 Ų | 107.6 | 72% | 0.72 | 55% | 0.554 | S | S | * | * | S | Bend | trans | -156.8 | 77.1 | 177.9 | -70.8 | 0 | 0 | 0 | 0 | 114.4 | ||
| 640 | F | 24.9 | Very low | 39.5 | Very low | 162 Ų | 162 | 109.6 Ų | 109.6 | 71% | 0.711 | 56% | 0.562 | S | S | * | * | trans | -166.3 | 144.9 | 148.7 | -120.4 | -76.1 | 0 | 0 | 0 | 113.4 | R603 | R603-F640 VanDerWaalsContact NH1-CD2 3.27Š| ||
| 641 | S | 28.7 | Very low | 38.4 | Very low | 93 Ų | 93 | 114.5 Ų | 114.5 | 65% | 0.65 | 59% | 0.587 | S | S | * | * | trans | 4.3 | 137.2 | 167.1 | -165.9 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 642 | Y | 28.6 | Very low | 36.7 | Very low | 199 Ų | 199 | 117.1 Ų | 117.1 | 78% | 0.78 | 61% | 0.607 | S | S | * | * | trans | -133.7 | 17.3 | 170.3 | -125 | -71.8 | 0 | 0 | 0 | 113.7 | I646 | Y642-I646 HydrophobicContact CD1-CD1 3.65Å; Y642-I646 HydrophobicContact CD1-CG1 4.4Å; Y642-I646 HydrophobicContact CE1-CD1 4.01Å | ||
| 643 | A | 28.5 | Very low | 35.5 | Very low | 60 Ų | 60 | 120.9 Ų | 120.9 | 50% | 0.496 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -84.3 | -65.1 | -158.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||
| 644 | H | 31.2 | Very low | 34.6 | Very low | 147 Ų | 147 | 122.8 Ų | 122.8 | 68% | 0.681 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -98.6 | -21.4 | -163.9 | -90.9 | -123.9 | 0 | 0 | 0 | 116.6 | I646 I647 | H644-I646 PolarHBondContact O-N 2.81Å; H644-I647 PolarHBondContact O-N 3.26Å |
| 645 | F | 31.9 | Very low | 33.4 | Very low | 179 Ų | 179 | 129 Ų | 129 | 79% | 0.785 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.9 | -17.2 | 170.8 | -167.2 | -107.5 | 0 | 0 | 0 | 112.1 | I649 | F645-I649 HydrophobicContact CD1-CD1 4.05Å; F645-I649 HydrophobicContact CE1-CD1 3.5Å; F645-I649 HydrophobicContact CE2-CD1 4.13Å; F645-I649 HydrophobicContact CZ-CD1 3.55Å |
| 646 | I | 40.2 | Very low | 32.3 | Very low | 69 Ų | 69 | 130.1 Ų | 130.1 | 35% | 0.354 | 67% | 0.671 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.4 | -31.3 | 170.7 | -86.2 | -174.4 | 0 | 0 | 0 | 112.2 | Y642 H644 I649 L650 | Y642-I646 HydrophobicContact CD1-CD1 3.65Å; Y642-I646 HydrophobicContact CD1-CG1 4.4Å; Y642-I646 HydrophobicContact CE1-CD1 4.01Å; H644-I646 PolarHBondContact O-N 2.81Å; I646-I649 PolarHBondContact O-N 3.46Å; I646-L650 HydrophobicContact CG2-CD1 3.98Å; I646-L650 HydrophobicContact CG2-CD2 3.86Å; I646-L650 HydrophobicContact CG2-CG 4.43Å; I646-L650 WeakPolarHBondContact O-CB 3.37Å; I646-L650 WeakPolarHBondContact O-CD1 3.31Å; I646-L650 PolarHBondContact O-N 2.72Å |
| 647 | I | 34.5 | Very low | 31.5 | Very low | 83 Ų | 83 | 128.3 Ų | 128.3 | 43% | 0.426 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -70.4 | -47.6 | -174.6 | -63.6 | 180 | 0 | 0 | 0 | 111.3 | H644 I649 I651 | H644-I647 PolarHBondContact O-N 3.26Å; I647-I649 PolarHBondContact O-N 2.64Å; I647-I651 HydrophobicContact CG2-CD1 4.31Å |
| 648 | G | 33 | Very low | 31 | Very low | 56 Ų | 56 | 126.7 Ų | 126.7 | 58% | 0.577 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -66.7 | -16.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 649 | I | 37 | Very low | 30.6 | Very low | 88 Ų | 88 | 126.2 Ų | 126.2 | 45% | 0.451 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -108.6 | -26.2 | -175.7 | -65.3 | 179 | 0 | 0 | 0 | 112.4 | F645 I646 I647 | F645-I649 HydrophobicContact CD1-CD1 4.05Å; F645-I649 HydrophobicContact CE1-CD1 3.5Å; F645-I649 HydrophobicContact CE2-CD1 4.13Å; F645-I649 HydrophobicContact CZ-CD1 3.55Å; I646-I649 PolarHBondContact O-N 3.46Å; I647-I649 PolarHBondContact O-N 2.64Å |
| 650 | L | 32.7 | Very low | 30.7 | Very low | 97 Ų | 97 | 128.2 Ų | 128.2 | 51% | 0.508 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -71.4 | -30.4 | 173.1 | -98.9 | 57 | 0 | 0 | 0 | 113.2 | I646 L652 V654 | I646-L650 HydrophobicContact CG2-CD1 3.98Å; I646-L650 HydrophobicContact CG2-CD2 3.86Å; I646-L650 HydrophobicContact CG2-CG 4.43Å; I646-L650 WeakPolarHBondContact O-CB 3.37Å; I646-L650 WeakPolarHBondContact O-CD1 3.31Å; I646-L650 PolarHBondContact O-N 2.72Å; L650-L652 VanDerWaalsContact C-N 3.3Å; L650-L652 PolarHBondContact O-N 3Å; L650-V654 HydrophobicContact CB-CG2 4.29Å; L650-V654 HydrophobicContact CG-CG2 3.92Å; L650-V654 WeakPolarHBondContact O-CG2 3.33Å |
| 651 | I | 34.7 | Very low | 30.9 | Very low | 143 Ų | 143 | 129.4 Ų | 129.4 | 73% | 0.733 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | -28.5 | -177.9 | -68.9 | 174 | 0 | 0 | 0 | 112.1 | I647 | I647-I651 HydrophobicContact CG2-CD1 4.31Š|
| 652 | L | 30.4 | Very low | 31.1 | Very low | 147 Ų | 147 | 131.1 Ų | 131.1 | 77% | 0.77 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.2 | -18.8 | -176.2 | -96.5 | 161.2 | 0 | 0 | 0 | 115.7 | L650 | L650-L652 VanDerWaalsContact C-N 3.3Å; L650-L652 PolarHBondContact O-N 3Å |
| 653 | L | 29 | Very low | 31.4 | Very low | 148 Ų | 148 | 128.4 Ų | 128.4 | 78% | 0.775 | 68% | 0.678 | S | S | * | * | trans | -144.6 | 52.2 | -172.1 | -74 | 178 | 0 | 0 | 0 | 115.8 | ||||
| 654 | V | 31.4 | Very low | 31.9 | Very low | 104 Ų | 104 | 130 Ų | 130 | 63% | 0.63 | 69% | 0.686 | S | S | * | * | trans | -120.7 | 65.2 | 167.6 | -170.6 | 0 | 0 | 0 | 0 | 113.1 | L650 | L650-V654 HydrophobicContact CB-CG2 4.29Å; L650-V654 HydrophobicContact CG-CG2 3.92Å; L650-V654 WeakPolarHBondContact O-CG2 3.33Å | ||
| 655 | K | 28.9 | Very low | 32.4 | Very low | 206 Ų | 206 | 129.8 Ų | 129.8 | 90% | 0.896 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -175.5 | 120.7 | 149.1 | -100.7 | 162.8 | -176.1 | 177.9 | 0 | 105.6 | ||
| 656 | H | 26.5 | Very low | 33 | Very low | 183 Ų | 183 | 128 Ų | 128 | 85% | 0.847 | 68% | 0.683 | S | S | * | * | cis | -125.4 | 155.5 | 13.4 | -160.6 | -81.3 | 0 | 0 | 0 | 112.5 | ||||
| 657 | S | 28.6 | Very low | 33.3 | Very low | 84 Ų | 84 | 129 Ų | 129 | 59% | 0.587 | 69% | 0.687 | S | S | * | * | trans | -96.6 | 145.2 | 179.6 | 177.1 | 0 | 0 | 0 | 0 | 113 | M659 | S657-M659 PolarHBondContact OG-N 3.42Š| ||
| 658 | T | 28.9 | Very low | 34 | Very low | 151 Ų | 151 | 129.6 Ų | 129.6 | 93% | 0.926 | 69% | 0.69 | S | S | * | * | trans | -143.9 | 83.1 | 138.2 | 43.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 659 | M | 25.3 | Very low | 35.1 | Very low | 148 Ų | 148 | 134 Ų | 134 | 73% | 0.729 | 70% | 0.696 | S | S | * | * | trans | -105.4 | 137.1 | 173.8 | -151.3 | -158.1 | -63.5 | 0 | 0 | 112.4 | S657 | S657-M659 PolarHBondContact OG-N 3.42Š| ||
| 660 | Q | 28.9 | Very low | 36.1 | Very low | 145 Ų | 145 | 132.8 Ų | 132.8 | 68% | 0.678 | 69% | 0.69 | S | S | * | * | trans | 30.9 | 109.1 | 153 | -70.2 | 175.3 | 6.1 | 0 | 0 | 119.6 | ||||
| 661 | Q | 29.9 | Very low | 37.1 | Very low | 188 Ų | 188 | 130.4 Ų | 130.4 | 88% | 0.879 | 68% | 0.678 | S | S | * | * | -114 | 165.8 | 117.6 | -68.8 | -171.6 | -4.5 | 0 | 0 | 108.2 | |||||
| 662 | V | 32 | Very low | 38.6 | Very low | 129 Ų | 129 | 127 Ų | 127 | 78% | 0.782 | 66% | 0.659 | S | S | * | * | trans | 71.9 | 121.3 | -177.1 | -174.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 663 | I | 35 | Very low | 40.4 | Very low | 142 Ų | 142 | 126.4 Ų | 126.4 | 73% | 0.728 | 65% | 0.65 | S | S | * | * | cis | -148.2 | 164.8 | 3.1 | -130.8 | 166.9 | 0 | 0 | 0 | 110.8 | ||||
| 664 | S | 39.8 | Very low | 42.1 | Very low | 94 Ų | 94 | 119.8 Ų | 119.8 | 66% | 0.657 | 62% | 0.615 | S | S | * | * | trans | -121 | 177.9 | 175.3 | -170.3 | 0 | 0 | 0 | 0 | 112.5 | Q666 | S664-Q666 VanDerWaalsContact C-N 3.32Å; S664-Q666 PolarHBondContact O-N 3.26Å | ||
| 665 | N | 41.3 | Very low | 43.7 | Very low | 142 Ų | 142 | 116 Ų | 116 | 76% | 0.759 | 59% | 0.591 | S | S | * | * | S | Bend | trans | 68.3 | -28.3 | 172.3 | -65.3 | -23.5 | 0 | 0 | 0 | 119.5 | Q667 | N665-Q667 VanDerWaalsContact C-N 3.34Å; N665-Q667 PolarHBondContact O-N 2.96Å |
| 666 | Q | 45.1 | Very low | 45.8 | Very low | 141 Ų | 141 | 109.2 Ų | 109.2 | 66% | 0.659 | 56% | 0.564 | S | S | * | * | S | Bend | trans | -67.3 | -34.5 | 179.8 | -165.4 | 68.1 | 24 | 0 | 0 | 112.7 | S664 N668 | S664-Q666 VanDerWaalsContact C-N 3.32Å; S664-Q666 PolarHBondContact O-N 3.26Å; Q666-N668 PolarHBondContact O-N 3.02Å |
| 667 | Q | 45.6 | Very low | 47.8 | Very low | 91 Ų | 91 | 104.4 Ų | 104.4 | 43% | 0.425 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -70.5 | -26.6 | -166.2 | -59.7 | -168.7 | -25.8 | 0 | 0 | 115.3 | V586 N665 H669 L671 | V586-Q667 HydrophobicContact CG1-CB 4.17Å; V586-Q667 HydrophobicContact CG1-CG 3.83Å; V586-Q667 PolarHBondContact O-NE2 2.95Å; N665-Q667 VanDerWaalsContact C-N 3.34Å; N665-Q667 PolarHBondContact O-N 2.96Å; Q667-H669 VanDerWaalsContact C-N 3.34Å; Q667-H669 PolarHBondContact O-N 2.79Å; Q667-L671 WeakPolarHBondContact O-CB 3.32Å; Q667-L671 PolarHBondContact O-N 2.86Å |
| 668 | N | 50.1 | Low | 49.4 | Very low | 94 Ų | 94 | 101.7 Ų | 101.7 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.7 | -33.2 | -173.6 | -82.9 | 1.4 | 0 | 0 | 0 | 113.5 | Q666 E672 | Q666-N668 PolarHBondContact O-N 3.02Å; N668-E672 PolarHBondContact O-N 3.2Å |
| 669 | H | 56 | Low | 51.3 | Low | 149 Ų | 149 | 94.5 Ų | 94.5 | 69% | 0.69 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -79.9 | -35.5 | -176.8 | -160 | 49.5 | 0 | 0 | 0 | 112.4 | Q667 K673 | Q667-H669 VanDerWaalsContact C-N 3.34Å; Q667-H669 PolarHBondContact O-N 2.79Å; H669-K673 PolarHBondContact O-N 3.31Å |
| 670 | D | 58 | Low | 53.5 | Low | 62 Ų | 62 | 89.1 Ų | 89.1 | 33% | 0.332 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -67.5 | -38.4 | 170.7 | -69.7 | -44.2 | 0 | 0 | 0 | 110.9 | K673 L674 | D670-K673 WeakPolarHBondContact O-CB 3.44Å; D670-K673 PolarHBondContact O-N 3.48Å; D670-L674 WeakPolarHBondContact O-CB 3.18Å; D670-L674 PolarHBondContact O-N 3.49Å |
| 671 | L | 54.9 | Low | 55.2 | Low | 48 Ų | 48 | 82.6 Ų | 82.6 | 25% | 0.251 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -63 | -44.7 | 178.2 | -173.7 | 67.3 | 0 | 0 | 0 | 113.3 | Y634 Q667 K673 L674 I675 | Y634-L671 HydrophobicContact CD2-CD2 4.12Å; Y634-L671 HydrophobicContact CE1-CD2 4.33Å; Y634-L671 HydrophobicContact CE2-CD2 3.41Å; Y634-L671 VanDerWaalsContact CE2-CD2 3.41Å; Q667-L671 WeakPolarHBondContact O-CB 3.32Å; Q667-L671 PolarHBondContact O-N 2.86Å; L671-K673 VanDerWaalsContact C-N 3.31Å; L671-K673 PolarHBondContact O-N 2.87Å; L671-L674 WeakPolarHBondContact O-CB 3.34Å; L671-L674 PolarHBondContact O-N 2.88Å; L671-L674 VanDerWaalsContact O-N 3.13Å; L671-I675 WeakPolarHBondContact O-CG1 3.33Å; L671-I675 PolarHBondContact O-N 3.33Å |
| 672 | E | 65.9 | Low | 56.7 | Low | 72 Ų | 72 | 74.1 Ų | 74.1 | 34% | 0.336 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -65.6 | -36.1 | 178.6 | -177.7 | 163.5 | -135.3 | 0 | 0 | 112.1 | R631 N668 L674 I675 I676 | R631-E672 IonicContact CZ-OE1 2.68Å; R631-E672 IonicContact NE-OE1 2.87Å; R631-E672 PolarHBondContact NE-OE1 3.1Å; R631-E672 IonicContact NH2-OE1 2.78Å; R631-E672 PolarHBondContact NH2-OE1 3.4Å; N668-E672 PolarHBondContact O-N 3.2Å; E672-L674 VanDerWaalsContact C-N 3.27Å; E672-L674 PolarHBondContact O-N 3.36Å; E672-I675 PolarHBondContact O-N 2.92Å; E672-I676 HydrophobicContact CG-CD1 4.49Å; E672-I676 WeakPolarHBondContact O-CG1 2.95Å; E672-I676 PolarHBondContact O-N 2.97Å |
| 673 | K | 67.3 | Low | 58.5 | Low | 134 Ų | 134 | 68 Ų | 68 | 58% | 0.583 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -61.8 | -37.7 | 172.7 | -161.7 | 178.8 | -174.9 | -178.6 | 0 | 111.5 | H669 D670 L671 I676 Q677 | H669-K673 PolarHBondContact O-N 3.31Å; D670-K673 WeakPolarHBondContact O-CB 3.44Å; D670-K673 PolarHBondContact O-N 3.48Å; L671-K673 VanDerWaalsContact C-N 3.31Å; L671-K673 PolarHBondContact O-N 2.87Å; K673-I676 PolarHBondContact O-N 3.42Å; K673-Q677 WeakPolarHBondContact O-CG 3.48Å; K673-Q677 PolarHBondContact O-N 3.03Å; K673-Q677 VanDerWaalsContact O-N 3.11Å |
| 674 | L | 64.2 | Low | 59.8 | Low | 9 Ų | 9 | 62 Ų | 62 | 5% | 0.047 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -70.5 | -41.4 | 178.4 | -136.4 | 158.3 | 0 | 0 | 0 | 112.3 | A579 T582 I583 D670 L671 E672 I676 Q677 I678 | A579-L674 HydrophobicContact CB-CD2 4.09Å; T582-L674 HydrophobicContact CG2-CD1 3.97Å; I583-L674 HydrophobicContact CB-CD1 4.48Å; I583-L674 HydrophobicContact CD1-CD2 3.79Å; I583-L674 HydrophobicContact CG1-CD1 3.52Å; I583-L674 HydrophobicContact CG1-CD2 3.58Å; I583-L674 HydrophobicContact CG1-CG 4.2Å; D670-L674 WeakPolarHBondContact O-CB 3.18Å; D670-L674 PolarHBondContact O-N 3.49Å; L671-L674 WeakPolarHBondContact O-CB 3.34Å; L671-L674 PolarHBondContact O-N 2.88Å; L671-L674 VanDerWaalsContact O-N 3.13Å; E672-L674 VanDerWaalsContact C-N 3.27Å; E672-L674 PolarHBondContact O-N 3.36Å; L674-I676 VanDerWaalsContact C-N 3.27Å; L674-I676 PolarHBondContact O-N 2.9Å; L674-Q677 PolarHBondContact O-N 2.89Å; L674-Q677 VanDerWaalsContact O-N 3.16Å; L674-I678 HydrophobicContact CD2-CD1 3.59Å; L674-I678 HydrophobicContact CD2-CG1 4.02Å; L674-I678 WeakPolarHBondContact O-CG1 3.25Å; L674-I678 PolarHBondContact O-N 3.46Å |
| 675 | I | 65.1 | Low | 60.7 | Low | 23 Ų | 23 | 58.2 Ų | 58.2 | 12% | 0.118 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -56.7 | -42.7 | 172.1 | -70 | 168.9 | 0 | 0 | 0 | 110.6 | L630 L671 E672 A679 | L630-I675 HydrophobicContact CB-CG2 3.82Å; L630-I675 HydrophobicContact CD1-CG2 4.27Å; L671-I675 WeakPolarHBondContact O-CG1 3.33Å; L671-I675 PolarHBondContact O-N 3.33Å; E672-I675 PolarHBondContact O-N 2.92Å; I675-A679 WeakPolarHBondContact O-CB 3.41Å; I675-A679 PolarHBondContact O-N 3.02Å |
| 676 | I | 73.5 | Confident | 61.5 | Low | 65 Ų | 65 | 51.6 Ų | 51.6 | 33% | 0.333 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -66.9 | -38.6 | 178.1 | -65.4 | 167.3 | 0 | 0 | 0 | 111.6 | I627 E672 K673 L674 D680 | I627-I676 HydrophobicContact CD1-CG1 4.2Å; I627-I676 HydrophobicContact CD1-CG2 4.39Å; E672-I676 HydrophobicContact CG-CD1 4.49Å; E672-I676 WeakPolarHBondContact O-CG1 2.95Å; E672-I676 PolarHBondContact O-N 2.97Å; K673-I676 PolarHBondContact O-N 3.42Å; L674-I676 VanDerWaalsContact C-N 3.27Å; L674-I676 PolarHBondContact O-N 2.9Å; I676-D680 PolarHBondContact O-N 3.1Å |
| 677 | Q | 68.8 | Low | 62.2 | Low | 81 Ų | 81 | 46.8 Ų | 46.8 | 38% | 0.379 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -67.3 | -45.7 | 176.8 | -74.9 | 179.5 | -53.9 | 0 | 0 | 112.7 | A579 K673 L674 A679 D680 V681 | A579-Q677 HydrophobicContact CB-CB 4.3Å; K673-Q677 WeakPolarHBondContact O-CG 3.48Å; K673-Q677 PolarHBondContact O-N 3.03Å; K673-Q677 VanDerWaalsContact O-N 3.11Å; L674-Q677 PolarHBondContact O-N 2.89Å; L674-Q677 VanDerWaalsContact O-N 3.16Å; Q677-A679 VanDerWaalsContact C-N 3.32Å; Q677-A679 PolarHBondContact O-N 3.38Å; Q677-D680 WeakPolarHBondContact O-CB 3.11Å; Q677-D680 PolarHBondContact O-N 3.3Å; Q677-V681 PolarHBondContact O-N 2.76Å; Q677-V681 VanDerWaalsContact O-N 3.15Å |
| 678 | I | 62.2 | Low | 62.8 | Low | 27 Ų | 27 | 47.5 Ų | 47.5 | 14% | 0.138 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.6 | -45.5 | 176.1 | -70.1 | 170.1 | 0 | 0 | 0 | 110.1 | I583 L630 L674 D680 V681 C682 | I583-I678 HydrophobicContact CD1-CD1 4.47Å; L630-I678 HydrophobicContact CD1-CG2 4.34Å; L674-I678 HydrophobicContact CD2-CD1 3.59Å; L674-I678 HydrophobicContact CD2-CG1 4.02Å; L674-I678 WeakPolarHBondContact O-CG1 3.25Å; L674-I678 PolarHBondContact O-N 3.46Å; I678-D680 VanDerWaalsContact C-N 3.35Å; I678-D680 PolarHBondContact O-N 3.2Å; I678-V681 PolarHBondContact O-N 2.92Å; I678-C682 WeakPolarHBondContact O-CB 3.47Å; I678-C682 PolarHBondContact O-N 3.25Å; I678-C682 PolarHBondContact O-SG 3.45Å |
| 679 | A | 69.7 | Low | 62.8 | Low | 0 Ų | 0 | 47.9 Ų | 47.9 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -66.5 | -31.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | K623 L626 I627 L630 I675 Q677 S683 | K623-A679 HydrophobicContact CG-CB 4.41Å; L626-A679 HydrophobicContact CB-CB 3.88Å; I627-A679 HydrophobicContact CD1-CB 4.31Å; I627-A679 HydrophobicContact CG1-CB 3.42Å; I627-A679 VanDerWaalsContact CG1-CB 3.42Å; L630-A679 HydrophobicContact CD1-CB 4.47Å; I675-A679 WeakPolarHBondContact O-CB 3.41Å; I675-A679 PolarHBondContact O-N 3.02Å; Q677-A679 VanDerWaalsContact C-N 3.32Å; Q677-A679 PolarHBondContact O-N 3.38Å; A679-S683 WeakPolarHBondContact O-CB 3.37Å; A679-S683 PolarHBondContact O-N 3.02Å; A679-S683 PolarHBondContact O-OG 3.1Å |
| 680 | D | 70.7 | Confident | 62.6 | Low | 36 Ų | 36 | 44.6 Ų | 44.6 | 19% | 0.193 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60 | -57.6 | 170.7 | -115 | -28.9 | 0 | 0 | 0 | 110.5 | K623 I676 Q677 I678 C682 S683 I684 | K623-D680 WeakPolarHBondContact CD-OD1 3.34Å; K623-D680 VanDerWaalsContact CE-CG 3.42Å; K623-D680 WeakPolarHBondContact CE-OD1 3.5Å; K623-D680 IonicContact NZ-OD1 3.58Å; K623-D680 PolarHBondContact NZ-OD1 2.98Å; K623-D680 IonicContact NZ-OD2 3.32Å; K623-D680 PolarHBondContact NZ-OD2 3.48Å; I676-D680 PolarHBondContact O-N 3.1Å; Q677-D680 WeakPolarHBondContact O-CB 3.11Å; Q677-D680 PolarHBondContact O-N 3.3Å; I678-D680 VanDerWaalsContact C-N 3.35Å; I678-D680 PolarHBondContact O-N 3.2Å; D680-C682 PolarHBondContact O-N 2.98Å; D680-S683 PolarHBondContact O-N 2.87Å; D680-S683 PolarHBondContact O-OG 3.27Å; D680-I684 PolarHBondContact O-N 3.16Å |
| 681 | V | 64.4 | Low | 61.8 | Low | 8 Ų | 8 | 43 Ų | 43 | 5% | 0.048 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.4 | -46.7 | -176 | 179.2 | 0 | 0 | 0 | 0 | 111.2 | L576 Q677 I678 S683 I684 V685 | L576-V681 HydrophobicContact CB-CG1 4.39Å; L576-V681 HydrophobicContact CD1-CG1 4.33Å; L576-V681 HydrophobicContact CD2-CG1 4.41Å; Q677-V681 PolarHBondContact O-N 2.76Å; Q677-V681 VanDerWaalsContact O-N 3.15Å; I678-V681 PolarHBondContact O-N 2.92Å; V681-S683 VanDerWaalsContact C-N 3.3Å; V681-S683 PolarHBondContact O-N 2.86Å; V681-I684 PolarHBondContact O-N 3.02Å; V681-V685 PolarHBondContact O-N 3.46Å |
| 682 | C | 62.2 | Low | 61 | Low | 10 Ų | 10 | 45.6 Ų | 45.6 | 7% | 0.068 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.5 | -31.6 | 179.3 | -64.4 | 0 | 0 | 0 | 0 | 112.4 | L626 I678 D680 A686 I710 | L626-C682 HydrophobicContact CD2-CB 3.34Å; I678-C682 WeakPolarHBondContact O-CB 3.47Å; I678-C682 PolarHBondContact O-N 3.25Å; I678-C682 PolarHBondContact O-SG 3.45Å; D680-C682 PolarHBondContact O-N 2.98Å; C682-A686 VanDerWaalsContact O-CB 3.26Å; C682-A686 WeakPolarHBondContact O-CB 3.36Å; C682-A686 PolarHBondContact O-N 2.87Å; C682-I710 HydrophobicContact CB-CD1 4.32Å |
| 683 | S | 68.5 | Low | 59.5 | Low | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.1 | -35 | 174.9 | 73.6 | 0 | 0 | 0 | 0 | 113.2 | A679 D680 V681 T687 | A679-S683 WeakPolarHBondContact O-CB 3.37Å; A679-S683 PolarHBondContact O-N 3.02Å; A679-S683 PolarHBondContact O-OG 3.1Å; D680-S683 PolarHBondContact O-N 2.87Å; D680-S683 PolarHBondContact O-OG 3.27Å; V681-S683 VanDerWaalsContact C-N 3.3Å; V681-S683 PolarHBondContact O-N 2.86Å; S683-T687 WeakPolarHBondContact O-CB 3.14Å; S683-T687 PolarHBondContact O-N 3.2Å; S683-T687 VanDerWaalsContact O-N 3.1Å; S683-T687 PolarHBondContact O-OG1 3.35Å |
| 684 | I | 63.8 | Low | 58 | Low | 17 Ų | 17 | 48.7 Ų | 48.7 | 9% | 0.087 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.9 | -52.3 | 176.5 | -64 | 165.3 | 0 | 0 | 0 | 109.2 | L572 Q619 D680 V681 A686 T687 E688 | L572-I684 HydrophobicContact CD1-CD1 3.98Å; L572-I684 HydrophobicContact CD1-CG2 3.98Å; L572-I684 HydrophobicContact CD2-CD1 3.75Å; Q619-I684 HydrophobicContact CG-CG1 4.44Å; D680-I684 PolarHBondContact O-N 3.16Å; V681-I684 PolarHBondContact O-N 3.02Å; I684-A686 VanDerWaalsContact C-N 3.31Å; I684-A686 PolarHBondContact O-N 3.11Å; I684-T687 PolarHBondContact O-N 3.47Å; I684-E688 PolarHBondContact O-N 3.03Å; I684-E688 VanDerWaalsContact O-N 3.16Å |
| 685 | V | 58.3 | Low | 56.3 | Low | 13 Ų | 13 | 52.7 Ų | 52.7 | 8% | 0.079 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -57.8 | -41.9 | 179.1 | 174.6 | 0 | 0 | 0 | 0 | 111.7 | V681 T687 L689 L713 | V681-V685 PolarHBondContact O-N 3.46Å; V685-T687 PolarHBondContact O-N 3.26Å; V685-L689 HydrophobicContact CG1-CD1 3.66Å; V685-L689 HydrophobicContact CG1-CG 4.38Å; V685-L689 WeakPolarHBondContact O-CB 3.16Å; V685-L689 WeakPolarHBondContact O-CG 3.48Å; V685-L689 PolarHBondContact O-N 2.87Å; V685-L689 VanDerWaalsContact O-N 3.16Å; V685-L713 HydrophobicContact CG1-CD1 4.09Å |
| 686 | A | 57 | Low | 54.8 | Low | 4 Ų | 4 | 61.7 Ų | 61.7 | 3% | 0.033 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -71.3 | -24.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y622 C682 I684 I690 L706 | Y622-A686 HydrophobicContact CD1-CB 4.32Å; C682-A686 VanDerWaalsContact O-CB 3.26Å; C682-A686 WeakPolarHBondContact O-CB 3.36Å; C682-A686 PolarHBondContact O-N 2.87Å; I684-A686 VanDerWaalsContact C-N 3.31Å; I684-A686 PolarHBondContact O-N 3.11Å; A686-I690 WeakPolarHBondContact O-CG1 3.39Å; A686-L706 HydrophobicContact CB-CD2 4.35Å |
| 687 | T | 60.6 | Low | 52.7 | Low | 40 Ų | 40 | 64.7 Ų | 64.7 | 25% | 0.245 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -80.1 | -39 | 178.4 | -52.7 | 0 | 0 | 0 | 0 | 111.2 | Q619 S683 I684 V685 G691 | Q619-T687 WeakPolarHBondContact CA-OG1 3.25Å; S683-T687 WeakPolarHBondContact O-CB 3.14Å; S683-T687 PolarHBondContact O-N 3.2Å; S683-T687 VanDerWaalsContact O-N 3.1Å; S683-T687 PolarHBondContact O-OG1 3.35Å; I684-T687 PolarHBondContact O-N 3.47Å; V685-T687 PolarHBondContact O-N 3.26Å; T687-G691 PolarHBondContact O-N 2.68Å |
| 688 | E | 57.7 | Low | 50.8 | Low | 105 Ų | 105 | 64.1 Ų | 64.1 | 49% | 0.491 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -79.7 | -39.7 | -177.9 | -64.6 | -64.8 | 162 | 0 | 0 | 113.2 | I566 I684 I690 G691 | I566-E688 HydrophobicContact CD1-CB 4.36Å; I566-E688 HydrophobicContact CD1-CG 4.08Å; I566-E688 HydrophobicContact CG2-CG 4.18Å; I684-E688 PolarHBondContact O-N 3.03Å; I684-E688 VanDerWaalsContact O-N 3.16Å; E688-I690 PolarHBondContact O-N 3.44Å; E688-I690 VanDerWaalsContact O-N 3.13Å; E688-G691 PolarHBondContact O-N 2.72Å |
| 689 | L | 50.3 | Low | 49.3 | Very low | 102 Ų | 102 | 72 Ų | 72 | 53% | 0.534 | 42% | 0.42 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.3 | -9 | 177.4 | -69.7 | 176.4 | 0 | 0 | 0 | 114 | V685 L709 | V685-L689 HydrophobicContact CG1-CD1 3.66Å; V685-L689 HydrophobicContact CG1-CG 4.38Å; V685-L689 WeakPolarHBondContact O-CB 3.16Å; V685-L689 WeakPolarHBondContact O-CG 3.48Å; V685-L689 PolarHBondContact O-N 2.87Å; V685-L689 VanDerWaalsContact O-N 3.16Å; L689-L709 HydrophobicContact CD1-CD2 3.84Å |
| 690 | I | 51.5 | Low | 47.4 | Very low | 81 Ų | 81 | 80.1 Ų | 80.1 | 42% | 0.415 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -128.8 | 31.9 | -178.9 | -38.9 | 178.7 | 0 | 0 | 0 | 109.6 | A686 E688 | A686-I690 WeakPolarHBondContact O-CG1 3.39Å; E688-I690 PolarHBondContact O-N 3.44Å; E688-I690 VanDerWaalsContact O-N 3.13Å |
| 691 | G | 42.5 | Very low | 45.4 | Very low | 29 Ų | 29 | 87.4 Ų | 87.4 | 30% | 0.299 | 49% | 0.488 | S | S | . | . | trans | -53.3 | 151.8 | -170.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | T687 E688 | T687-G691 PolarHBondContact O-N 2.68Å; E688-G691 PolarHBondContact O-N 2.72Å | ||
| 692 | S | 37.3 | Very low | 44 | Very low | 101 Ų | 101 | 93.9 Ų | 93.9 | 71% | 0.706 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | 148 | 179.9 | 47.4 | 0 | 0 | 0 | 0 | 113 | ||
| 693 | D | 33.4 | Very low | 43 | Very low | 158 Ų | 158 | 95.6 Ų | 95.6 | 85% | 0.845 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75.8 | 33.5 | 173.7 | -57 | -20.9 | 0 | 0 | 0 | 117.6 | ||
| 694 | T | 36.7 | Very low | 41.7 | Very low | 113 Ų | 113 | 101.4 Ų | 101.4 | 69% | 0.693 | 58% | 0.582 | S | S | * | * | P | Polyproline II helix | trans | -93.8 | 125.8 | 158.7 | 50.2 | 0 | 0 | 0 | 0 | 111.7 | ||
| 695 | A | 29 | Very low | 40.8 | Very low | 94 Ų | 94 | 104.4 Ų | 104.4 | 78% | 0.777 | 60% | 0.598 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 149.7 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | P697 | A695-P697 VanDerWaalsContact O-CD 3.24Å; A695-P697 WeakPolarHBondContact O-CD 3.25Å |
| 696 | K | 33.8 | Very low | 40.4 | Very low | 211 Ų | 211 | 106.1 Ų | 106.1 | 92% | 0.917 | 61% | 0.607 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 124.6 | -175.8 | -67.9 | -179.7 | 177.8 | 178.7 | 0 | 114.4 | ||
| 697 | P | 28.8 | Very low | 40 | Very low | 128 Ų | 128 | 109 Ų | 109 | 83% | 0.831 | 62% | 0.62 | S | S | * | * | P | Polyproline II helix | trans | -95.1 | 161.6 | 150.5 | 3.6 | 19.1 | 0 | 0 | 0 | 110.3 | A695 | A695-P697 VanDerWaalsContact O-CD 3.24Å; A695-P697 WeakPolarHBondContact O-CD 3.25Å |
| 698 | G | 29.3 | Very low | 39.4 | Very low | 70 Ų | 70 | 110.2 Ų | 110.2 | 72% | 0.722 | 63% | 0.627 | S | S | * | * | trans | -137.9 | 137 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 699 | K | 30.5 | Very low | 39 | Very low | 191 Ų | 191 | 108.3 Ų | 108.3 | 83% | 0.83 | 62% | 0.62 | S | S | * | * | S | Bend | trans | 64.9 | 140.1 | -173.1 | -57.3 | -175 | 175.1 | -173.8 | 0 | 114 | ||
| 700 | H | 28.7 | Very low | 39.1 | Very low | 172 Ų | 172 | 104.8 Ų | 104.8 | 80% | 0.796 | 60% | 0.601 | S | S | * | * | S | Bend | trans | 63.9 | 53.9 | 179.3 | -47.2 | -81.8 | 0 | 0 | 0 | 116.5 | ||
| 701 | F | 29.6 | Very low | 39.1 | Very low | 189 Ų | 189 | 102.7 Ų | 102.7 | 83% | 0.829 | 59% | 0.591 | S | S | * | * | trans | -163.2 | 104.9 | 143.3 | -99.4 | -62.3 | 0 | 0 | 0 | 110.1 | ||||
| 702 | T | 34.1 | Very low | 39.5 | Very low | 143 Ų | 143 | 103.1 Ų | 103.1 | 88% | 0.877 | 59% | 0.586 | S | S | * | * | trans | -148.2 | 102.4 | 175.7 | 48 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 703 | G | 40.9 | Very low | 40.2 | Very low | 47 Ų | 47 | 101 Ų | 101 | 49% | 0.485 | 57% | 0.567 | S | S | . | * | trans | 174.8 | -8.6 | -176.3 | 0 | 0 | 0 | 0 | 0 | 119 | N705 | G703-N705 PolarHBondContact O-N 3.27Š| ||
| 704 | V | 41.2 | Very low | 41.3 | Very low | 121 Ų | 121 | 94.2 Ų | 94.2 | 73% | 0.733 | 53% | 0.531 | S | S | * | . | trans | -69.9 | 94 | 177.1 | -176.9 | 0 | 0 | 0 | 0 | 109.8 | L706 L709 | V704-L706 PolarHBondContact O-N 3.19Å; V704-L709 HydrophobicContact CG1-CD1 4.39Å | ||
| 705 | N | 46.7 | Very low | 41.9 | Very low | 80 Ų | 80 | 93.2 Ų | 93.2 | 43% | 0.428 | 52% | 0.517 | S | S | . | . | trans | -73.6 | 99.9 | 174 | -170.5 | 1.2 | 0 | 0 | 0 | 109.9 | G703 E707 T708 L709 | G703-N705 PolarHBondContact O-N 3.27Å; N705-E707 PolarHBondContact O-N 2.97Å; N705-E707 WeakPolarHBondContact OD1-CB 3.27Å; N705-E707 PolarHBondContact OD1-N 3.46Å; N705-T708 PolarHBondContact ND2-OG1 3.13Å; N705-T708 WeakPolarHBondContact O-CB 3.32Å; N705-T708 PolarHBondContact O-N 3.16Å; N705-T708 VanDerWaalsContact O-N 3.11Å; N705-L709 PolarHBondContact O-N 3.39Å; N705-L709 VanDerWaalsContact O-N 3.08Å | ||
| 706 | L | 48.5 | Very low | 43 | Very low | 49 Ų | 49 | 89.9 Ų | 89.9 | 26% | 0.257 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -56.2 | -30.2 | 176.9 | -166 | 72.7 | 0 | 0 | 0 | 112 | A686 V704 L709 I710 | A686-L706 HydrophobicContact CB-CD2 4.35Å; V704-L706 PolarHBondContact O-N 3.19Å; L706-L709 PolarHBondContact O-N 2.94Å; L706-I710 HydrophobicContact CD2-CD1 4.3Å; L706-I710 HydrophobicContact CG-CD1 3.92Å; L706-I710 HydrophobicContact CG-CG1 4.46Å; L706-I710 WeakPolarHBondContact O-CB 3.18Å; L706-I710 VanDerWaalsContact O-CG1 3.25Å; L706-I710 WeakPolarHBondContact O-CG1 3.35Å; L706-I710 PolarHBondContact O-N 2.92Å |
| 707 | E | 48.3 | Very low | 43.8 | Very low | 64 Ų | 64 | 80.6 Ų | 80.6 | 30% | 0.299 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -65.9 | -45.7 | 177 | -159.1 | 169.7 | -128.1 | 0 | 0 | 111.3 | N705 M711 | N705-E707 PolarHBondContact O-N 2.97Å; N705-E707 WeakPolarHBondContact OD1-CB 3.27Å; N705-E707 PolarHBondContact OD1-N 3.46Å; E707-M711 VanDerWaalsContact O-CB 3.28Å; E707-M711 WeakPolarHBondContact O-CB 3.21Å; E707-M711 VanDerWaalsContact O-CG 3.28Å; E707-M711 WeakPolarHBondContact O-CG 3.34Å; E707-M711 PolarHBondContact O-N 3.17Å |
| 708 | T | 48 | Very low | 44.8 | Very low | 66 Ų | 66 | 76.2 Ų | 76.2 | 41% | 0.405 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -62.9 | -43.3 | 173.1 | -52.8 | 0 | 0 | 0 | 0 | 111.6 | N705 M711 N712 | N705-T708 PolarHBondContact ND2-OG1 3.13Å; N705-T708 WeakPolarHBondContact O-CB 3.32Å; N705-T708 PolarHBondContact O-N 3.16Å; N705-T708 VanDerWaalsContact O-N 3.11Å; T708-M711 PolarHBondContact O-N 3.42Å; T708-N712 WeakPolarHBondContact O-CB 3.45Å; T708-N712 PolarHBondContact O-N 3.08Å |
| 709 | L | 49.3 | Very low | 45.6 | Very low | 65 Ų | 65 | 78.7 Ų | 78.7 | 34% | 0.34 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -67.6 | -41.1 | -177.9 | -165.8 | 148.9 | 0 | 0 | 0 | 111.6 | L689 V704 N705 L706 L713 | L689-L709 HydrophobicContact CD1-CD2 3.84Å; V704-L709 HydrophobicContact CG1-CD1 4.39Å; N705-L709 PolarHBondContact O-N 3.39Å; N705-L709 VanDerWaalsContact O-N 3.08Å; L706-L709 PolarHBondContact O-N 2.94Å; L709-L713 HydrophobicContact CD2-CD1 4.04Å; L709-L713 PolarHBondContact O-N 3.48Å |
| 710 | I | 53.3 | Low | 46.2 | Very low | 28 Ų | 28 | 75.1 Ų | 75.1 | 14% | 0.144 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -65.4 | -44.5 | 171.6 | -71.4 | 169.6 | 0 | 0 | 0 | 110.9 | C682 L706 N712 L713 V714 | C682-I710 HydrophobicContact CB-CD1 4.32Å; L706-I710 HydrophobicContact CD2-CD1 4.3Å; L706-I710 HydrophobicContact CG-CD1 3.92Å; L706-I710 HydrophobicContact CG-CG1 4.46Å; L706-I710 WeakPolarHBondContact O-CB 3.18Å; L706-I710 VanDerWaalsContact O-CG1 3.25Å; L706-I710 WeakPolarHBondContact O-CG1 3.35Å; L706-I710 PolarHBondContact O-N 2.92Å; I710-N712 VanDerWaalsContact C-N 3.32Å; I710-N712 PolarHBondContact O-N 3.46Å; I710-L713 WeakPolarHBondContact O-CB 3.33Å; I710-L713 PolarHBondContact O-N 3.32Å; I710-V714 HydrophobicContact CG2-CG2 4.45Å; I710-V714 WeakPolarHBondContact O-CG2 3.4Å; I710-V714 PolarHBondContact O-N 2.7Å |
| 711 | M | 52.1 | Low | 46.9 | Very low | 38 Ų | 38 | 70.6 Ų | 70.6 | 19% | 0.187 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62.5 | -36.7 | 178.5 | -81.1 | -70.2 | -81.1 | 0 | 0 | 112.8 | I600 E707 T708 V714 K715 | I600-M711 HydrophobicContact CB-SD 3.79Å; I600-M711 HydrophobicContact CD1-SD 3.85Å; I600-M711 HydrophobicContact CG1-SD 4.4Å; I600-M711 HydrophobicContact CG2-CG 4.04Å; I600-M711 HydrophobicContact CG2-SD 3.63Å; E707-M711 VanDerWaalsContact O-CB 3.28Å; E707-M711 WeakPolarHBondContact O-CB 3.21Å; E707-M711 VanDerWaalsContact O-CG 3.28Å; E707-M711 WeakPolarHBondContact O-CG 3.34Å; E707-M711 PolarHBondContact O-N 3.17Å; T708-M711 PolarHBondContact O-N 3.42Å; M711-V714 PolarHBondContact O-N 3.43Å; M711-K715 VanDerWaalsContact O-CG 3.3Å; M711-K715 WeakPolarHBondContact O-CG 3.31Å; M711-K715 PolarHBondContact O-N 2.83Å |
| 712 | N | 50 | Low | 47.2 | Very low | 37 Ų | 37 | 65.8 Ų | 65.8 | 20% | 0.198 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -74 | -36.1 | 176.2 | -71.1 | -7.7 | 0 | 0 | 0 | 112 | T708 I710 V714 K715 G716 | T708-N712 WeakPolarHBondContact O-CB 3.45Å; T708-N712 PolarHBondContact O-N 3.08Å; I710-N712 VanDerWaalsContact C-N 3.32Å; I710-N712 PolarHBondContact O-N 3.46Å; N712-V714 VanDerWaalsContact C-N 3.34Å; N712-V714 PolarHBondContact O-N 3.26Å; N712-K715 PolarHBondContact O-N 2.86Å; N712-K715 PolarHBondContact OD1-NZ 2.8Å; N712-G716 PolarHBondContact O-N 3.25Å |
| 713 | L | 52.6 | Low | 47.5 | Very low | 58 Ų | 58 | 61.6 Ų | 61.6 | 30% | 0.304 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -58.2 | -43.1 | 167.3 | -97.9 | 164.2 | 0 | 0 | 0 | 112.3 | F563 V685 L709 I710 G716 A717 | F563-L713 HydrophobicContact CE2-CD2 4.41Å; F563-L713 HydrophobicContact CZ-CD2 4.06Å; V685-L713 HydrophobicContact CG1-CD1 4.09Å; L709-L713 HydrophobicContact CD2-CD1 4.04Å; L709-L713 PolarHBondContact O-N 3.48Å; I710-L713 WeakPolarHBondContact O-CB 3.33Å; I710-L713 PolarHBondContact O-N 3.32Å; L713-G716 PolarHBondContact O-N 2.86Å; L713-A717 PolarHBondContact O-N 2.76Å |
| 714 | V | 55 | Low | 47.8 | Very low | 15 Ų | 15 | 61 Ų | 61 | 9% | 0.091 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64.4 | -47.9 | 175.7 | 168.3 | 0 | 0 | 0 | 0 | 110.9 | I580 I710 M711 N712 G716 A717 V718 | I580-V714 HydrophobicContact CD1-CG1 4.07Å; I710-V714 HydrophobicContact CG2-CG2 4.45Å; I710-V714 WeakPolarHBondContact O-CG2 3.4Å; I710-V714 PolarHBondContact O-N 2.7Å; M711-V714 PolarHBondContact O-N 3.43Å; N712-V714 VanDerWaalsContact C-N 3.34Å; N712-V714 PolarHBondContact O-N 3.26Å; V714-G716 VanDerWaalsContact C-N 3.34Å; V714-G716 PolarHBondContact O-N 3.45Å; V714-A717 PolarHBondContact O-N 3.19Å; V714-A717 VanDerWaalsContact O-N 3.1Å; V714-V718 HydrophobicContact CG1-CG2 4.33Å; V714-V718 VanDerWaalsContact O-CG2 3.25Å; V714-V718 WeakPolarHBondContact O-CG2 3.46Å; V714-V718 PolarHBondContact O-N 3.45Å |
| 715 | K | 49.8 | Very low | 48.1 | Very low | 92 Ų | 92 | 56.5 Ų | 56.5 | 40% | 0.4 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -56.6 | -45.8 | 175.7 | -71.1 | 168.3 | -169.4 | 166 | 0 | 112 | M711 N712 A717 V718 Y719 L723 | M711-K715 VanDerWaalsContact O-CG 3.3Å; M711-K715 WeakPolarHBondContact O-CG 3.31Å; M711-K715 PolarHBondContact O-N 2.83Å; N712-K715 PolarHBondContact O-N 2.86Å; N712-K715 PolarHBondContact OD1-NZ 2.8Å; K715-A717 VanDerWaalsContact C-N 3.28Å; K715-A717 PolarHBondContact O-N 3.33Å; K715-V718 PolarHBondContact O-N 2.83Å; K715-V718 VanDerWaalsContact O-N 3.13Å; K715-Y719 WeakPolarHBondContact O-CD2 3.44Å; K715-Y719 PolarHBondContact O-N 2.68Å; K715-Y719 VanDerWaalsContact O-N 3.16Å; K715-L723 HydrophobicContact CB-CD1 4.41Å |
| 716 | G | 52.2 | Low | 48 | Very low | 24 Ų | 24 | 59.5 Ų | 59.5 | 25% | 0.247 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63 | -31.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | N712 L713 V714 | N712-G716 PolarHBondContact O-N 3.25Å; L713-G716 PolarHBondContact O-N 2.86Å; V714-G716 VanDerWaalsContact C-N 3.34Å; V714-G716 PolarHBondContact O-N 3.45Å |
| 717 | A | 51.9 | Low | 48.2 | Very low | 15 Ų | 15 | 58.3 Ų | 58.3 | 12% | 0.124 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -74.9 | -29.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | L576 R577 I580 L713 V714 K715 | L576-A717 HydrophobicContact CD2-CB 4.02Å; L576-A717 HydrophobicContact CG-CB 4.32Å; R577-A717 HydrophobicContact CG-CB 4.4Å; I580-A717 HydrophobicContact CD1-CB 3.97Å; L713-A717 PolarHBondContact O-N 2.76Å; V714-A717 PolarHBondContact O-N 3.19Å; V714-A717 VanDerWaalsContact O-N 3.1Å; K715-A717 VanDerWaalsContact C-N 3.28Å; K715-A717 PolarHBondContact O-N 3.33Å |
| 718 | V | 48.5 | Very low | 48.8 | Very low | 37 Ų | 37 | 57.8 Ų | 57.8 | 22% | 0.224 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -74.6 | -47.1 | -179.7 | 174.6 | 0 | 0 | 0 | 0 | 112.7 | I580 Y584 F593 V714 K715 | I580-V718 HydrophobicContact CD1-CG2 4.18Å; I580-V718 HydrophobicContact CG2-CB 4.45Å; I580-V718 HydrophobicContact CG2-CG2 3.61Å; Y584-V718 HydrophobicContact CE2-CG1 3.89Å; Y584-V718 HydrophobicContact CE2-CG2 4.35Å; F593-V718 HydrophobicContact CE1-CG1 3.96Å; F593-V718 HydrophobicContact CZ-CG1 3.63Å; V714-V718 HydrophobicContact CG1-CG2 4.33Å; V714-V718 VanDerWaalsContact O-CG2 3.25Å; V714-V718 WeakPolarHBondContact O-CG2 3.46Å; V714-V718 PolarHBondContact O-N 3.45Å; K715-V718 PolarHBondContact O-N 2.83Å; K715-V718 VanDerWaalsContact O-N 3.13Å |
| 719 | Y | 45.7 | Very low | 49.6 | Very low | 122 Ų | 122 | 54.9 Ų | 54.9 | 48% | 0.478 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -97.2 | -4.8 | -161.9 | -77.2 | -72.7 | 0 | 0 | 0 | 115.8 | F593 K715 T721 L723 | F593-Y719 HydrophobicContact CD1-CE2 4.49Å; F593-Y719 HydrophobicContact CE1-CD2 4.39Å; F593-Y719 HydrophobicContact CE1-CE1 4.31Å; F593-Y719 AromaticContact CE1-CE2 3.48Å; F593-Y719 HydrophobicContact CE1-CE2 3.48Å; F593-Y719 VanDerWaalsContact CE1-CE2 3.48Å; F593-Y719 AromaticContact CE1-CZ 3.46Å; F593-Y719 VanDerWaalsContact CE1-CZ 3.46Å; F593-Y719 WeakPolarHBondContact CE1-OH 3.34Å; F593-Y719 AromaticContact CE2-CE1 3.98Å; F593-Y719 HydrophobicContact CE2-CE1 3.98Å; F593-Y719 AromaticContact CE2-CZ 3.75Å; F593-Y719 WeakPolarHBondContact CE2-OH 3.28Å; F593-Y719 HydrophobicContact CZ-CD1 4.3Å; F593-Y719 HydrophobicContact CZ-CD2 4.32Å; F593-Y719 AromaticContact CZ-CE1 3.51Å; F593-Y719 HydrophobicContact CZ-CE1 3.51Å; F593-Y719 AromaticContact CZ-CE2 3.53Å; F593-Y719 HydrophobicContact CZ-CE2 3.53Å; F593-Y719 AromaticContact CZ-CZ 3.08Å; F593-Y719 WeakPolarHBondContact CZ-OH 3.28Å; K715-Y719 WeakPolarHBondContact O-CD2 3.44Å; K715-Y719 PolarHBondContact O-N 2.68Å; K715-Y719 VanDerWaalsContact O-N 3.16Å; Y719-T721 WeakPolarHBondContact CB-OG1 3.46Å; Y719-T721 PolarHBondContact O-N 2.97Å; Y719-T721 VanDerWaalsContact O-N 3.07Å; Y719-L723 HydrophobicContact CD2-CD1 3.77Å; Y719-L723 HydrophobicContact CG-CD1 4.16Å |
| 720 | D | 43.6 | Very low | 50.3 | Low | 115 Ų | 115 | 53.7 Ų | 53.7 | 62% | 0.615 | 30% | 0.295 | S | S | * | . | trans | 48 | 34.4 | -177.3 | -136.7 | -10.4 | 0 | 0 | 0 | 115.1 | R577 | R577-D720 IonicContact CZ-OD1 3.38Å; R577-D720 IonicContact CZ-OD2 3.45Å; R577-D720 IonicContact NH1-OD1 2.7Å; R577-D720 PolarHBondContact NH1-OD1 2.69Å; R577-D720 IonicContact NH1-OD2 2.66Å; R577-D720 PolarHBondContact NH1-OD2 3.37Å; R577-D720 VanDerWaalsContact NH2-CG 3.31Å; R577-D720 IonicContact NH2-OD1 3.69Å; R577-D720 PolarHBondContact NH2-OD1 3.21Å; R577-D720 IonicContact NH2-OD2 2.69Å | ||
| 721 | T | 42.9 | Very low | 50.7 | Low | 77 Ų | 77 | 54 Ų | 54 | 47% | 0.472 | 30% | 0.304 | S | S | . | . | S | Bend | trans | -120 | 159 | 178.1 | 40.2 | 0 | 0 | 0 | 0 | 110.7 | Y719 L723 | Y719-T721 WeakPolarHBondContact CB-OG1 3.46Å; Y719-T721 PolarHBondContact O-N 2.97Å; Y719-T721 VanDerWaalsContact O-N 3.07Å; T721-L723 PolarHBondContact O-N 3.45Å; T721-L723 WeakPolarHBondContact OG1-CD1 3.43Å |
| 722 | P | 36 | Very low | 51.3 | Low | 88 Ų | 88 | 54.3 Ų | 54.3 | 57% | 0.571 | 31% | 0.307 | S | S | * | . | trans | -70.8 | 61.4 | 180 | -19 | 34.4 | 0 | 0 | 0 | 114.1 | A724 | P722-A724 PolarHBondContact O-N 3.14Š| ||
| 723 | L | 41.4 | Very low | 52.2 | Low | 56 Ų | 56 | 52.6 Ų | 52.6 | 29% | 0.293 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | 28.8 | -172.6 | -86.8 | 167.3 | 0 | 0 | 0 | 115.2 | K715 Y719 T721 N725 | K715-L723 HydrophobicContact CB-CD1 4.41Å; Y719-L723 HydrophobicContact CD2-CD1 3.77Å; Y719-L723 HydrophobicContact CG-CD1 4.16Å; T721-L723 PolarHBondContact O-N 3.45Å; T721-L723 WeakPolarHBondContact OG1-CD1 3.43Å; L723-N725 PolarHBondContact O-N 2.85Å |
| 724 | A | 47.9 | Very low | 52.8 | Low | 33 Ų | 33 | 53.3 Ų | 53.3 | 27% | 0.273 | 31% | 0.312 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.3 | -10.9 | 165.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | P722 V728 | P722-A724 PolarHBondContact O-N 3.14Å; A724-V728 WeakPolarHBondContact O-CG2 3.45Å |
| 725 | N | 46.3 | Very low | 53.1 | Low | 28 Ų | 28 | 54.4 Ų | 54.4 | 15% | 0.15 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -123.6 | 18.8 | -155.2 | -69 | 27 | 0 | 0 | 0 | 115.3 | L723 S763 G764 A765 | L723-N725 PolarHBondContact O-N 2.85Å; N725-S763 PolarHBondContact ND2-O 3.29Å; N725-S763 PolarHBondContact OD1-O 3.03Å; N725-G764 PolarHBondContact ND2-O 3.25Å; N725-A765 HydrophobicContact CB-CB 3.7Å; N725-A765 WeakPolarHBondContact ND2-CA 3.1Å; N725-A765 PolarHBondContact ND2-N 3.44Å |
| 726 | R | 44.7 | Very low | 53.5 | Low | 142 Ų | 142 | 52.4 Ų | 52.4 | 54% | 0.536 | 32% | 0.323 | S | S | . | . | S | Bend | trans | -132.7 | 131.6 | 165 | -79.6 | -168.1 | -177.9 | 173.9 | 0.7 | 110.4 | V728 E769 E773 | R726-V728 VanDerWaalsContact C-N 3.3Å; R726-E769 IonicContact CZ-OE1 2.72Å; R726-E769 IonicContact CZ-OE2 2.86Å; R726-E769 IonicContact NE-OE2 3.31Å; R726-E769 PolarHBondContact NE-OE2 3.02Å; R726-E769 IonicContact NH2-OE1 3.03Å; R726-E769 PolarHBondContact NH2-OE1 3.19Å; R726-E769 IonicContact NH2-OE2 3.45Å; R726-E769 PolarHBondContact NH2-OE2 2.85Å; R726-E773 VanDerWaalsContact CA-OE1 3.23Å; R726-E773 WeakPolarHBondContact CA-OE1 3.32Å; R726-E773 VanDerWaalsContact CB-OE1 3.31Å; R726-E773 WeakPolarHBondContact CB-OE1 3.35Å |
| 727 | G | 53.2 | Low | 54.1 | Low | 25 Ų | 25 | 54.4 Ų | 54.4 | 26% | 0.258 | 34% | 0.343 | S | S | . | . | S | Bend | trans | 77.6 | 3.3 | -175.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | G731 E773 | G727-G731 PolarHBondContact O-N 3.3Å; G727-E773 WeakPolarHBondContact CA-OE2 3.31Å; G727-E773 PolarHBondContact N-OE1 3.4Å; G727-E773 PolarHBondContact N-OE2 3.4Å |
| 728 | V | 59.9 | Low | 54.9 | Low | 52 Ų | 52 | 55.2 Ų | 55.2 | 32% | 0.315 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -84.6 | -33.9 | -179.1 | 165.2 | 0 | 0 | 0 | 0 | 112.1 | A724 R726 L732 | A724-V728 WeakPolarHBondContact O-CG2 3.45Å; R726-V728 VanDerWaalsContact C-N 3.3Å; V728-L732 HydrophobicContact CG1-CD1 4.09Å; V728-L732 WeakPolarHBondContact O-CB 3.23Å; V728-L732 WeakPolarHBondContact O-CG 3.48Å; V728-L732 PolarHBondContact O-N 2.67Å |
| 729 | L | 64.9 | Low | 56.4 | Low | 6 Ų | 6 | 54.7 Ų | 54.7 | 3% | 0.031 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -76.1 | -44.5 | 178.4 | -75.2 | 172.2 | 0 | 0 | 0 | 112.5 | G731 L732 L733 L760 A770 L774 | L729-G731 VanDerWaalsContact C-N 3.28Å; L729-G731 PolarHBondContact O-N 3.33Å; L729-L732 HydrophobicContact CD2-CD1 4.37Å; L729-L732 PolarHBondContact O-N 3.38Å; L729-L733 WeakPolarHBondContact O-CB 3.43Å; L729-L733 PolarHBondContact O-N 3.37Å; L729-L760 HydrophobicContact CD2-CD1 4.25Å; L729-L760 HydrophobicContact CD2-CD2 4.33Å; L729-L760 HydrophobicContact CD2-CG 3.76Å; L729-A770 HydrophobicContact CD1-CB 3.51Å; L729-L774 HydrophobicContact CB-CD2 3.89Å; L729-L774 HydrophobicContact CB-CG 3.98Å; L729-L774 HydrophobicContact CD1-CD1 4.23Å; L729-L774 HydrophobicContact CD1-CG 4.41Å |
| 730 | S | 64 | Low | 58.2 | Low | 39 Ų | 39 | 50.8 Ų | 50.8 | 27% | 0.273 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -63.3 | -34.9 | 169.2 | 51.5 | 0 | 0 | 0 | 0 | 112.1 | L733 A734 | S730-L733 PolarHBondContact O-N 3.06Å; S730-A734 WeakPolarHBondContact O-CB 3.39Å; S730-A734 PolarHBondContact O-N 2.91Å |
| 731 | G | 62.1 | Low | 60 | Low | 34 Ų | 34 | 53.6 Ų | 53.6 | 35% | 0.351 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -64.5 | -41.6 | 171.3 | 0 | 0 | 0 | 0 | 0 | 114 | G727 L729 A735 | G727-G731 PolarHBondContact O-N 3.3Å; L729-G731 VanDerWaalsContact C-N 3.28Å; L729-G731 PolarHBondContact O-N 3.33Å; G731-A735 VanDerWaalsContact O-CB 3.25Å; G731-A735 WeakPolarHBondContact O-CB 3.45Å; G731-A735 PolarHBondContact O-N 3.5Å |
| 732 | L | 64 | Low | 61.8 | Low | 46 Ų | 46 | 50.5 Ų | 50.5 | 24% | 0.241 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -64.7 | -44.4 | 173 | -86.9 | 162 | 0 | 0 | 0 | 111.4 | L551 V728 L729 A735 A736 L746 | L551-L732 HydrophobicContact CD2-CD1 4.03Å; V728-L732 HydrophobicContact CG1-CD1 4.09Å; V728-L732 WeakPolarHBondContact O-CB 3.23Å; V728-L732 WeakPolarHBondContact O-CG 3.48Å; V728-L732 PolarHBondContact O-N 2.67Å; L729-L732 HydrophobicContact CD2-CD1 4.37Å; L729-L732 PolarHBondContact O-N 3.38Å; L732-A735 CarbonylContact O-C 3.59Å; L732-A735 PolarHBondContact O-N 2.89Å; L732-A736 WeakPolarHBondContact O-CB 3.49Å; L732-A736 PolarHBondContact O-N 3.03Å; L732-L746 HydrophobicContact CB-CD1 4.2Å; L732-L746 HydrophobicContact CD2-CD2 4.44Å |
| 733 | L | 69.1 | Low | 64 | Low | 1 Ų | 1 | 46.3 Ų | 46.3 | 1% | 0.005 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.2 | -48.4 | 178.4 | -178.1 | 52.7 | 0 | 0 | 0 | 111.4 | L729 S730 A735 A736 G737 G738 A742 L743 L746 L774 G777 L778 | L729-L733 WeakPolarHBondContact O-CB 3.43Å; L729-L733 PolarHBondContact O-N 3.37Å; S730-L733 PolarHBondContact O-N 3.06Å; L733-A735 VanDerWaalsContact C-N 3.34Å; L733-A735 PolarHBondContact O-N 3.41Å; L733-A736 PolarHBondContact O-N 3.37Å; L733-G737 PolarHBondContact O-N 3.07Å; L733-G737 VanDerWaalsContact O-N 3.11Å; L733-G738 PolarHBondContact O-N 2.75Å; L733-A742 HydrophobicContact CD1-CB 3.86Å; L733-L743 HydrophobicContact CD1-CB 3.69Å; L733-L746 HydrophobicContact CB-CD1 4.42Å; L733-L746 HydrophobicContact CD1-CD1 4.45Å; L733-L774 HydrophobicContact CD2-CD2 4.15Å; L733-G777 VanDerWaalsContact CD2-O 3.31Å; L733-G777 WeakPolarHBondContact CD2-O 3.47Å; L733-L778 HydrophobicContact CD2-CD2 4.14Å; L733-L778 HydrophobicContact CD2-CG 4.36Å |
| 734 | A | 65.7 | Low | 66 | Low | 72 Ų | 72 | 46.8 Ų | 46.8 | 60% | 0.595 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -62.6 | -38 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | S730 A736 G737 | S730-A734 WeakPolarHBondContact O-CB 3.39Å; S730-A734 PolarHBondContact O-N 2.91Å; A734-A736 VanDerWaalsContact C-N 3.32Å; A734-G737 PolarHBondContact O-N 2.92Å |
| 735 | A | 61.3 | Low | 67.5 | Low | 39 Ų | 39 | 47.5 Ų | 47.5 | 32% | 0.322 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -72.2 | -23.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | G731 L732 L733 | G731-A735 VanDerWaalsContact O-CB 3.25Å; G731-A735 WeakPolarHBondContact O-CB 3.45Å; G731-A735 PolarHBondContact O-N 3.5Å; L732-A735 CarbonylContact O-C 3.59Å; L732-A735 PolarHBondContact O-N 2.89Å; L733-A735 VanDerWaalsContact C-N 3.34Å; L733-A735 PolarHBondContact O-N 3.41Å |
| 736 | A | 59 | Low | 68.9 | Low | 50 Ų | 50 | 47.4 Ų | 47.4 | 41% | 0.413 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -84.5 | -14.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L732 L733 A734 A742 L746 | L732-A736 WeakPolarHBondContact O-CB 3.49Å; L732-A736 PolarHBondContact O-N 3.03Å; L733-A736 PolarHBondContact O-N 3.37Å; A734-A736 VanDerWaalsContact C-N 3.32Å; A736-A742 HydrophobicContact CB-CB 3.92Å; A736-L746 HydrophobicContact CB-CD1 3.97Å; A736-L746 HydrophobicContact CB-CD2 4.34Å; A736-L746 HydrophobicContact CB-CG 4.04Å |
| 737 | G | 64.9 | Low | 70.6 | Confident | 65 Ų | 65 | 40.7 Ų | 40.7 | 67% | 0.67 | 29% | 0.293 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 137.3 | -17.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | L733 A734 | L733-G737 PolarHBondContact O-N 3.07Å; L733-G737 VanDerWaalsContact O-N 3.11Å; A734-G737 PolarHBondContact O-N 2.92Å |
| 738 | G | 67.7 | Low | 71.8 | Confident | 33 Ų | 33 | 41.7 Ų | 41.7 | 34% | 0.34 | 30% | 0.303 | S | S | . | . | S | Bend | trans | 79.9 | 159.9 | -169.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | L733 A742 | L733-G738 PolarHBondContact O-N 2.75Å; G738-A742 WeakPolarHBondContact O-CB 3.39Å |
| 739 | G | 80.9 | Confident | 72.5 | Confident | 25 Ų | 25 | 43 Ų | 43 | 26% | 0.258 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | 70.8 | 178.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | E741 A742 L743 | G739-E741 PolarHBondContact O-N 3.39Å; G739-A742 PolarHBondContact O-N 3.44Å; G739-L743 PolarHBondContact O-N 2.91Å |
| 740 | I | 83.7 | Confident | 72.5 | Confident | 41 Ų | 41 | 44.3 Ų | 44.3 | 21% | 0.21 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -67.1 | -33.3 | -165.2 | -166.5 | 61.2 | 0 | 0 | 0 | 114.7 | A742 L743 M744 L778 Q788 L789 A792 | I740-A742 PolarHBondContact O-N 3.01Å; I740-L743 HydrophobicContact CD1-CD2 4.35Å; I740-L743 PolarHBondContact O-N 3.47Å; I740-M744 HydrophobicContact CG1-CG 4.5Å; I740-M744 WeakPolarHBondContact O-CG 3.3Å; I740-M744 PolarHBondContact O-N 3.25Å; I740-L778 HydrophobicContact CB-CD2 4.18Å; I740-L778 HydrophobicContact CD1-CD1 4.14Å; I740-L778 HydrophobicContact CD1-CD2 3.99Å; I740-Q788 HydrophobicContact CB-CB 4.38Å; I740-Q788 HydrophobicContact CD1-CB 4.46Å; I740-Q788 HydrophobicContact CG1-CB 4.36Å; I740-L789 HydrophobicContact CD1-CD1 4.17Å; I740-A792 HydrophobicContact CD1-CB 3.79Å; I740-A792 HydrophobicContact CG1-CB 3.7Å |
| 741 | E | 81.5 | Confident | 72.6 | Confident | 174 Ų | 174 | 44.7 Ų | 44.7 | 81% | 0.813 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -62.9 | -41.6 | 176.1 | -65.9 | -169.1 | 164.5 | 0 | 0 | 111.9 | G739 L743 M744 G745 | G739-E741 PolarHBondContact O-N 3.39Å; E741-L743 VanDerWaalsContact C-N 3.35Å; E741-M744 PolarHBondContact O-N 3.45Å; E741-G745 PolarHBondContact O-N 3.1Å |
| 742 | A | 80.3 | Confident | 73.2 | Confident | 12 Ų | 12 | 44.4 Ų | 44.4 | 10% | 0.099 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -66.1 | -38.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | L733 A736 G738 G739 I740 G745 L746 | L733-A742 HydrophobicContact CD1-CB 3.86Å; A736-A742 HydrophobicContact CB-CB 3.92Å; G738-A742 WeakPolarHBondContact O-CB 3.39Å; G739-A742 PolarHBondContact O-N 3.44Å; I740-A742 PolarHBondContact O-N 3.01Å; A742-G745 PolarHBondContact O-N 2.97Å; A742-L746 WeakPolarHBondContact O-CG 3.45Å; A742-L746 PolarHBondContact O-N 3.27Å |
| 743 | L | 82.7 | Confident | 74.1 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.9 | -43.2 | 174.5 | -175.7 | 52.6 | 0 | 0 | 0 | 111.9 | L733 G739 I740 E741 G745 L746 I747 L760 L774 L778 L789 | L733-L743 HydrophobicContact CD1-CB 3.69Å; G739-L743 PolarHBondContact O-N 2.91Å; I740-L743 HydrophobicContact CD1-CD2 4.35Å; I740-L743 PolarHBondContact O-N 3.47Å; E741-L743 VanDerWaalsContact C-N 3.35Å; L743-G745 VanDerWaalsContact C-N 3.32Å; L743-G745 PolarHBondContact O-N 2.91Å; L743-L746 WeakPolarHBondContact O-CB 3.49Å; L743-L746 PolarHBondContact O-N 2.65Å; L743-L746 VanDerWaalsContact O-N 3.14Å; L743-I747 HydrophobicContact CD1-CD1 4.21Å; L743-I747 HydrophobicContact CD1-CG1 4.3Å; L743-I747 HydrophobicContact CG-CD1 3.9Å; L743-I747 HydrophobicContact CG-CG1 4.46Å; L743-I747 WeakPolarHBondContact O-CG1 3.22Å; L743-I747 PolarHBondContact O-N 3.16Å; L743-L760 HydrophobicContact CD1-CD2 3.58Å; L743-L774 HydrophobicContact CD1-CD1 4.36Å; L743-L774 HydrophobicContact CD1-CD2 3.79Å; L743-L778 HydrophobicContact CB-CD2 4.13Å; L743-L778 HydrophobicContact CD2-CD1 3.87Å; L743-L778 HydrophobicContact CD2-CD2 3.88Å; L743-L778 HydrophobicContact CD2-CG 4.15Å; L743-L789 HydrophobicContact CD2-CD1 3.76Å |
| 744 | M | 82.4 | Confident | 74.8 | Confident | 65 Ų | 65 | 45.9 Ų | 45.9 | 32% | 0.32 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -66 | -34.3 | 176.7 | -73.2 | -58.3 | -75.7 | 0 | 0 | 112.6 | I740 E741 I747 G748 A792 | I740-M744 HydrophobicContact CG1-CG 4.5Å; I740-M744 WeakPolarHBondContact O-CG 3.3Å; I740-M744 PolarHBondContact O-N 3.25Å; E741-M744 PolarHBondContact O-N 3.45Å; M744-I747 HydrophobicContact SD-CD1 3.88Å; M744-G748 PolarHBondContact O-N 2.86Å; M744-A792 HydrophobicContact CE-CB 4.34Å; M744-A792 WeakPolarHBondContact CE-O 3.41Å; M744-A792 HydrophobicContact CG-CB 3.83Å; M744-A792 HydrophobicContact SD-CB 3.75Å |
| 745 | G | 79.3 | Confident | 75.6 | Confident | 48 Ų | 48 | 47.5 Ų | 47.5 | 50% | 0.495 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61 | -43.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | E741 A742 L743 G748 S749 | E741-G745 PolarHBondContact O-N 3.1Å; A742-G745 PolarHBondContact O-N 2.97Å; L743-G745 VanDerWaalsContact C-N 3.32Å; L743-G745 PolarHBondContact O-N 2.91Å; G745-G748 PolarHBondContact O-N 3.13Å; G745-S749 PolarHBondContact O-N 3.14Å |
| 746 | L | 76.4 | Confident | 76.7 | Confident | 26 Ų | 26 | 45.7 Ų | 45.7 | 14% | 0.136 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -64.3 | -49.2 | 175.4 | -73 | 167.5 | 0 | 0 | 0 | 111.9 | L732 L733 A736 A742 L743 G748 S749 V750 L760 | L732-L746 HydrophobicContact CB-CD1 4.2Å; L732-L746 HydrophobicContact CD2-CD2 4.44Å; L733-L746 HydrophobicContact CB-CD1 4.42Å; L733-L746 HydrophobicContact CD1-CD1 4.45Å; A736-L746 HydrophobicContact CB-CD1 3.97Å; A736-L746 HydrophobicContact CB-CD2 4.34Å; A736-L746 HydrophobicContact CB-CG 4.04Å; A742-L746 WeakPolarHBondContact O-CG 3.45Å; A742-L746 PolarHBondContact O-N 3.27Å; L743-L746 WeakPolarHBondContact O-CB 3.49Å; L743-L746 PolarHBondContact O-N 2.65Å; L743-L746 VanDerWaalsContact O-N 3.14Å; L746-G748 VanDerWaalsContact C-N 3.32Å; L746-G748 PolarHBondContact O-N 3.09Å; L746-S749 WeakPolarHBondContact O-CB 3.32Å; L746-S749 PolarHBondContact O-N 2.92Å; L746-S749 PolarHBondContact O-OG 3.37Å; L746-V750 PolarHBondContact O-N 3.49Å; L746-L760 HydrophobicContact CB-CD1 4.21Å |
| 747 | I | 81 | Confident | 78 | Confident | 1 Ų | 1 | 43.3 Ų | 43.3 | 1% | 0.005 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -55.9 | -46.5 | 175.7 | -71.1 | 166.7 | 0 | 0 | 0 | 110.7 | L743 M744 S749 V750 G751 G752 G753 L757 L760 M793 | L743-I747 HydrophobicContact CD1-CD1 4.21Å; L743-I747 HydrophobicContact CD1-CG1 4.3Å; L743-I747 HydrophobicContact CG-CD1 3.9Å; L743-I747 HydrophobicContact CG-CG1 4.46Å; L743-I747 WeakPolarHBondContact O-CG1 3.22Å; L743-I747 PolarHBondContact O-N 3.16Å; M744-I747 HydrophobicContact SD-CD1 3.88Å; I747-S749 VanDerWaalsContact C-N 3.3Å; I747-S749 PolarHBondContact O-N 3.12Å; I747-V750 WeakPolarHBondContact O-CG2 3.17Å; I747-V750 PolarHBondContact O-N 3.41Å; I747-G751 PolarHBondContact O-N 3.1Å; I747-G751 VanDerWaalsContact O-N 3.17Å; I747-G752 PolarHBondContact O-N 3.22Å; I747-G753 WeakPolarHBondContact CG2-O 3.48Å; I747-L757 HydrophobicContact CD1-CB 4.23Å; I747-L757 HydrophobicContact CD1-CD1 4.01Å; I747-L757 HydrophobicContact CG1-CB 4.31Å; I747-L757 HydrophobicContact CG1-CD1 4.32Å; I747-L760 HydrophobicContact CG1-CD2 4.19Å; I747-M793 HydrophobicContact CD1-SD 4.31Å |
| 748 | G | 78 | Confident | 78.9 | Confident | 46 Ų | 46 | 41.2 Ų | 41.2 | 47% | 0.474 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -58.7 | -38.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | M744 G745 L746 V750 | M744-G748 PolarHBondContact O-N 2.86Å; G745-G748 PolarHBondContact O-N 3.13Å; L746-G748 VanDerWaalsContact C-N 3.32Å; L746-G748 PolarHBondContact O-N 3.09Å; G748-V750 VanDerWaalsContact C-N 3.29Å; G748-V750 PolarHBondContact O-N 2.85Å |
| 749 | S | 73.8 | Confident | 79.5 | Confident | 81 Ų | 81 | 45.8 Ų | 45.8 | 57% | 0.566 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -68.2 | -22 | -179.2 | 79.3 | 0 | 0 | 0 | 0 | 114.8 | G745 L746 I747 | G745-S749 PolarHBondContact O-N 3.14Å; L746-S749 WeakPolarHBondContact O-CB 3.32Å; L746-S749 PolarHBondContact O-N 2.92Å; L746-S749 PolarHBondContact O-OG 3.37Å; I747-S749 VanDerWaalsContact C-N 3.3Å; I747-S749 PolarHBondContact O-N 3.12Å |
| 750 | V | 64.3 | Low | 79.5 | Confident | 33 Ų | 33 | 44.8 Ų | 44.8 | 20% | 0.2 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -108.5 | -9.8 | -179 | -65 | 0 | 0 | 0 | 0 | 114.5 | L551 L746 I747 G748 G756 R759 L760 | L551-V750 HydrophobicContact CD1-CG1 4.26Å; L746-V750 PolarHBondContact O-N 3.49Å; I747-V750 WeakPolarHBondContact O-CG2 3.17Å; I747-V750 PolarHBondContact O-N 3.41Å; G748-V750 VanDerWaalsContact C-N 3.29Å; G748-V750 PolarHBondContact O-N 2.85Å; V750-G756 WeakPolarHBondContact CG2-O 3.38Å; V750-R759 HydrophobicContact CB-CB 4.45Å; V750-R759 HydrophobicContact CG2-CB 4.37Å; V750-R759 WeakPolarHBondContact O-CD 3.26Å; V750-R759 PolarHBondContact O-NH1 3.46Å; V750-L760 HydrophobicContact CG2-CB 4.47Å; V750-L760 HydrophobicContact CG2-CD1 4.25Å |
| 751 | G | 67.2 | Low | 79.4 | Confident | 47 Ų | 47 | 42.8 Ų | 42.8 | 49% | 0.485 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 166.8 | -23.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | I747 | I747-G751 PolarHBondContact O-N 3.1Å; I747-G751 VanDerWaalsContact O-N 3.17Å |
| 752 | G | 75.1 | Confident | 79 | Confident | 28 Ų | 28 | 37.8 Ų | 37.8 | 29% | 0.289 | 26% | 0.26 | S | S | . | . | S | Bend | trans | 79.4 | 150.2 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | I747 G756 | I747-G752 PolarHBondContact O-N 3.22Å; G752-G756 PolarHBondContact O-N 3.31Å |
| 753 | G | 82.3 | Confident | 78.3 | Confident | 37 Ų | 37 | 37.8 Ų | 37.8 | 38% | 0.381 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | 54.2 | -149 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | I747 E755 G756 L757 | I747-G753 WeakPolarHBondContact CG2-O 3.48Å; G753-E755 PolarHBondContact O-N 3.37Å; G753-G756 PolarHBondContact O-N 2.88Å; G753-G756 VanDerWaalsContact O-N 3.16Å; G753-L757 PolarHBondContact O-N 3.27Å |
| 754 | V | 84.3 | Confident | 77.2 | Confident | 41 Ų | 41 | 38.3 Ų | 38.3 | 25% | 0.248 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -52.8 | -50.7 | -179.4 | 179.8 | 0 | 0 | 0 | 0 | 112.3 | G756 L757 A758 M793 N802 N805 A806 | V754-G756 VanDerWaalsContact C-N 3.3Å; V754-G756 PolarHBondContact O-N 3.04Å; V754-L757 PolarHBondContact O-N 3.22Å; V754-A758 WeakPolarHBondContact O-CB 3.2Å; V754-A758 PolarHBondContact O-N 3.49Å; V754-M793 HydrophobicContact CG2-CE 4.18Å; V754-N802 HydrophobicContact CG2-CB 3.58Å; V754-N802 WeakPolarHBondContact CG2-OD1 3.31Å; V754-N805 HydrophobicContact CG1-CB 3.65Å; V754-A806 HydrophobicContact CG1-CB 4.2Å |
| 755 | E | 81.9 | Confident | 76.2 | Confident | 106 Ų | 106 | 38.9 Ų | 38.9 | 50% | 0.495 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -64.3 | -35.1 | -179.1 | 178.4 | 65.3 | -169.1 | 0 | 0 | 111.9 | G753 R759 | G753-E755 PolarHBondContact O-N 3.37Å; E755-R759 WeakPolarHBondContact O-CD 3.24Å; E755-R759 WeakPolarHBondContact O-CG 3.5Å; E755-R759 PolarHBondContact O-N 3.17Å; E755-R759 VanDerWaalsContact O-N 3.12Å; E755-R759 IonicContact OE1-CZ 3.88Å; E755-R759 IonicContact OE1-NE 2.72Å; E755-R759 PolarHBondContact OE1-NE 2.87Å; E755-R759 IonicContact OE1-NH2 2.7Å; E755-R759 PolarHBondContact OE1-NH2 2.75Å |
| 756 | G | 83.5 | Confident | 76 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.6 | -49 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | V750 G752 G753 V754 A758 R759 L760 | V750-G756 WeakPolarHBondContact CG2-O 3.38Å; G752-G756 PolarHBondContact O-N 3.31Å; G753-G756 PolarHBondContact O-N 2.88Å; G753-G756 VanDerWaalsContact O-N 3.16Å; V754-G756 VanDerWaalsContact C-N 3.3Å; V754-G756 PolarHBondContact O-N 3.04Å; G756-A758 PolarHBondContact O-N 3.08Å; G756-R759 PolarHBondContact O-N 2.83Å; G756-L760 WeakPolarHBondContact O-CB 3.48Å; G756-L760 PolarHBondContact O-N 2.6Å |
| 757 | L | 86.8 | Confident | 76.3 | Confident | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.2 | -40.9 | 176.7 | -179.2 | 59.9 | 0 | 0 | 0 | 111.3 | I747 G753 V754 R759 L760 L761 M793 I803 A806 | I747-L757 HydrophobicContact CD1-CB 4.23Å; I747-L757 HydrophobicContact CD1-CD1 4.01Å; I747-L757 HydrophobicContact CG1-CB 4.31Å; I747-L757 HydrophobicContact CG1-CD1 4.32Å; G753-L757 PolarHBondContact O-N 3.27Å; V754-L757 PolarHBondContact O-N 3.22Å; L757-R759 PolarHBondContact O-N 2.95Å; L757-L760 HydrophobicContact CD1-CD2 4.46Å; L757-L760 WeakPolarHBondContact O-CA 3.35Å; L757-L760 VanDerWaalsContact O-CB 3.3Å; L757-L760 WeakPolarHBondContact O-CB 3.39Å; L757-L760 PolarHBondContact O-N 3.14Å; L757-L760 VanDerWaalsContact O-N 3.1Å; L757-L761 HydrophobicContact CD1-CD1 4.13Å; L757-L761 HydrophobicContact CD1-CD2 4.42Å; L757-L761 HydrophobicContact CD1-CG 4Å; L757-L761 HydrophobicContact CG-CD1 3.92Å; L757-L761 HydrophobicContact CG-CG 4.24Å; L757-L761 VanDerWaalsContact O-CG 3.32Å; L757-L761 WeakPolarHBondContact O-CG 3.32Å; L757-L761 PolarHBondContact O-N 3.5Å; L757-M793 HydrophobicContact CB-CE 4.02Å; L757-M793 HydrophobicContact CB-SD 4.44Å; L757-M793 HydrophobicContact CD2-CE 3.67Å; L757-M793 HydrophobicContact CD2-CG 4.35Å; L757-M793 HydrophobicContact CD2-SD 4.03Å; L757-I803 HydrophobicContact CD2-CG1 4.29Å; L757-A806 HydrophobicContact CB-CB 3.86Å; L757-A806 HydrophobicContact CD2-CB 3.74Å; L757-A806 HydrophobicContact CG-CB 3.68Å |
| 758 | A | 84 | Confident | 76.3 | Confident | 22 Ų | 22 | 40.1 Ų | 40.1 | 18% | 0.182 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -59.5 | -45.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112 | V754 G756 L760 L761 A762 A806 | V754-A758 WeakPolarHBondContact O-CB 3.2Å; V754-A758 PolarHBondContact O-N 3.49Å; G756-A758 PolarHBondContact O-N 3.08Å; A758-L760 VanDerWaalsContact C-N 3.31Å; A758-L760 PolarHBondContact O-N 2.85Å; A758-L761 PolarHBondContact O-N 3.07Å; A758-A762 WeakPolarHBondContact O-CB 3.46Å; A758-A762 PolarHBondContact O-N 3.38Å; A758-A806 WeakPolarHBondContact CA-O 3.44Å; A758-A806 HydrophobicContact CB-CB 4.18Å |
| 759 | R | 80.3 | Confident | 76.4 | Confident | 128 Ų | 128 | 41.2 Ų | 41.2 | 48% | 0.483 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65.3 | -34 | 175.1 | -69.5 | 166.7 | -175.4 | -177.2 | 5.2 | 112.7 | V750 E755 G756 L757 S763 | V750-R759 HydrophobicContact CB-CB 4.45Å; V750-R759 HydrophobicContact CG2-CB 4.37Å; V750-R759 WeakPolarHBondContact O-CD 3.26Å; V750-R759 PolarHBondContact O-NH1 3.46Å; E755-R759 WeakPolarHBondContact O-CD 3.24Å; E755-R759 WeakPolarHBondContact O-CG 3.5Å; E755-R759 PolarHBondContact O-N 3.17Å; E755-R759 VanDerWaalsContact O-N 3.12Å; E755-R759 IonicContact OE1-CZ 3.88Å; E755-R759 IonicContact OE1-NE 2.72Å; E755-R759 PolarHBondContact OE1-NE 2.87Å; E755-R759 IonicContact OE1-NH2 2.7Å; E755-R759 PolarHBondContact OE1-NH2 2.75Å; G756-R759 PolarHBondContact O-N 2.83Å; L757-R759 PolarHBondContact O-N 2.95Å; R759-S763 PolarHBondContact O-N 3.31Å |
| 760 | L | 80.1 | Confident | 76.7 | Confident | 4 Ų | 4 | 37.5 Ų | 37.5 | 2% | 0.021 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -66.1 | -49.9 | 175.7 | -158.2 | 82.6 | 0 | 0 | 0 | 110.3 | L729 L743 L746 I747 V750 G756 L757 A758 S763 L774 | L729-L760 HydrophobicContact CD2-CD1 4.25Å; L729-L760 HydrophobicContact CD2-CD2 4.33Å; L729-L760 HydrophobicContact CD2-CG 3.76Å; L743-L760 HydrophobicContact CD1-CD2 3.58Å; L746-L760 HydrophobicContact CB-CD1 4.21Å; I747-L760 HydrophobicContact CG1-CD2 4.19Å; V750-L760 HydrophobicContact CG2-CB 4.47Å; V750-L760 HydrophobicContact CG2-CD1 4.25Å; G756-L760 WeakPolarHBondContact O-CB 3.48Å; G756-L760 PolarHBondContact O-N 2.6Å; L757-L760 HydrophobicContact CD1-CD2 4.46Å; L757-L760 WeakPolarHBondContact O-CA 3.35Å; L757-L760 VanDerWaalsContact O-CB 3.3Å; L757-L760 WeakPolarHBondContact O-CB 3.39Å; L757-L760 PolarHBondContact O-N 3.14Å; L757-L760 VanDerWaalsContact O-N 3.1Å; A758-L760 VanDerWaalsContact C-N 3.31Å; A758-L760 PolarHBondContact O-N 2.85Å; L760-S763 WeakPolarHBondContact O-CB 3.49Å; L760-S763 PolarHBondContact O-N 3.06Å; L760-S763 PolarHBondContact O-OG 2.95Å; L760-L774 HydrophobicContact CD2-CD1 3.85Å; L760-L774 HydrophobicContact CD2-CD2 4.49Å |
| 761 | L | 81.7 | Confident | 77.8 | Confident | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -65.6 | -39.6 | 178.5 | -65.8 | 175.5 | 0 | 0 | 0 | 112.7 | L757 A758 S763 G764 P767 A770 L771 L774 A806 L807 | L757-L761 HydrophobicContact CD1-CD1 4.13Å; L757-L761 HydrophobicContact CD1-CD2 4.42Å; L757-L761 HydrophobicContact CD1-CG 4Å; L757-L761 HydrophobicContact CG-CD1 3.92Å; L757-L761 HydrophobicContact CG-CG 4.24Å; L757-L761 VanDerWaalsContact O-CG 3.32Å; L757-L761 WeakPolarHBondContact O-CG 3.32Å; L757-L761 PolarHBondContact O-N 3.5Å; A758-L761 PolarHBondContact O-N 3.07Å; L761-S763 PolarHBondContact O-N 3.41Å; L761-S763 VanDerWaalsContact O-N 3.16Å; L761-G764 WeakPolarHBondContact O-CA 3.31Å; L761-G764 PolarHBondContact O-N 2.71Å; L761-P767 HydrophobicContact CB-CB 4.14Å; L761-A770 HydrophobicContact CB-CB 4.5Å; L761-A770 HydrophobicContact CD2-CB 3.92Å; L761-L771 HydrophobicContact CD1-CB 4.48Å; L761-L771 HydrophobicContact CD1-CD1 4.49Å; L761-L771 HydrophobicContact CD2-CB 3.72Å; L761-L771 HydrophobicContact CD2-CD1 4.16Å; L761-L774 HydrophobicContact CD2-CD1 3.76Å; L761-A806 HydrophobicContact CD1-CB 4.23Å; L761-L807 HydrophobicContact CD1-CD2 4.19Å; L761-L807 HydrophobicContact CD1-CG 4.44Å |
| 762 | A | 74.3 | Confident | 78.6 | Confident | 69 Ų | 69 | 33.9 Ų | 33.9 | 57% | 0.57 | 21% | 0.213 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -69.5 | -4.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | A758 G764 | A758-A762 WeakPolarHBondContact O-CB 3.46Å; A758-A762 PolarHBondContact O-N 3.38Å; A762-G764 VanDerWaalsContact C-N 3.31Å |
| 763 | S | 65.9 | Low | 78.8 | Confident | 11 Ų | 11 | 34.6 Ų | 34.6 | 8% | 0.077 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78 | -17.9 | 164.6 | 75.3 | 0 | 0 | 0 | 0 | 112.7 | N725 R759 L760 L761 | N725-S763 PolarHBondContact ND2-O 3.29Å; N725-S763 PolarHBondContact OD1-O 3.03Å; R759-S763 PolarHBondContact O-N 3.31Å; L760-S763 WeakPolarHBondContact O-CB 3.49Å; L760-S763 PolarHBondContact O-N 3.06Å; L760-S763 PolarHBondContact O-OG 2.95Å; L761-S763 PolarHBondContact O-N 3.41Å; L761-S763 VanDerWaalsContact O-N 3.16Å |
| 764 | G | 58.9 | Low | 78.9 | Confident | 11 Ų | 11 | 32.9 Ų | 32.9 | 11% | 0.113 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -75.6 | 164.2 | 167.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | N725 L761 A762 N766 | N725-G764 PolarHBondContact ND2-O 3.25Å; L761-G764 WeakPolarHBondContact O-CA 3.31Å; L761-G764 PolarHBondContact O-N 2.71Å; A762-G764 VanDerWaalsContact C-N 3.31Å; G764-N766 VanDerWaalsContact C-N 3.32Å |
| 765 | A | 61.9 | Low | 79 | Confident | 78 Ų | 78 | 31.1 Ų | 31.1 | 65% | 0.645 | 18% | 0.181 | S | C | * | . | S | Bend | trans | -80.7 | -21 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | N725 | N725-A765 HydrophobicContact CB-CB 3.7Å; N725-A765 WeakPolarHBondContact ND2-CA 3.1Å; N725-A765 PolarHBondContact ND2-N 3.44Å |
| 766 | N | 74.5 | Confident | 78.9 | Confident | 58 Ų | 58 | 33.3 Ų | 33.3 | 31% | 0.31 | 19% | 0.189 | S | C | . | . | S | Bend | trans | -139.6 | 122.8 | 166.9 | 175.8 | 5.1 | 0 | 0 | 0 | 107 | G764 S768 E769 A770 | G764-N766 VanDerWaalsContact C-N 3.32Å; N766-S768 PolarHBondContact ND2-OG 2.76Å; N766-S768 PolarHBondContact O-N 2.79Å; N766-S768 PolarHBondContact OD1-N 2.79Å; N766-S768 VanDerWaalsContact OD1-N 3.14Å; N766-S768 PolarHBondContact OD1-OG 3.16Å; N766-E769 HydrophobicContact CB-CB 4.36Å; N766-E769 HydrophobicContact CB-CG 4.2Å; N766-E769 PolarHBondContact O-N 3.4Å; N766-A770 PolarHBondContact O-N 3.43Å; N766-A770 VanDerWaalsContact O-N 3.09Å |
| 767 | P | 82 | Confident | 78.6 | Confident | 39 Ų | 39 | 34.7 Ų | 34.7 | 25% | 0.253 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -54.1 | -30.1 | 176.9 | -29.8 | 37.5 | 0 | 0 | 0 | 114.6 | L761 A770 L771 L807 | L761-P767 HydrophobicContact CB-CB 4.14Å; P767-A770 WeakPolarHBondContact O-CB 3.37Å; P767-L771 PolarHBondContact O-N 3.12Å; P767-L807 HydrophobicContact CB-CD2 4.19Å; P767-L807 WeakPolarHBondContact O-CD2 3.47Å |
| 768 | S | 81.7 | Confident | 78.5 | Confident | 4 Ų | 4 | 35.6 Ų | 35.6 | 3% | 0.028 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -73.8 | -44 | 178.8 | 69.7 | 0 | 0 | 0 | 0 | 113.3 | N766 A770 L771 G772 E817 Q821 | N766-S768 PolarHBondContact ND2-OG 2.76Å; N766-S768 PolarHBondContact O-N 2.79Å; N766-S768 PolarHBondContact OD1-N 2.79Å; N766-S768 VanDerWaalsContact OD1-N 3.14Å; N766-S768 PolarHBondContact OD1-OG 3.16Å; S768-A770 VanDerWaalsContact C-N 3.26Å; S768-A770 PolarHBondContact O-N 3.27Å; S768-L771 PolarHBondContact O-N 3.45Å; S768-L771 VanDerWaalsContact O-N 3.16Å; S768-G772 PolarHBondContact O-N 2.95Å; S768-E817 VanDerWaalsContact CB-OE2 3.29Å; S768-E817 WeakPolarHBondContact CB-OE2 3.21Å; S768-E817 PolarHBondContact OG-OE2 3.39Å; S768-Q821 VanDerWaalsContact O-CD 3.22Å; S768-Q821 VanDerWaalsContact O-CG 3.31Å; S768-Q821 WeakPolarHBondContact O-CG 3.17Å |
| 769 | E | 80.4 | Confident | 78.5 | Confident | 68 Ų | 68 | 36.9 Ų | 36.9 | 32% | 0.318 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -61.4 | -38.9 | 172.4 | -66 | -169.2 | 179.7 | 0 | 0 | 111.2 | R726 N766 L771 G772 E773 | R726-E769 IonicContact CZ-OE1 2.72Å; R726-E769 IonicContact CZ-OE2 2.86Å; R726-E769 IonicContact NE-OE2 3.31Å; R726-E769 PolarHBondContact NE-OE2 3.02Å; R726-E769 IonicContact NH2-OE1 3.03Å; R726-E769 PolarHBondContact NH2-OE1 3.19Å; R726-E769 IonicContact NH2-OE2 3.45Å; R726-E769 PolarHBondContact NH2-OE2 2.85Å; N766-E769 HydrophobicContact CB-CB 4.36Å; N766-E769 HydrophobicContact CB-CG 4.2Å; N766-E769 PolarHBondContact O-N 3.4Å; E769-L771 VanDerWaalsContact C-N 3.32Å; E769-L771 PolarHBondContact O-N 3.09Å; E769-G772 PolarHBondContact O-N 3.3Å; E769-E773 PolarHBondContact O-N 3.43Å |
| 770 | A | 80.8 | Confident | 78.5 | Confident | 3 Ų | 3 | 38.5 Ų | 38.5 | 3% | 0.025 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.1 | -39.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L729 L761 N766 P767 S768 L774 | L729-A770 HydrophobicContact CD1-CB 3.51Å; L761-A770 HydrophobicContact CB-CB 4.5Å; L761-A770 HydrophobicContact CD2-CB 3.92Å; N766-A770 PolarHBondContact O-N 3.43Å; N766-A770 VanDerWaalsContact O-N 3.09Å; P767-A770 WeakPolarHBondContact O-CB 3.37Å; S768-A770 VanDerWaalsContact C-N 3.26Å; S768-A770 PolarHBondContact O-N 3.27Å; A770-L774 WeakPolarHBondContact O-CG 3.13Å; A770-L774 PolarHBondContact O-N 2.88Å; A770-L774 VanDerWaalsContact O-N 3.12Å |
| 771 | L | 86.6 | Confident | 78.7 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -70.1 | -40.3 | 175.6 | -175.7 | 62.4 | 0 | 0 | 0 | 111.5 | L761 P767 S768 E769 E773 L774 L775 L789 I803 L807 L818 | L761-L771 HydrophobicContact CD1-CB 4.48Å; L761-L771 HydrophobicContact CD1-CD1 4.49Å; L761-L771 HydrophobicContact CD2-CB 3.72Å; L761-L771 HydrophobicContact CD2-CD1 4.16Å; P767-L771 PolarHBondContact O-N 3.12Å; S768-L771 PolarHBondContact O-N 3.45Å; S768-L771 VanDerWaalsContact O-N 3.16Å; E769-L771 VanDerWaalsContact C-N 3.32Å; E769-L771 PolarHBondContact O-N 3.09Å; L771-E773 VanDerWaalsContact C-N 3.34Å; L771-E773 PolarHBondContact O-N 2.83Å; L771-L774 PolarHBondContact O-N 2.96Å; L771-L774 VanDerWaalsContact O-N 3.14Å; L771-L775 HydrophobicContact CD1-CD1 4.4Å; L771-L775 HydrophobicContact CD1-CG 4.33Å; L771-L775 HydrophobicContact CG-CD1 3.94Å; L771-L775 HydrophobicContact CG-CG 4.34Å; L771-L775 WeakPolarHBondContact O-CG 3.39Å; L771-L775 PolarHBondContact O-N 3.46Å; L771-L789 HydrophobicContact CD1-CD2 3.68Å; L771-I803 HydrophobicContact CD1-CG2 4.25Å; L771-I803 HydrophobicContact CD2-CG2 3.57Å; L771-L807 HydrophobicContact CB-CD2 4.01Å; L771-L807 HydrophobicContact CD2-CD1 3.81Å; L771-L807 HydrophobicContact CD2-CD2 3.85Å; L771-L807 HydrophobicContact CD2-CG 3.94Å; L771-L818 HydrophobicContact CD2-CD1 3.71Å |
| 772 | G | 83.8 | Confident | 78.9 | Confident | 4 Ų | 4 | 43 Ų | 43 | 4% | 0.041 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63 | -37.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | S768 E769 K776 | S768-G772 PolarHBondContact O-N 2.95Å; E769-G772 PolarHBondContact O-N 3.3Å; G772-K776 WeakPolarHBondContact O-CB 3.31Å; G772-K776 WeakPolarHBondContact O-CG 3.37Å; G772-K776 PolarHBondContact O-N 2.79Å |
| 773 | E | 79.5 | Confident | 79.5 | Confident | 43 Ų | 43 | 40.4 Ų | 40.4 | 20% | 0.201 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -68.4 | -30.8 | 171.7 | -74.2 | -167.5 | 167.1 | 0 | 0 | 113.2 | R726 G727 E769 L771 G777 | R726-E773 VanDerWaalsContact CA-OE1 3.23Å; R726-E773 WeakPolarHBondContact CA-OE1 3.32Å; R726-E773 VanDerWaalsContact CB-OE1 3.31Å; R726-E773 WeakPolarHBondContact CB-OE1 3.35Å; G727-E773 WeakPolarHBondContact CA-OE2 3.31Å; G727-E773 PolarHBondContact N-OE1 3.4Å; G727-E773 PolarHBondContact N-OE2 3.4Å; E769-E773 PolarHBondContact O-N 3.43Å; L771-E773 VanDerWaalsContact C-N 3.34Å; L771-E773 PolarHBondContact O-N 2.83Å; E773-G777 PolarHBondContact O-N 2.96Å |
| 774 | L | 83.6 | Confident | 80.5 | Confident | 1 Ų | 1 | 45 Ų | 45 | 1% | 0.005 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -75.9 | -44.7 | 175.8 | -79 | 171.5 | 0 | 0 | 0 | 112.3 | L729 L733 L743 L760 L761 A770 L771 K776 G777 L778 | L729-L774 HydrophobicContact CB-CD2 3.89Å; L729-L774 HydrophobicContact CB-CG 3.98Å; L729-L774 HydrophobicContact CD1-CD1 4.23Å; L729-L774 HydrophobicContact CD1-CG 4.41Å; L733-L774 HydrophobicContact CD2-CD2 4.15Å; L743-L774 HydrophobicContact CD1-CD1 4.36Å; L743-L774 HydrophobicContact CD1-CD2 3.79Å; L760-L774 HydrophobicContact CD2-CD1 3.85Å; L760-L774 HydrophobicContact CD2-CD2 4.49Å; L761-L774 HydrophobicContact CD2-CD1 3.76Å; A770-L774 WeakPolarHBondContact O-CG 3.13Å; A770-L774 PolarHBondContact O-N 2.88Å; A770-L774 VanDerWaalsContact O-N 3.12Å; L771-L774 PolarHBondContact O-N 2.96Å; L771-L774 VanDerWaalsContact O-N 3.14Å; L774-K776 PolarHBondContact O-N 3.38Å; L774-G777 CarbonylContact O-C 3.39Å; L774-G777 WeakPolarHBondContact O-CA 3.25Å; L774-G777 PolarHBondContact O-N 3.16Å; L774-L778 PolarHBondContact O-N 3.48Å; L774-L778 VanDerWaalsContact O-N 3.13Å |
| 775 | L | 86.6 | Confident | 82 | Confident | 5 Ų | 5 | 44.5 Ų | 44.5 | 3% | 0.026 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -59.1 | -48.2 | 178 | -72.3 | 165.4 | 0 | 0 | 0 | 110.6 | L771 G777 L778 D779 A785 L786 L789 Q821 V822 | L771-L775 HydrophobicContact CD1-CD1 4.4Å; L771-L775 HydrophobicContact CD1-CG 4.33Å; L771-L775 HydrophobicContact CG-CD1 3.94Å; L771-L775 HydrophobicContact CG-CG 4.34Å; L771-L775 WeakPolarHBondContact O-CG 3.39Å; L771-L775 PolarHBondContact O-N 3.46Å; L775-G777 PolarHBondContact O-N 3.42Å; L775-G777 VanDerWaalsContact O-N 3.09Å; L775-L778 WeakPolarHBondContact O-CB 3.43Å; L775-L778 PolarHBondContact O-N 2.67Å; L775-D779 PolarHBondContact O-N 2.84Å; L775-A785 HydrophobicContact CB-CB 4.13Å; L775-A785 HydrophobicContact CD2-CB 3.98Å; L775-A785 WeakPolarHBondContact O-CB 3.35Å; L775-L786 HydrophobicContact CD2-CB 4.46Å; L775-L786 HydrophobicContact CD2-CD1 4.48Å; L775-L789 HydrophobicContact CD2-CB 4.38Å; L775-L789 HydrophobicContact CD2-CD2 3.99Å; L775-Q821 HydrophobicContact CD1-CB 4.29Å; L775-V822 HydrophobicContact CD1-CG1 3.81Å |
| 776 | K | 81.3 | Confident | 83.4 | Confident | 152 Ų | 152 | 40.8 Ų | 40.8 | 66% | 0.661 | 22% | 0.216 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | -2.1 | 172.8 | -65.8 | 173.6 | -179 | 174 | 0 | 114.4 | G772 L774 | G772-K776 WeakPolarHBondContact O-CB 3.31Å; G772-K776 WeakPolarHBondContact O-CG 3.37Å; G772-K776 PolarHBondContact O-N 2.79Å; L774-K776 PolarHBondContact O-N 3.38Å |
| 777 | G | 76.6 | Confident | 84 | Confident | 28 Ų | 28 | 41.3 Ų | 41.3 | 29% | 0.289 | 22% | 0.215 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -104.3 | -5.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | L733 E773 L774 L775 | L733-G777 VanDerWaalsContact CD2-O 3.31Å; L733-G777 WeakPolarHBondContact CD2-O 3.47Å; E773-G777 PolarHBondContact O-N 2.96Å; L774-G777 CarbonylContact O-C 3.39Å; L774-G777 WeakPolarHBondContact O-CA 3.25Å; L774-G777 PolarHBondContact O-N 3.16Å; L775-G777 PolarHBondContact O-N 3.42Å; L775-G777 VanDerWaalsContact O-N 3.09Å |
| 778 | L | 83.5 | Confident | 84.4 | Confident | 19 Ų | 19 | 42.2 Ų | 42.2 | 10% | 0.099 | 22% | 0.216 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.7 | -50 | 173.6 | -69.2 | 172.2 | 0 | 0 | 0 | 111.3 | L733 I740 L743 L774 L775 A785 L789 | L733-L778 HydrophobicContact CD2-CD2 4.14Å; L733-L778 HydrophobicContact CD2-CG 4.36Å; I740-L778 HydrophobicContact CB-CD2 4.18Å; I740-L778 HydrophobicContact CD1-CD1 4.14Å; I740-L778 HydrophobicContact CD1-CD2 3.99Å; L743-L778 HydrophobicContact CB-CD2 4.13Å; L743-L778 HydrophobicContact CD2-CD1 3.87Å; L743-L778 HydrophobicContact CD2-CD2 3.88Å; L743-L778 HydrophobicContact CD2-CG 4.15Å; L774-L778 PolarHBondContact O-N 3.48Å; L774-L778 VanDerWaalsContact O-N 3.13Å; L775-L778 WeakPolarHBondContact O-CB 3.43Å; L775-L778 PolarHBondContact O-N 2.67Å; L778-A785 HydrophobicContact CB-CB 4.28Å; L778-L789 HydrophobicContact CD1-CB 4.07Å |
| 779 | D | 84.6 | Confident | 84.8 | Confident | 49 Ų | 49 | 42 Ų | 42 | 26% | 0.262 | 22% | 0.215 | S | C | . | . | trans | -150.6 | 154.8 | -177.9 | -151.9 | -49.6 | 0 | 0 | 0 | 109.3 | L775 D781 K784 A785 Q788 | L775-D779 PolarHBondContact O-N 2.84Å; D779-D781 VanDerWaalsContact C-N 3.33Å; D779-D781 PolarHBondContact OD1-N 3.29Å; D779-D781 VanDerWaalsContact OD1-N 3.08Å; D779-K784 HydrophobicContact CB-CB 4.18Å; D779-K784 VanDerWaalsContact OD2-CB 3.26Å; D779-K784 WeakPolarHBondContact OD2-CB 3.17Å; D779-K784 WeakPolarHBondContact OD2-CD 3.29Å; D779-A785 HydrophobicContact CB-CB 3.97Å; D779-Q788 PolarHBondContact OD2-NE2 2.79Å; D779-Q788 VanDerWaalsContact OD2-NE2 3.14Å | ||
| 780 | D | 80 | Confident | 85.2 | Confident | 163 Ų | 163 | 38.8 Ų | 38.8 | 87% | 0.872 | 20% | 0.2 | S | C | * | . | S | Bend | trans | -78.3 | -24.1 | 171.2 | -75.7 | -49.7 | 0 | 0 | 0 | 110.8 | ||
| 781 | D | 84.9 | Confident | 85.6 | Confident | 48 Ų | 48 | 43.8 Ų | 43.8 | 26% | 0.257 | 23% | 0.226 | S | C | . | . | S | Bend | trans | -82.8 | 117.8 | 173 | 176 | -35 | 0 | 0 | 0 | 110.4 | D779 V783 K784 A785 | D779-D781 VanDerWaalsContact C-N 3.33Å; D779-D781 PolarHBondContact OD1-N 3.29Å; D779-D781 VanDerWaalsContact OD1-N 3.08Å; D781-V783 VanDerWaalsContact C-N 3.31Å; D781-V783 PolarHBondContact O-N 2.93Å; D781-V783 WeakPolarHBondContact OD1-CA 3.24Å; D781-V783 VanDerWaalsContact OD1-CB 3.31Å; D781-V783 WeakPolarHBondContact OD1-CB 3.25Å; D781-V783 PolarHBondContact OD1-N 2.92Å; D781-K784 HydrophobicContact CB-CB 3.99Å; D781-K784 HydrophobicContact CB-CD 4.07Å; D781-K784 HydrophobicContact CB-CG 4.04Å; D781-K784 PolarHBondContact O-N 3.29Å; D781-K784 PolarHBondContact OD1-N 2.85Å; D781-K784 IonicContact OD2-NZ 3.46Å; D781-K784 PolarHBondContact OD2-NZ 2.84Å; D781-A785 WeakPolarHBondContact O-CB 3.33Å; D781-A785 PolarHBondContact O-N 2.91Å |
| 782 | P | 84.9 | Confident | 85.5 | Confident | 49 Ų | 49 | 45.4 Ų | 45.4 | 32% | 0.318 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -67.7 | -29.2 | -175.9 | 28.2 | -34.9 | 0 | 0 | 0 | 113.2 | L786 V822 | P782-L786 VanDerWaalsContact O-CB 3.25Å; P782-L786 WeakPolarHBondContact O-CB 3.22Å; P782-L786 PolarHBondContact O-N 2.62Å; P782-V822 HydrophobicContact CB-CB 4.21Å |
| 783 | V | 87.1 | Confident | 85.6 | Confident | 15 Ų | 15 | 45.8 Ų | 45.8 | 9% | 0.091 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -71.2 | -44.3 | 176.8 | -169.7 | 0 | 0 | 0 | 0 | 109.6 | D781 L786 K787 N831 E834 | D781-V783 VanDerWaalsContact C-N 3.31Å; D781-V783 PolarHBondContact O-N 2.93Å; D781-V783 WeakPolarHBondContact OD1-CA 3.24Å; D781-V783 VanDerWaalsContact OD1-CB 3.31Å; D781-V783 WeakPolarHBondContact OD1-CB 3.25Å; D781-V783 PolarHBondContact OD1-N 2.92Å; V783-L786 PolarHBondContact O-N 2.88Å; V783-K787 HydrophobicContact CG1-CD 3.87Å; V783-K787 VanDerWaalsContact CG1-CE 3.5Å; V783-K787 HydrophobicContact CG1-CG 4.42Å; V783-K787 VanDerWaalsContact O-CB 3.25Å; V783-K787 WeakPolarHBondContact O-CB 3.23Å; V783-K787 VanDerWaalsContact O-CG 3.24Å; V783-K787 WeakPolarHBondContact O-CG 3.32Å; V783-K787 PolarHBondContact O-N 3.23Å; V783-N831 HydrophobicContact CG2-CB 3.75Å; V783-N831 VanDerWaalsContact CG2-CG 3.44Å; V783-N831 WeakPolarHBondContact CG2-OD1 3.23Å; V783-E834 HydrophobicContact CG1-CB 3.92Å |
| 784 | K | 88 | Confident | 85.8 | Confident | 108 Ų | 108 | 46.4 Ų | 46.4 | 47% | 0.47 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.8 | -44.2 | 175 | -68.9 | -174.8 | -172.5 | 82.6 | 0 | 111.7 | D779 D781 L786 K787 Q788 | D779-K784 HydrophobicContact CB-CB 4.18Å; D779-K784 VanDerWaalsContact OD2-CB 3.26Å; D779-K784 WeakPolarHBondContact OD2-CB 3.17Å; D779-K784 WeakPolarHBondContact OD2-CD 3.29Å; D781-K784 HydrophobicContact CB-CB 3.99Å; D781-K784 HydrophobicContact CB-CD 4.07Å; D781-K784 HydrophobicContact CB-CG 4.04Å; D781-K784 PolarHBondContact O-N 3.29Å; D781-K784 PolarHBondContact OD1-N 2.85Å; D781-K784 IonicContact OD2-NZ 3.46Å; D781-K784 PolarHBondContact OD2-NZ 2.84Å; K784-L786 VanDerWaalsContact C-N 3.35Å; K784-L786 PolarHBondContact O-N 2.93Å; K784-K787 PolarHBondContact O-N 3.05Å; K784-Q788 WeakPolarHBondContact O-CB 3.37Å; K784-Q788 VanDerWaalsContact O-CG 3.24Å; K784-Q788 WeakPolarHBondContact O-CG 3.43Å; K784-Q788 PolarHBondContact O-N 2.59Å |
| 785 | A | 89 | Confident | 85.8 | Confident | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -58.3 | -46.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | L775 L778 D779 D781 L789 | L775-A785 HydrophobicContact CB-CB 4.13Å; L775-A785 HydrophobicContact CD2-CB 3.98Å; L775-A785 WeakPolarHBondContact O-CB 3.35Å; L778-A785 HydrophobicContact CB-CB 4.28Å; D779-A785 HydrophobicContact CB-CB 3.97Å; D781-A785 WeakPolarHBondContact O-CB 3.33Å; D781-A785 PolarHBondContact O-N 2.91Å; A785-L789 WeakPolarHBondContact O-CB 2.8Å; A785-L789 PolarHBondContact O-N 3.48Å |
| 786 | L | 91.1 | Very high | 85.8 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -68.5 | -43.5 | 178.2 | -174.4 | 61.4 | 0 | 0 | 0 | 112 | L775 P782 V783 K784 Q788 L789 A790 I803 L818 V822 L832 A835 | L775-L786 HydrophobicContact CD2-CB 4.46Å; L775-L786 HydrophobicContact CD2-CD1 4.48Å; P782-L786 VanDerWaalsContact O-CB 3.25Å; P782-L786 WeakPolarHBondContact O-CB 3.22Å; P782-L786 PolarHBondContact O-N 2.62Å; V783-L786 PolarHBondContact O-N 2.88Å; K784-L786 VanDerWaalsContact C-N 3.35Å; K784-L786 PolarHBondContact O-N 2.93Å; L786-Q788 PolarHBondContact O-N 3.21Å; L786-L789 PolarHBondContact O-N 2.87Å; L786-A790 VanDerWaalsContact O-CB 3.23Å; L786-A790 WeakPolarHBondContact O-CB 3.42Å; L786-A790 PolarHBondContact O-N 3.22Å; L786-I803 HydrophobicContact CD1-CD1 4.05Å; L786-L818 HydrophobicContact CD1-CD1 4.13Å; L786-V822 HydrophobicContact CB-CG1 4.33Å; L786-V822 HydrophobicContact CD2-CG1 4.19Å; L786-V822 HydrophobicContact CD2-CG2 4.48Å; L786-L832 HydrophobicContact CD2-CD1 4.3Å; L786-A835 HydrophobicContact CB-CB 4.15Å; L786-A835 HydrophobicContact CD2-CB 3.58Å; L786-A835 HydrophobicContact CG-CB 3.72Å |
| 787 | K | 88.9 | Confident | 86.1 | Confident | 70 Ų | 70 | 41.6 Ų | 41.6 | 30% | 0.304 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -59.9 | -44.7 | 174.9 | -78.3 | 172.5 | 179.7 | 166.6 | 0 | 111.9 | V783 K784 N791 E834 A835 | V783-K787 HydrophobicContact CG1-CD 3.87Å; V783-K787 VanDerWaalsContact CG1-CE 3.5Å; V783-K787 HydrophobicContact CG1-CG 4.42Å; V783-K787 VanDerWaalsContact O-CB 3.25Å; V783-K787 WeakPolarHBondContact O-CB 3.23Å; V783-K787 VanDerWaalsContact O-CG 3.24Å; V783-K787 WeakPolarHBondContact O-CG 3.32Å; V783-K787 PolarHBondContact O-N 3.23Å; K784-K787 PolarHBondContact O-N 3.05Å; K787-N791 VanDerWaalsContact O-CB 3.22Å; K787-N791 WeakPolarHBondContact O-CB 3.41Å; K787-N791 PolarHBondContact O-N 3.34Å; K787-N791 PolarHBondContact O-ND2 3.2Å; K787-E834 WeakPolarHBondContact CE-O 3.29Å; K787-E834 PolarHBondContact NZ-O 2.83Å; K787-E834 IonicContact NZ-OE2 3.15Å; K787-A835 HydrophobicContact CG-CB 3.81Å |
| 788 | Q | 89.5 | Confident | 86.6 | Confident | 57 Ų | 57 | 44.6 Ų | 44.6 | 27% | 0.266 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.2 | -47.1 | 175.9 | -74.7 | 177.1 | 45.8 | 0 | 0 | 111.4 | I740 D779 K784 L786 A792 | I740-Q788 HydrophobicContact CB-CB 4.38Å; I740-Q788 HydrophobicContact CD1-CB 4.46Å; I740-Q788 HydrophobicContact CG1-CB 4.36Å; D779-Q788 PolarHBondContact OD2-NE2 2.79Å; D779-Q788 VanDerWaalsContact OD2-NE2 3.14Å; K784-Q788 WeakPolarHBondContact O-CB 3.37Å; K784-Q788 VanDerWaalsContact O-CG 3.24Å; K784-Q788 WeakPolarHBondContact O-CG 3.43Å; K784-Q788 PolarHBondContact O-N 2.59Å; L786-Q788 PolarHBondContact O-N 3.21Å; Q788-A792 WeakPolarHBondContact O-CB 3.45Å; Q788-A792 PolarHBondContact O-N 3.14Å |
| 789 | L | 90.2 | Very high | 86.9 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.005 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68.3 | -44 | 179.6 | -172.7 | 59.1 | 0 | 0 | 0 | 112.3 | I740 L743 L771 L775 L778 A785 L786 A792 M793 I803 | I740-L789 HydrophobicContact CD1-CD1 4.17Å; L743-L789 HydrophobicContact CD2-CD1 3.76Å; L771-L789 HydrophobicContact CD1-CD2 3.68Å; L775-L789 HydrophobicContact CD2-CB 4.38Å; L775-L789 HydrophobicContact CD2-CD2 3.99Å; L778-L789 HydrophobicContact CD1-CB 4.07Å; A785-L789 WeakPolarHBondContact O-CB 2.8Å; A785-L789 PolarHBondContact O-N 3.48Å; L786-L789 PolarHBondContact O-N 2.87Å; L789-A792 PolarHBondContact O-N 3.17Å; L789-M793 HydrophobicContact CD1-CG 4.06Å; L789-M793 HydrophobicContact CG-CG 4.34Å; L789-M793 VanDerWaalsContact O-CB 3.29Å; L789-M793 WeakPolarHBondContact O-CB 3.49Å; L789-M793 WeakPolarHBondContact O-CG 3.24Å; L789-M793 PolarHBondContact O-N 2.93Å; L789-I803 HydrophobicContact CB-CD1 4.15Å; L789-I803 HydrophobicContact CD2-CD1 3.89Å; L789-I803 HydrophobicContact CD2-CG1 4.13Å; L789-I803 HydrophobicContact CG-CD1 3.69Å; L789-I803 HydrophobicContact CG-CG1 4.05Å |
| 790 | A | 89 | Confident | 87.2 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -61.7 | -45.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111 | L786 A792 M793 G794 G795 G799 I800 I803 | L786-A790 VanDerWaalsContact O-CB 3.23Å; L786-A790 WeakPolarHBondContact O-CB 3.42Å; L786-A790 PolarHBondContact O-N 3.22Å; A790-A792 VanDerWaalsContact C-N 3.33Å; A790-A792 PolarHBondContact O-N 3.13Å; A790-M793 CarbonylContact O-C 3.59Å; A790-M793 PolarHBondContact O-N 3.26Å; A790-G794 PolarHBondContact O-N 3.38Å; A790-G795 PolarHBondContact O-N 2.88Å; A790-G799 VanDerWaalsContact O-CA 3.23Å; A790-G799 WeakPolarHBondContact O-CA 3.49Å; A790-I800 HydrophobicContact CB-CG1 4.1Å; A790-I803 HydrophobicContact CB-CD1 4.27Å |
| 791 | N | 87.8 | Confident | 87.7 | Confident | 108 Ų | 108 | 36.3 Ų | 36.3 | 58% | 0.578 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -62.3 | -38.2 | 176.6 | -71.1 | -16.6 | 0 | 0 | 0 | 112.6 | K787 M793 | K787-N791 VanDerWaalsContact O-CB 3.22Å; K787-N791 WeakPolarHBondContact O-CB 3.41Å; K787-N791 PolarHBondContact O-N 3.34Å; K787-N791 PolarHBondContact O-ND2 3.2Å; N791-M793 VanDerWaalsContact C-N 3.3Å; N791-M793 PolarHBondContact O-N 3.01Å |
| 792 | A | 85.8 | Confident | 87.9 | Confident | 34 Ų | 34 | 36.2 Ų | 36.2 | 28% | 0.281 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -70.7 | -24.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | I740 M744 Q788 L789 A790 | I740-A792 HydrophobicContact CD1-CB 3.79Å; I740-A792 HydrophobicContact CG1-CB 3.7Å; M744-A792 HydrophobicContact CE-CB 4.34Å; M744-A792 WeakPolarHBondContact CE-O 3.41Å; M744-A792 HydrophobicContact CG-CB 3.83Å; M744-A792 HydrophobicContact SD-CB 3.75Å; Q788-A792 WeakPolarHBondContact O-CB 3.45Å; Q788-A792 PolarHBondContact O-N 3.14Å; L789-A792 PolarHBondContact O-N 3.17Å; A790-A792 VanDerWaalsContact C-N 3.33Å; A790-A792 PolarHBondContact O-N 3.13Å |
| 793 | M | 86.2 | Confident | 88.2 | Confident | 12 Ų | 12 | 33.9 Ų | 33.9 | 6% | 0.059 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -97.5 | -3 | -179 | -67.4 | -66.3 | -63.5 | 0 | 0 | 114.4 | I747 V754 L757 L789 A790 N791 N802 I803 | I747-M793 HydrophobicContact CD1-SD 4.31Å; V754-M793 HydrophobicContact CG2-CE 4.18Å; L757-M793 HydrophobicContact CB-CE 4.02Å; L757-M793 HydrophobicContact CB-SD 4.44Å; L757-M793 HydrophobicContact CD2-CE 3.67Å; L757-M793 HydrophobicContact CD2-CG 4.35Å; L757-M793 HydrophobicContact CD2-SD 4.03Å; L789-M793 HydrophobicContact CD1-CG 4.06Å; L789-M793 HydrophobicContact CG-CG 4.34Å; L789-M793 VanDerWaalsContact O-CB 3.29Å; L789-M793 WeakPolarHBondContact O-CB 3.49Å; L789-M793 WeakPolarHBondContact O-CG 3.24Å; L789-M793 PolarHBondContact O-N 2.93Å; A790-M793 CarbonylContact O-C 3.59Å; A790-M793 PolarHBondContact O-N 3.26Å; N791-M793 VanDerWaalsContact C-N 3.3Å; N791-M793 PolarHBondContact O-N 3.01Å; M793-N802 HydrophobicContact CB-CB 4.24Å; M793-N802 HydrophobicContact CE-CB 4.16Å; M793-N802 PolarHBondContact O-ND2 3.14Å; M793-I803 HydrophobicContact CB-CG1 4.36Å; M793-I803 HydrophobicContact CG-CG1 4.17Å |
| 794 | G | 83.6 | Confident | 88.4 | Confident | 55 Ų | 55 | 33.5 Ų | 33.5 | 57% | 0.567 | 20% | 0.195 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 155.7 | -24.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | A790 | A790-G794 PolarHBondContact O-N 3.38Š|
| 795 | G | 83.9 | Confident | 88.4 | Confident | 25 Ų | 25 | 32.6 Ų | 32.6 | 26% | 0.258 | 20% | 0.195 | S | C | . | . | S | Bend | trans | 94.3 | 136.8 | -170.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A790 V797 D798 G799 | A790-G795 PolarHBondContact O-N 2.88Å; G795-V797 PolarHBondContact O-N 2.9Å; G795-D798 PolarHBondContact O-N 3.19Å; G795-G799 PolarHBondContact O-N 2.99Å |
| 796 | G | 86.1 | Confident | 88.3 | Confident | 20 Ų | 20 | 32.8 Ų | 32.8 | 21% | 0.206 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | 43.4 | -128.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | G799 I800 A836 | G796-G799 PolarHBondContact O-N 3.23Å; G796-I800 PolarHBondContact O-N 3.43Å; G796-A836 WeakPolarHBondContact CA-O 3.45Å |
| 797 | V | 88 | Confident | 88.1 | Confident | 12 Ų | 12 | 33.7 Ų | 33.7 | 7% | 0.073 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -57.2 | -47.3 | -179.4 | 173.3 | 0 | 0 | 0 | 0 | 113.4 | G795 G799 I800 K801 A836 E841 L842 S845 | G795-V797 PolarHBondContact O-N 2.9Å; V797-G799 VanDerWaalsContact C-N 3.32Å; V797-G799 PolarHBondContact O-N 3.41Å; V797-I800 PolarHBondContact O-N 3.18Å; V797-K801 WeakPolarHBondContact O-CB 3.41Å; V797-K801 PolarHBondContact O-N 3.18Å; V797-A836 HydrophobicContact CG2-CB 4.17Å; V797-E841 HydrophobicContact CG2-CB 3.84Å; V797-L842 HydrophobicContact CG1-CD1 4.26Å; V797-L842 HydrophobicContact CG2-CB 4.06Å; V797-L842 HydrophobicContact CG2-CD1 4.39Å; V797-S845 VanDerWaalsContact CG1-CB 3.44Å |
| 798 | D | 86.6 | Confident | 87.7 | Confident | 91 Ų | 91 | 32.1 Ų | 32.1 | 49% | 0.487 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -68.9 | -32.9 | -179.6 | -90.3 | -22.8 | 0 | 0 | 0 | 111.9 | G795 K801 N802 | G795-D798 PolarHBondContact O-N 3.19Å; D798-K801 PolarHBondContact O-N 3.34Å; D798-K801 WeakPolarHBondContact OD1-CD 3.29Å; D798-K801 IonicContact OD1-NZ 2.66Å; D798-N802 VanDerWaalsContact O-CB 3.26Å; D798-N802 WeakPolarHBondContact O-CB 3.44Å; D798-N802 VanDerWaalsContact O-CG 3.22Å; D798-N802 PolarHBondContact O-N 2.88Å; D798-N802 PolarHBondContact O-ND2 3.45Å |
| 799 | G | 89.8 | Confident | 87.2 | Confident | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -58.1 | -47.9 | 169 | 0 | 0 | 0 | 0 | 0 | 112.5 | A790 G795 G796 V797 N802 I803 | A790-G799 VanDerWaalsContact O-CA 3.23Å; A790-G799 WeakPolarHBondContact O-CA 3.49Å; G795-G799 PolarHBondContact O-N 2.99Å; G796-G799 PolarHBondContact O-N 3.23Å; V797-G799 VanDerWaalsContact C-N 3.32Å; V797-G799 PolarHBondContact O-N 3.41Å; G799-N802 PolarHBondContact O-N 3.07Å; G799-I803 WeakPolarHBondContact O-CG1 3.38Å; G799-I803 PolarHBondContact O-N 3.3Å; G799-I803 VanDerWaalsContact O-N 3.09Å |
| 800 | I | 91.6 | Very high | 86.9 | Confident | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -65.3 | -46.5 | 176.4 | -70.3 | 164.4 | 0 | 0 | 0 | 111.1 | A790 G796 V797 N802 I803 L804 L818 L832 A835 A836 L842 | A790-I800 HydrophobicContact CB-CG1 4.1Å; G796-I800 PolarHBondContact O-N 3.43Å; V797-I800 PolarHBondContact O-N 3.18Å; I800-N802 PolarHBondContact O-N 3.2Å; I800-I803 WeakPolarHBondContact O-CA 3.37Å; I800-I803 WeakPolarHBondContact O-CB 3.26Å; I800-I803 PolarHBondContact O-N 2.93Å; I800-L804 HydrophobicContact CG2-CD1 3.96Å; I800-L804 HydrophobicContact CG2-CG 4.29Å; I800-L804 WeakPolarHBondContact O-CG 3.5Å; I800-L804 PolarHBondContact O-N 2.88Å; I800-L818 HydrophobicContact CG2-CD2 4.11Å; I800-L832 HydrophobicContact CD1-CD1 4.05Å; I800-L832 HydrophobicContact CG2-CD1 3.92Å; I800-A835 HydrophobicContact CD1-CB 4.4Å; I800-A836 HydrophobicContact CD1-CB 3.6Å; I800-L842 HydrophobicContact CB-CD1 4.35Å; I800-L842 HydrophobicContact CD1-CD1 4.39Å; I800-L842 HydrophobicContact CG2-CD1 3.92Å |
| 801 | K | 89 | Confident | 86.7 | Confident | 58 Ų | 58 | 41.4 Ų | 41.4 | 25% | 0.252 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -54.1 | -39.9 | 175.2 | -169 | 176.4 | -168.5 | 167.7 | 0 | 111.8 | V797 D798 L804 N805 S845 L846 | V797-K801 WeakPolarHBondContact O-CB 3.41Å; V797-K801 PolarHBondContact O-N 3.18Å; D798-K801 PolarHBondContact O-N 3.34Å; D798-K801 WeakPolarHBondContact OD1-CD 3.29Å; D798-K801 IonicContact OD1-NZ 2.66Å; K801-L804 PolarHBondContact O-N 3.29Å; K801-N805 WeakPolarHBondContact O-CB 3.42Å; K801-N805 PolarHBondContact O-N 3.28Å; K801-N805 PolarHBondContact O-ND2 3.41Å; K801-N805 VanDerWaalsContact O-ND2 3.12Å; K801-S845 WeakPolarHBondContact CD-OG 3.26Å; K801-S845 VanDerWaalsContact CE-O 3.29Å; K801-S845 WeakPolarHBondContact CE-O 3.38Å; K801-S845 PolarHBondContact NZ-O 3.26Å; K801-S845 PolarHBondContact NZ-OG 2.89Å; K801-L846 HydrophobicContact CB-CD2 4.24Å; K801-L846 HydrophobicContact CG-CD2 4.01Å |
| 802 | N | 90.5 | Very high | 86.5 | Confident | 46 Ų | 46 | 40.2 Ų | 40.2 | 25% | 0.246 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -71.5 | -29.8 | 175.6 | -77.3 | -21.1 | 0 | 0 | 0 | 113.9 | V754 M793 D798 G799 I800 A806 | V754-N802 HydrophobicContact CG2-CB 3.58Å; V754-N802 WeakPolarHBondContact CG2-OD1 3.31Å; M793-N802 HydrophobicContact CB-CB 4.24Å; M793-N802 HydrophobicContact CE-CB 4.16Å; M793-N802 PolarHBondContact O-ND2 3.14Å; D798-N802 VanDerWaalsContact O-CB 3.26Å; D798-N802 WeakPolarHBondContact O-CB 3.44Å; D798-N802 VanDerWaalsContact O-CG 3.22Å; D798-N802 PolarHBondContact O-N 2.88Å; D798-N802 PolarHBondContact O-ND2 3.45Å; G799-N802 PolarHBondContact O-N 3.07Å; I800-N802 PolarHBondContact O-N 3.2Å; N802-A806 WeakPolarHBondContact O-CB 3.11Å; N802-A806 PolarHBondContact O-N 3.21Å |
| 803 | I | 91.3 | Very high | 86.5 | Confident | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -70.3 | -43 | 169.7 | -65 | 162.4 | 0 | 0 | 0 | 110.7 | L757 L771 L786 L789 A790 M793 G799 I800 A806 L807 L818 | L757-I803 HydrophobicContact CD2-CG1 4.29Å; L771-I803 HydrophobicContact CD1-CG2 4.25Å; L771-I803 HydrophobicContact CD2-CG2 3.57Å; L786-I803 HydrophobicContact CD1-CD1 4.05Å; L789-I803 HydrophobicContact CB-CD1 4.15Å; L789-I803 HydrophobicContact CD2-CD1 3.89Å; L789-I803 HydrophobicContact CD2-CG1 4.13Å; L789-I803 HydrophobicContact CG-CD1 3.69Å; L789-I803 HydrophobicContact CG-CG1 4.05Å; A790-I803 HydrophobicContact CB-CD1 4.27Å; M793-I803 HydrophobicContact CB-CG1 4.36Å; M793-I803 HydrophobicContact CG-CG1 4.17Å; G799-I803 WeakPolarHBondContact O-CG1 3.38Å; G799-I803 PolarHBondContact O-N 3.3Å; G799-I803 VanDerWaalsContact O-N 3.09Å; I800-I803 WeakPolarHBondContact O-CA 3.37Å; I800-I803 WeakPolarHBondContact O-CB 3.26Å; I800-I803 PolarHBondContact O-N 2.93Å; I803-A806 WeakPolarHBondContact O-CA 3.47Å; I803-A806 WeakPolarHBondContact O-CB 3.44Å; I803-A806 PolarHBondContact O-N 3.14Å; I803-L807 PolarHBondContact O-N 3.09Å; I803-L818 HydrophobicContact CG2-CD1 4.38Å |
| 804 | L | 90.2 | Very high | 86.6 | Confident | 7 Ų | 7 | 41.9 Ų | 41.9 | 4% | 0.037 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.3 | -44.8 | 177.5 | -64 | 169.5 | 0 | 0 | 0 | 111.8 | I800 K801 A806 L807 G808 A814 L815 L818 L846 | I800-L804 HydrophobicContact CG2-CD1 3.96Å; I800-L804 HydrophobicContact CG2-CG 4.29Å; I800-L804 WeakPolarHBondContact O-CG 3.5Å; I800-L804 PolarHBondContact O-N 2.88Å; K801-L804 PolarHBondContact O-N 3.29Å; L804-A806 PolarHBondContact O-N 2.97Å; L804-L807 HydrophobicContact CD2-CD1 4.43Å; L804-L807 PolarHBondContact O-N 3.24Å; L804-G808 PolarHBondContact O-N 3.37Å; L804-G808 VanDerWaalsContact O-N 3.14Å; L804-A814 HydrophobicContact CB-CB 4.32Å; L804-A814 HydrophobicContact CD2-CB 4Å; L804-L815 HydrophobicContact CD1-CD1 4.02Å; L804-L815 HydrophobicContact CD2-CB 4.06Å; L804-L815 HydrophobicContact CD2-CD1 3.93Å; L804-L818 HydrophobicContact CD2-CB 4.08Å; L804-L818 HydrophobicContact CD2-CD2 3.75Å; L804-L818 HydrophobicContact CG-CD2 4.32Å; L804-L846 HydrophobicContact CD1-CD1 3.6Å; L804-L846 HydrophobicContact CD1-CD2 3.66Å; L804-L846 HydrophobicContact CD1-CG 4.31Å |
| 805 | N | 88.3 | Confident | 86.9 | Confident | 89 Ų | 89 | 39.2 Ų | 39.2 | 48% | 0.476 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -59.3 | -26.9 | 172.8 | -70.5 | -28.9 | 0 | 0 | 0 | 112.6 | V754 K801 | V754-N805 HydrophobicContact CG1-CB 3.65Å; K801-N805 WeakPolarHBondContact O-CB 3.42Å; K801-N805 PolarHBondContact O-N 3.28Å; K801-N805 PolarHBondContact O-ND2 3.41Å; K801-N805 VanDerWaalsContact O-ND2 3.12Å |
| 806 | A | 87.7 | Confident | 87.1 | Confident | 4 Ų | 4 | 42.1 Ų | 42.1 | 3% | 0.033 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -85.4 | -27.6 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114 | V754 L757 A758 L761 N802 I803 L804 G808 | V754-A806 HydrophobicContact CG1-CB 4.2Å; L757-A806 HydrophobicContact CB-CB 3.86Å; L757-A806 HydrophobicContact CD2-CB 3.74Å; L757-A806 HydrophobicContact CG-CB 3.68Å; A758-A806 WeakPolarHBondContact CA-O 3.44Å; A758-A806 HydrophobicContact CB-CB 4.18Å; L761-A806 HydrophobicContact CD1-CB 4.23Å; N802-A806 WeakPolarHBondContact O-CB 3.11Å; N802-A806 PolarHBondContact O-N 3.21Å; I803-A806 WeakPolarHBondContact O-CA 3.47Å; I803-A806 WeakPolarHBondContact O-CB 3.44Å; I803-A806 PolarHBondContact O-N 3.14Å; L804-A806 PolarHBondContact O-N 2.97Å; A806-G808 VanDerWaalsContact C-N 3.35Å |
| 807 | L | 86.8 | Confident | 87.2 | Confident | 18 Ų | 18 | 43.3 Ų | 43.3 | 9% | 0.094 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -65.4 | -40.8 | 167.9 | -76.9 | 168.2 | 0 | 0 | 0 | 111.3 | L761 P767 L771 I803 L804 A814 L818 | L761-L807 HydrophobicContact CD1-CD2 4.19Å; L761-L807 HydrophobicContact CD1-CG 4.44Å; P767-L807 HydrophobicContact CB-CD2 4.19Å; P767-L807 WeakPolarHBondContact O-CD2 3.47Å; L771-L807 HydrophobicContact CB-CD2 4.01Å; L771-L807 HydrophobicContact CD2-CD1 3.81Å; L771-L807 HydrophobicContact CD2-CD2 3.85Å; L771-L807 HydrophobicContact CD2-CG 3.94Å; I803-L807 PolarHBondContact O-N 3.09Å; L804-L807 HydrophobicContact CD2-CD1 4.43Å; L804-L807 PolarHBondContact O-N 3.24Å; L807-A814 HydrophobicContact CB-CB 4.33Å; L807-A814 WeakPolarHBondContact CD1-O 3.28Å; L807-L818 HydrophobicContact CD1-CB 4.19Å |
| 808 | G | 79 | Confident | 87.3 | Confident | 37 Ų | 37 | 42.8 Ų | 42.8 | 38% | 0.381 | 24% | 0.244 | S | C | . | . | trans | 75.5 | 178 | -177 | 0 | 0 | 0 | 0 | 0 | 113.7 | L804 A806 | L804-G808 PolarHBondContact O-N 3.37Å; L804-G808 VanDerWaalsContact O-N 3.14Å; A806-G808 VanDerWaalsContact C-N 3.35Å | ||
| 809 | G | 79.1 | Confident | 87.5 | Confident | 77 Ų | 77 | 38.6 Ų | 38.6 | 79% | 0.794 | 22% | 0.222 | S | C | * | . | S | Bend | trans | 91.2 | -163.2 | -165 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 810 | D | 85 | Confident | 87.4 | Confident | 79 Ų | 79 | 44.1 Ų | 44.1 | 42% | 0.422 | 25% | 0.246 | S | C | . | . | trans | -79 | 163.5 | 166.6 | 69.1 | 87.5 | 0 | 0 | 0 | 111.1 | Q812 T813 A814 | D810-Q812 VanDerWaalsContact C-N 3.33Å; D810-Q812 PolarHBondContact O-N 2.91Å; D810-Q812 WeakPolarHBondContact OD1-CA 3.37Å; D810-Q812 WeakPolarHBondContact OD1-CB 3.39Å; D810-Q812 PolarHBondContact OD1-N 3.12Å; D810-T813 PolarHBondContact OD1-N 2.84Å; D810-T813 PolarHBondContact OD1-OG1 3.45Å; D810-T813 WeakPolarHBondContact OD2-CB 3.08Å; D810-T813 PolarHBondContact OD2-OG1 3.22Å; D810-A814 WeakPolarHBondContact O-CB 3.45Å; D810-A814 PolarHBondContact O-N 3.05Å | ||
| 811 | K | 83.8 | Confident | 87.2 | Confident | 97 Ų | 97 | 45.7 Ų | 45.7 | 42% | 0.422 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.4 | -33.1 | -176.2 | -63.5 | -175.4 | -172.5 | -179.4 | 0 | 113.6 | L815 L846 F847 | K811-L815 WeakPolarHBondContact O-CB 3.41Å; K811-L815 PolarHBondContact O-N 3.17Å; K811-L846 WeakPolarHBondContact CD-O 3.33Å; K811-L846 WeakPolarHBondContact CE-O 3.34Å; K811-L846 PolarHBondContact NZ-O 2.93Å; K811-F847 HydrophobicContact CB-CD1 4.49Å; K811-F847 HydrophobicContact CB-CE1 3.74Å; K811-F847 HydrophobicContact CB-CZ 4.43Å |
| 812 | Q | 83.9 | Confident | 87.2 | Confident | 83 Ų | 83 | 43 Ų | 43 | 39% | 0.388 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -72.7 | -47.4 | -178.2 | -63.1 | 176 | -7.1 | 0 | 0 | 110.2 | D810 L815 K816 F847 A859 | D810-Q812 VanDerWaalsContact C-N 3.33Å; D810-Q812 PolarHBondContact O-N 2.91Å; D810-Q812 WeakPolarHBondContact OD1-CA 3.37Å; D810-Q812 WeakPolarHBondContact OD1-CB 3.39Å; D810-Q812 PolarHBondContact OD1-N 3.12Å; Q812-L815 PolarHBondContact O-N 3.39Å; Q812-K816 VanDerWaalsContact O-CB 3.27Å; Q812-K816 WeakPolarHBondContact O-CB 3.34Å; Q812-K816 PolarHBondContact O-N 2.9Å; Q812-F847 HydrophobicContact CB-CE1 4.48Å; Q812-F847 HydrophobicContact CG-CD1 4.34Å; Q812-F847 HydrophobicContact CG-CE1 3.61Å; Q812-F847 HydrophobicContact CG-CZ 4.2Å; Q812-A859 HydrophobicContact CG-CB 4.43Å |
| 813 | T | 85.7 | Confident | 86.9 | Confident | 76 Ų | 76 | 43.4 Ų | 43.4 | 47% | 0.466 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.4 | -45.3 | 175.5 | -59.5 | 0 | 0 | 0 | 0 | 111.6 | D810 L815 K816 E817 | D810-T813 PolarHBondContact OD1-N 2.84Å; D810-T813 PolarHBondContact OD1-OG1 3.45Å; D810-T813 WeakPolarHBondContact OD2-CB 3.08Å; D810-T813 PolarHBondContact OD2-OG1 3.22Å; T813-L815 VanDerWaalsContact C-N 3.33Å; T813-L815 PolarHBondContact O-N 3.28Å; T813-K816 PolarHBondContact O-N 3.29Å; T813-E817 WeakPolarHBondContact O-CB 3.28Å; T813-E817 PolarHBondContact O-N 3.23Å |
| 814 | A | 88.2 | Confident | 86.6 | Confident | 5 Ų | 5 | 44.7 Ų | 44.7 | 4% | 0.041 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -61 | -41.7 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | L804 L807 D810 L818 | L804-A814 HydrophobicContact CB-CB 4.32Å; L804-A814 HydrophobicContact CD2-CB 4Å; L807-A814 HydrophobicContact CB-CB 4.33Å; L807-A814 WeakPolarHBondContact CD1-O 3.28Å; D810-A814 WeakPolarHBondContact O-CB 3.45Å; D810-A814 PolarHBondContact O-N 3.05Å; A814-L818 WeakPolarHBondContact O-CB 3.34Å; A814-L818 PolarHBondContact O-N 2.74Å |
| 815 | L | 90.5 | Very high | 86.4 | Confident | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -71.1 | -42.4 | 179.9 | -171.4 | 61 | 0 | 0 | 0 | 112.2 | L804 K811 Q812 T813 E817 L818 I819 L832 L846 F847 L857 A860 | L804-L815 HydrophobicContact CD1-CD1 4.02Å; L804-L815 HydrophobicContact CD2-CB 4.06Å; L804-L815 HydrophobicContact CD2-CD1 3.93Å; K811-L815 WeakPolarHBondContact O-CB 3.41Å; K811-L815 PolarHBondContact O-N 3.17Å; Q812-L815 PolarHBondContact O-N 3.39Å; T813-L815 VanDerWaalsContact C-N 3.33Å; T813-L815 PolarHBondContact O-N 3.28Å; L815-E817 VanDerWaalsContact C-N 3.33Å; L815-E817 PolarHBondContact O-N 2.96Å; L815-L818 HydrophobicContact CD1-CD2 4.3Å; L815-L818 WeakPolarHBondContact O-CB 3.47Å; L815-L818 PolarHBondContact O-N 3.04Å; L815-L818 VanDerWaalsContact O-N 3.13Å; L815-I819 HydrophobicContact CG-CD1 3.97Å; L815-I819 WeakPolarHBondContact O-CD1 3.32Å; L815-I819 VanDerWaalsContact O-CG1 3.28Å; L815-I819 WeakPolarHBondContact O-CG1 3.32Å; L815-I819 PolarHBondContact O-N 2.88Å; L815-L832 HydrophobicContact CD1-CD1 4.06Å; L815-L832 HydrophobicContact CD1-CD2 3.68Å; L815-L832 HydrophobicContact CG-CD2 4.37Å; L815-L846 HydrophobicContact CD1-CD1 4.4Å; L815-L846 HydrophobicContact CD2-CD1 4.02Å; L815-F847 HydrophobicContact CD2-CE2 3.56Å; L815-F847 HydrophobicContact CD2-CZ 3.69Å; L815-L857 HydrophobicContact CD2-CD1 4.44Å; L815-A860 HydrophobicContact CB-CB 3.92Å; L815-A860 HydrophobicContact CD2-CB 3.69Å; L815-A860 HydrophobicContact CG-CB 3.91Å |
| 816 | K | 88.3 | Confident | 86.3 | Confident | 85 Ų | 85 | 41.8 Ų | 41.8 | 37% | 0.37 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -58.4 | -43.8 | 175.1 | -170.1 | 164.2 | -161.4 | 153.8 | 0 | 112.2 | Q812 T813 K820 A859 A860 G862 | Q812-K816 VanDerWaalsContact O-CB 3.27Å; Q812-K816 WeakPolarHBondContact O-CB 3.34Å; Q812-K816 PolarHBondContact O-N 2.9Å; T813-K816 PolarHBondContact O-N 3.29Å; K816-K820 WeakPolarHBondContact O-CB 3.48Å; K816-K820 PolarHBondContact O-N 3.43Å; K816-A859 PolarHBondContact NZ-O 3.46Å; K816-A860 WeakPolarHBondContact CB-O 3.41Å; K816-A860 WeakPolarHBondContact CG-O 3.46Å; K816-G862 PolarHBondContact NZ-O 3.3Å |
| 817 | E | 88.6 | Confident | 86.3 | Confident | 46 Ų | 46 | 46.5 Ų | 46.5 | 22% | 0.215 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -72.2 | -28.9 | 175.6 | -78.3 | -63.1 | 128.5 | 0 | 0 | 113.2 | S768 T813 L815 K820 Q821 | S768-E817 VanDerWaalsContact CB-OE2 3.29Å; S768-E817 WeakPolarHBondContact CB-OE2 3.21Å; S768-E817 PolarHBondContact OG-OE2 3.39Å; T813-E817 WeakPolarHBondContact O-CB 3.28Å; T813-E817 PolarHBondContact O-N 3.23Å; L815-E817 VanDerWaalsContact C-N 3.33Å; L815-E817 PolarHBondContact O-N 2.96Å; E817-K820 WeakPolarHBondContact OE1-CD 3.47Å; E817-K820 IonicContact OE1-NZ 3.6Å; E817-K820 PolarHBondContact OE1-NZ 3.02Å; E817-K820 IonicContact OE2-NZ 3.79Å; E817-K820 PolarHBondContact OE2-NZ 2.87Å; E817-Q821 WeakPolarHBondContact O-CG 3.41Å; E817-Q821 PolarHBondContact O-N 3.46Å; E817-Q821 PolarHBondContact O-NE2 3.02Å |
| 818 | L | 90.4 | Very high | 86.4 | Confident | 0 Ų | 0 | 45.6 Ų | 45.6 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -67.2 | -52.8 | 171.5 | 176.8 | 62 | 0 | 0 | 0 | 111.6 | L771 L786 I800 I803 L804 L807 A814 L815 K820 Q821 V822 L832 | L771-L818 HydrophobicContact CD2-CD1 3.71Å; L786-L818 HydrophobicContact CD1-CD1 4.13Å; I800-L818 HydrophobicContact CG2-CD2 4.11Å; I803-L818 HydrophobicContact CG2-CD1 4.38Å; L804-L818 HydrophobicContact CD2-CB 4.08Å; L804-L818 HydrophobicContact CD2-CD2 3.75Å; L804-L818 HydrophobicContact CG-CD2 4.32Å; L807-L818 HydrophobicContact CD1-CB 4.19Å; A814-L818 WeakPolarHBondContact O-CB 3.34Å; A814-L818 PolarHBondContact O-N 2.74Å; L815-L818 HydrophobicContact CD1-CD2 4.3Å; L815-L818 WeakPolarHBondContact O-CB 3.47Å; L815-L818 PolarHBondContact O-N 3.04Å; L815-L818 VanDerWaalsContact O-N 3.13Å; L818-K820 PolarHBondContact O-N 3.21Å; L818-Q821 PolarHBondContact O-N 3.45Å; L818-V822 PolarHBondContact O-N 3.01Å; L818-L832 HydrophobicContact CD2-CD1 3.89Å |
| 819 | I | 89.7 | Confident | 86.9 | Confident | 4 Ų | 4 | 43.9 Ų | 43.9 | 2% | 0.021 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -48.3 | -46 | 175.7 | -72.1 | 159.6 | 0 | 0 | 0 | 110.3 | L815 Q821 V822 G823 G824 L829 L832 A860 | L815-I819 HydrophobicContact CG-CD1 3.97Å; L815-I819 WeakPolarHBondContact O-CD1 3.32Å; L815-I819 VanDerWaalsContact O-CG1 3.28Å; L815-I819 WeakPolarHBondContact O-CG1 3.32Å; L815-I819 PolarHBondContact O-N 2.88Å; I819-Q821 VanDerWaalsContact C-N 3.33Å; I819-Q821 PolarHBondContact O-N 3.3Å; I819-V822 PolarHBondContact O-N 2.81Å; I819-G823 PolarHBondContact O-N 3.23Å; I819-G824 PolarHBondContact O-N 2.84Å; I819-L829 HydrophobicContact CD1-CD2 3.46Å; I819-L829 VanDerWaalsContact CD1-CD2 3.46Å; I819-L829 HydrophobicContact CD1-CG 4.13Å; I819-L829 HydrophobicContact CG1-CD2 4.03Å; I819-L829 HydrophobicContact CG1-CG 4.39Å; I819-L829 HydrophobicContact CG2-CG 4.21Å; I819-L832 HydrophobicContact CD1-CD2 4.28Å; I819-L832 HydrophobicContact CG1-CD2 3.87Å; I819-A860 HydrophobicContact CD1-CB 4.38Å |
| 820 | K | 87.6 | Confident | 87.4 | Confident | 116 Ų | 116 | 44.5 Ų | 44.5 | 50% | 0.504 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -64.4 | -25.5 | 177.7 | 178.3 | -175.9 | 168.9 | -155.3 | 0 | 114.8 | K816 E817 L818 | K816-K820 WeakPolarHBondContact O-CB 3.48Å; K816-K820 PolarHBondContact O-N 3.43Å; E817-K820 WeakPolarHBondContact OE1-CD 3.47Å; E817-K820 IonicContact OE1-NZ 3.6Å; E817-K820 PolarHBondContact OE1-NZ 3.02Å; E817-K820 IonicContact OE2-NZ 3.79Å; E817-K820 PolarHBondContact OE2-NZ 2.87Å; L818-K820 PolarHBondContact O-N 3.21Å |
| 821 | Q | 88.3 | Confident | 87.7 | Confident | 33 Ų | 33 | 41 Ų | 41 | 15% | 0.154 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -81 | -29.2 | 172.8 | -58.9 | -37.2 | -59.2 | 0 | 0 | 113.2 | S768 L775 E817 L818 I819 | S768-Q821 VanDerWaalsContact O-CD 3.22Å; S768-Q821 VanDerWaalsContact O-CG 3.31Å; S768-Q821 WeakPolarHBondContact O-CG 3.17Å; L775-Q821 HydrophobicContact CD1-CB 4.29Å; E817-Q821 WeakPolarHBondContact O-CG 3.41Å; E817-Q821 PolarHBondContact O-N 3.46Å; E817-Q821 PolarHBondContact O-NE2 3.02Å; L818-Q821 PolarHBondContact O-N 3.45Å; I819-Q821 VanDerWaalsContact C-N 3.33Å; I819-Q821 PolarHBondContact O-N 3.3Å |
| 822 | V | 88.2 | Confident | 88 | Confident | 2 Ų | 2 | 36.4 Ų | 36.4 | 1% | 0.012 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -100.1 | 6.2 | -174.7 | -60 | 0 | 0 | 0 | 0 | 114.6 | L775 P782 L786 L818 I819 G828 N831 | L775-V822 HydrophobicContact CD1-CG1 3.81Å; P782-V822 HydrophobicContact CB-CB 4.21Å; L786-V822 HydrophobicContact CB-CG1 4.33Å; L786-V822 HydrophobicContact CD2-CG1 4.19Å; L786-V822 HydrophobicContact CD2-CG2 4.48Å; L818-V822 PolarHBondContact O-N 3.01Å; I819-V822 PolarHBondContact O-N 2.81Å; V822-G828 WeakPolarHBondContact CG2-O 3.17Å; V822-N831 HydrophobicContact CB-CB 4.48Å; V822-N831 HydrophobicContact CG2-CB 4.37Å; V822-N831 PolarHBondContact O-ND2 2.81Å |
| 823 | G | 84.8 | Confident | 88.2 | Confident | 53 Ų | 53 | 33 Ų | 33 | 55% | 0.546 | 19% | 0.186 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 160.5 | -40 | 170.3 | 0 | 0 | 0 | 0 | 0 | 113 | I819 | I819-G823 PolarHBondContact O-N 3.23Š|
| 824 | G | 84 | Confident | 88.3 | Confident | 27 Ų | 27 | 33.6 Ų | 33.6 | 28% | 0.278 | 18% | 0.184 | S | C | . | . | S | Bend | trans | 78.3 | 153.7 | -165.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | I819 G828 | I819-G824 PolarHBondContact O-N 2.84Å; G824-G828 PolarHBondContact O-N 2.86Å |
| 825 | G | 86.5 | Confident | 88.1 | Confident | 25 Ų | 25 | 33.7 Ų | 33.7 | 26% | 0.258 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | 53.7 | -146.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.7 | E827 G828 L829 N870 | G825-E827 VanDerWaalsContact C-N 3.32Å; G825-E827 PolarHBondContact O-N 3.31Å; G825-G828 PolarHBondContact O-N 2.87Å; G825-L829 PolarHBondContact O-N 3.14Å; G825-N870 VanDerWaalsContact C-OD1 3.29Å; G825-N870 WeakPolarHBondContact CA-OD1 3.44Å |
| 826 | A | 86.4 | Confident | 87.9 | Confident | 11 Ų | 11 | 34 Ų | 34 | 9% | 0.091 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -56.4 | -43.1 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L829 K830 N870 Q873 A874 | A826-L829 PolarHBondContact O-N 2.74Å; A826-K830 WeakPolarHBondContact O-CB 3.47Å; A826-K830 PolarHBondContact O-N 2.73Å; A826-N870 WeakPolarHBondContact CA-O 3.3Å; A826-N870 HydrophobicContact CB-CB 4.4Å; A826-N870 PolarHBondContact N-OD1 2.96Å; A826-Q873 HydrophobicContact CB-CB 3.77Å; A826-Q873 HydrophobicContact CB-CG 3.86Å; A826-A874 WeakPolarHBondContact O-CB 3.32Å |
| 827 | E | 87.1 | Confident | 87.7 | Confident | 102 Ų | 102 | 33.3 Ų | 33.3 | 48% | 0.477 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -66.7 | -40.7 | -179.9 | -174 | 64.6 | -175.8 | 0 | 0 | 111.2 | G825 L829 K830 N831 | G825-E827 VanDerWaalsContact C-N 3.32Å; G825-E827 PolarHBondContact O-N 3.31Å; E827-L829 VanDerWaalsContact C-N 3.32Å; E827-L829 PolarHBondContact O-N 3.48Å; E827-K830 PolarHBondContact O-N 2.76Å; E827-N831 VanDerWaalsContact O-CB 3.24Å; E827-N831 WeakPolarHBondContact O-CB 3.23Å; E827-N831 PolarHBondContact O-N 2.64Å; E827-N831 PolarHBondContact O-ND2 3.37Å |
| 828 | G | 89.3 | Confident | 87.6 | Confident | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64.2 | -33.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | V822 G824 G825 L832 | V822-G828 WeakPolarHBondContact CG2-O 3.17Å; G824-G828 PolarHBondContact O-N 2.86Å; G825-G828 PolarHBondContact O-N 2.87Å; G828-L832 VanDerWaalsContact O-CB 3.28Å; G828-L832 WeakPolarHBondContact O-CB 3.3Å; G828-L832 PolarHBondContact O-N 3.31Å |
| 829 | L | 90.2 | Very high | 87.5 | Confident | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -72.6 | -45.7 | 174.1 | -75.8 | 160.1 | 0 | 0 | 0 | 111.7 | I819 G825 A826 E827 N831 L832 F833 A861 N870 A874 | I819-L829 HydrophobicContact CD1-CD2 3.46Å; I819-L829 VanDerWaalsContact CD1-CD2 3.46Å; I819-L829 HydrophobicContact CD1-CG 4.13Å; I819-L829 HydrophobicContact CG1-CD2 4.03Å; I819-L829 HydrophobicContact CG1-CG 4.39Å; I819-L829 HydrophobicContact CG2-CG 4.21Å; G825-L829 PolarHBondContact O-N 3.14Å; A826-L829 PolarHBondContact O-N 2.74Å; E827-L829 VanDerWaalsContact C-N 3.32Å; E827-L829 PolarHBondContact O-N 3.48Å; L829-N831 VanDerWaalsContact C-N 3.34Å; L829-N831 PolarHBondContact O-N 3.11Å; L829-L832 HydrophobicContact CD2-CD2 4.44Å; L829-L832 CarbonylContact O-C 3.59Å; L829-L832 WeakPolarHBondContact O-CB 3.48Å; L829-L832 PolarHBondContact O-N 2.87Å; L829-F833 HydrophobicContact CB-CE2 4.12Å; L829-F833 HydrophobicContact CB-CZ 4.18Å; L829-F833 HydrophobicContact CD2-CE1 4.25Å; L829-F833 HydrophobicContact CD2-CZ 3.94Å; L829-F833 WeakPolarHBondContact O-CB 3.49Å; L829-F833 WeakPolarHBondContact O-CD1 3.38Å; L829-F833 WeakPolarHBondContact O-CD2 3.42Å; L829-F833 WeakPolarHBondContact O-CG 3.27Å; L829-F833 PolarHBondContact O-N 3.29Å; L829-A861 HydrophobicContact CD1-CB 3.55Å; L829-A861 HydrophobicContact CD2-CB 4.11Å; L829-A861 HydrophobicContact CG-CB 4.41Å; L829-N870 HydrophobicContact CD1-CB 3.87Å; L829-A874 HydrophobicContact CB-CB 3.42Å; L829-A874 VanDerWaalsContact CB-CB 3.42Å; L829-A874 HydrophobicContact CD1-CB 4.37Å |
| 830 | K | 89.3 | Confident | 87.3 | Confident | 90 Ų | 90 | 38.7 Ų | 38.7 | 39% | 0.391 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -58.1 | -47.1 | 175.4 | -178.4 | -172.3 | 169.1 | -163.4 | 0 | 111 | A826 E827 L832 F833 E834 A874 | A826-K830 WeakPolarHBondContact O-CB 3.47Å; A826-K830 PolarHBondContact O-N 2.73Å; E827-K830 PolarHBondContact O-N 2.76Å; K830-L832 VanDerWaalsContact C-N 3.27Å; K830-L832 PolarHBondContact O-N 3.22Å; K830-F833 PolarHBondContact O-N 3.37Å; K830-F833 VanDerWaalsContact O-N 3.14Å; K830-E834 VanDerWaalsContact CE-OE1 3.29Å; K830-E834 WeakPolarHBondContact CE-OE1 3.32Å; K830-E834 WeakPolarHBondContact O-CB 3.2Å; K830-E834 PolarHBondContact O-N 3.32Å; K830-A874 HydrophobicContact CB-CB 4.37Å |
| 831 | N | 90.6 | Very high | 87.2 | Confident | 6 Ų | 6 | 38.5 Ų | 38.5 | 3% | 0.032 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.8 | -32.8 | 178.5 | -68.5 | -14.2 | 0 | 0 | 0 | 112.6 | V783 V822 E827 L829 A835 | V783-N831 HydrophobicContact CG2-CB 3.75Å; V783-N831 VanDerWaalsContact CG2-CG 3.44Å; V783-N831 WeakPolarHBondContact CG2-OD1 3.23Å; V822-N831 HydrophobicContact CB-CB 4.48Å; V822-N831 HydrophobicContact CG2-CB 4.37Å; V822-N831 PolarHBondContact O-ND2 2.81Å; E827-N831 VanDerWaalsContact O-CB 3.24Å; E827-N831 WeakPolarHBondContact O-CB 3.23Å; E827-N831 PolarHBondContact O-N 2.64Å; E827-N831 PolarHBondContact O-ND2 3.37Å; L829-N831 VanDerWaalsContact C-N 3.34Å; L829-N831 PolarHBondContact O-N 3.11Å; N831-A835 VanDerWaalsContact O-CB 3.31Å; N831-A835 WeakPolarHBondContact O-CB 3.38Å; N831-A835 PolarHBondContact O-N 2.91Å |
| 832 | L | 91.2 | Very high | 87.3 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -69.9 | -45.3 | 171 | 169.3 | 77.6 | 0 | 0 | 0 | 112 | L786 I800 L815 L818 I819 G828 L829 K830 A835 A836 L842 | L786-L832 HydrophobicContact CD2-CD1 4.3Å; I800-L832 HydrophobicContact CD1-CD1 4.05Å; I800-L832 HydrophobicContact CG2-CD1 3.92Å; L815-L832 HydrophobicContact CD1-CD1 4.06Å; L815-L832 HydrophobicContact CD1-CD2 3.68Å; L815-L832 HydrophobicContact CG-CD2 4.37Å; L818-L832 HydrophobicContact CD2-CD1 3.89Å; I819-L832 HydrophobicContact CD1-CD2 4.28Å; I819-L832 HydrophobicContact CG1-CD2 3.87Å; G828-L832 VanDerWaalsContact O-CB 3.28Å; G828-L832 WeakPolarHBondContact O-CB 3.3Å; G828-L832 PolarHBondContact O-N 3.31Å; L829-L832 HydrophobicContact CD2-CD2 4.44Å; L829-L832 CarbonylContact O-C 3.59Å; L829-L832 WeakPolarHBondContact O-CB 3.48Å; L829-L832 PolarHBondContact O-N 2.87Å; K830-L832 VanDerWaalsContact C-N 3.27Å; K830-L832 PolarHBondContact O-N 3.22Å; L832-A835 CarbonylContact O-C 2.82Å; L832-A835 PolarHBondContact O-N 3.37Å; L832-A836 WeakPolarHBondContact O-CB 2.97Å; L832-A836 PolarHBondContact O-N 3.29Å; L832-L842 HydrophobicContact CD1-CD2 4.34Å; L832-L842 HydrophobicContact CD2-CD2 4Å; L832-L842 HydrophobicContact CG-CD2 3.91Å |
| 833 | F | 88.3 | Confident | 87.4 | Confident | 12 Ų | 12 | 36.9 Ų | 36.9 | 5% | 0.053 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -66.3 | -45.8 | -179.4 | -63.8 | -19.4 | 0 | 0 | 0 | 111.8 | L829 K830 A835 A836 G837 I839 L842 L857 L871 A874 | L829-F833 HydrophobicContact CB-CE2 4.12Å; L829-F833 HydrophobicContact CB-CZ 4.18Å; L829-F833 HydrophobicContact CD2-CE1 4.25Å; L829-F833 HydrophobicContact CD2-CZ 3.94Å; L829-F833 WeakPolarHBondContact O-CB 3.49Å; L829-F833 WeakPolarHBondContact O-CD1 3.38Å; L829-F833 WeakPolarHBondContact O-CD2 3.42Å; L829-F833 WeakPolarHBondContact O-CG 3.27Å; L829-F833 PolarHBondContact O-N 3.29Å; K830-F833 PolarHBondContact O-N 3.37Å; K830-F833 VanDerWaalsContact O-N 3.14Å; F833-A835 PolarHBondContact O-N 3.48Å; F833-A836 PolarHBondContact O-N 3.05Å; F833-A836 VanDerWaalsContact O-N 3.14Å; F833-G837 PolarHBondContact O-N 3.43Å; F833-I839 HydrophobicContact CB-CD1 4.32Å; F833-I839 HydrophobicContact CB-CG1 3.89Å; F833-I839 HydrophobicContact CD1-CG1 4.06Å; F833-I839 HydrophobicContact CD1-CG2 4.18Å; F833-I839 HydrophobicContact CD2-CD1 3.5Å; F833-I839 HydrophobicContact CD2-CG1 3.79Å; F833-I839 HydrophobicContact CD2-CG2 4.5Å; F833-I839 HydrophobicContact CE1-CG2 3.89Å; F833-I839 HydrophobicContact CE2-CD1 3.86Å; F833-I839 HydrophobicContact CE2-CG1 4.29Å; F833-I839 HydrophobicContact CE2-CG2 4.21Å; F833-I839 HydrophobicContact CG-CD1 3.93Å; F833-I839 HydrophobicContact CG-CG1 3.65Å; F833-I839 HydrophobicContact CG-CG2 4.48Å; F833-I839 HydrophobicContact CZ-CG2 3.91Å; F833-L842 HydrophobicContact CD1-CD2 4Å; F833-L842 HydrophobicContact CE1-CD2 4.23Å; F833-L857 HydrophobicContact CE1-CD1 4.26Å; F833-L857 HydrophobicContact CZ-CD1 4.45Å; F833-L857 HydrophobicContact CZ-CD2 4.48Å; F833-L871 HydrophobicContact CE2-CD1 4.03Å; F833-L871 HydrophobicContact CZ-CD1 3.65Å; F833-A874 HydrophobicContact CD2-CB 4.01Å; F833-A874 HydrophobicContact CE2-CB 3.64Å |
| 834 | E | 86.4 | Confident | 87.6 | Confident | 89 Ų | 89 | 37.2 Ų | 37.2 | 42% | 0.416 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -57.4 | -35.7 | 171.6 | -80.1 | -165.2 | -145.5 | 0 | 0 | 112.2 | V783 K787 K830 | V783-E834 HydrophobicContact CG1-CB 3.92Å; K787-E834 WeakPolarHBondContact CE-O 3.29Å; K787-E834 PolarHBondContact NZ-O 2.83Å; K787-E834 IonicContact NZ-OE2 3.15Å; K830-E834 VanDerWaalsContact CE-OE1 3.29Å; K830-E834 WeakPolarHBondContact CE-OE1 3.32Å; K830-E834 WeakPolarHBondContact O-CB 3.2Å; K830-E834 PolarHBondContact O-N 3.32Å |
| 835 | A | 85.3 | Confident | 87.7 | Confident | 6 Ų | 6 | 37.4 Ų | 37.4 | 5% | 0.05 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -78.4 | -26.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114 | L786 K787 I800 N831 L832 F833 | L786-A835 HydrophobicContact CB-CB 4.15Å; L786-A835 HydrophobicContact CD2-CB 3.58Å; L786-A835 HydrophobicContact CG-CB 3.72Å; K787-A835 HydrophobicContact CG-CB 3.81Å; I800-A835 HydrophobicContact CD1-CB 4.4Å; N831-A835 VanDerWaalsContact O-CB 3.31Å; N831-A835 WeakPolarHBondContact O-CB 3.38Å; N831-A835 PolarHBondContact O-N 2.91Å; L832-A835 CarbonylContact O-C 2.82Å; L832-A835 PolarHBondContact O-N 3.37Å; F833-A835 PolarHBondContact O-N 3.48Å |
| 836 | A | 85.9 | Confident | 87.8 | Confident | 7 Ų | 7 | 36.5 Ų | 36.5 | 6% | 0.058 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -75.9 | -37.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G796 V797 I800 L832 F833 S838 L842 | G796-A836 WeakPolarHBondContact CA-O 3.45Å; V797-A836 HydrophobicContact CG2-CB 4.17Å; I800-A836 HydrophobicContact CD1-CB 3.6Å; L832-A836 WeakPolarHBondContact O-CB 2.97Å; L832-A836 PolarHBondContact O-N 3.29Å; F833-A836 PolarHBondContact O-N 3.05Å; F833-A836 VanDerWaalsContact O-N 3.14Å; A836-S838 VanDerWaalsContact C-N 3.28Å; A836-S838 PolarHBondContact O-N 3.46Å; A836-L842 HydrophobicContact CB-CB 4.18Å; A836-L842 HydrophobicContact CB-CD1 4.24Å; A836-L842 HydrophobicContact CB-CD2 3.96Å; A836-L842 HydrophobicContact CB-CG 4.36Å |
| 837 | G | 84 | Confident | 87.9 | Confident | 70 Ų | 70 | 37.5 Ų | 37.5 | 72% | 0.722 | 20% | 0.201 | S | C | * | . | S | Bend | trans | 90.1 | -28.7 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | F833 | F833-G837 PolarHBondContact O-N 3.43Š|
| 838 | S | 86 | Confident | 87.9 | Confident | 33 Ų | 33 | 33.8 Ų | 33.8 | 23% | 0.231 | 19% | 0.19 | C | C | . | . | trans | -143 | 127.6 | 176.1 | 175.8 | 0 | 0 | 0 | 0 | 110.7 | A836 K840 E841 L842 | A836-S838 VanDerWaalsContact C-N 3.28Å; A836-S838 PolarHBondContact O-N 3.46Å; S838-K840 PolarHBondContact OG-N 3.48Å; S838-E841 PolarHBondContact OG-N 2.94Å; S838-L842 VanDerWaalsContact O-CB 3.32Å; S838-L842 WeakPolarHBondContact O-CB 3.46Å; S838-L842 PolarHBondContact O-N 2.94Å | ||
| 839 | I | 88.2 | Confident | 87.7 | Confident | 38 Ų | 38 | 41 Ų | 41 | 20% | 0.195 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -68.8 | -39.6 | 174.6 | -51.1 | 179.8 | 0 | 0 | 0 | 109.9 | F833 L842 M843 L857 L888 | F833-I839 HydrophobicContact CB-CD1 4.32Å; F833-I839 HydrophobicContact CB-CG1 3.89Å; F833-I839 HydrophobicContact CD1-CG1 4.06Å; F833-I839 HydrophobicContact CD1-CG2 4.18Å; F833-I839 HydrophobicContact CD2-CD1 3.5Å; F833-I839 HydrophobicContact CD2-CG1 3.79Å; F833-I839 HydrophobicContact CD2-CG2 4.5Å; F833-I839 HydrophobicContact CE1-CG2 3.89Å; F833-I839 HydrophobicContact CE2-CD1 3.86Å; F833-I839 HydrophobicContact CE2-CG1 4.29Å; F833-I839 HydrophobicContact CE2-CG2 4.21Å; F833-I839 HydrophobicContact CG-CD1 3.93Å; F833-I839 HydrophobicContact CG-CG1 3.65Å; F833-I839 HydrophobicContact CG-CG2 4.48Å; F833-I839 HydrophobicContact CZ-CG2 3.91Å; I839-L842 PolarHBondContact O-N 3.23Å; I839-M843 WeakPolarHBondContact O-CB 3.36Å; I839-M843 PolarHBondContact O-N 2.91Å; I839-L857 HydrophobicContact CG2-CD2 4.21Å; I839-L888 HydrophobicContact CB-CD2 4.39Å; I839-L888 HydrophobicContact CG2-CD1 3.75Å; I839-L888 HydrophobicContact CG2-CD2 4.4Å |
| 840 | K | 86.4 | Confident | 87.6 | Confident | 93 Ų | 93 | 41.7 Ų | 41.7 | 40% | 0.404 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -63.5 | -55.1 | -177.9 | -175.4 | 164.3 | 179.8 | 168 | 0 | 111.7 | S838 L842 M843 E844 L888 | S838-K840 PolarHBondContact OG-N 3.48Å; K840-L842 PolarHBondContact O-N 3.29Å; K840-M843 WeakPolarHBondContact O-CB 3.42Å; K840-M843 PolarHBondContact O-N 3.22Å; K840-M843 VanDerWaalsContact O-N 3.1Å; K840-E844 WeakPolarHBondContact CE-OE1 3.48Å; K840-E844 HydrophobicContact CG-CG 4.36Å; K840-E844 VanDerWaalsContact CG-OE1 3.27Å; K840-E844 WeakPolarHBondContact CG-OE1 3.28Å; K840-E844 IonicContact NZ-OE1 3.01Å; K840-E844 WeakPolarHBondContact O-CB 3.29Å; K840-E844 VanDerWaalsContact O-CG 3.28Å; K840-E844 WeakPolarHBondContact O-CG 2.99Å; K840-E844 PolarHBondContact O-N 3.39Å; K840-L888 HydrophobicContact CB-CD2 3.58Å; K840-L888 HydrophobicContact CG-CD2 4.18Å |
| 841 | E | 86.2 | Confident | 87.5 | Confident | 112 Ų | 112 | 38.9 Ų | 38.9 | 52% | 0.523 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -60.6 | -35.7 | 178.1 | -65.1 | 173.6 | -171.3 | 0 | 0 | 111.8 | V797 S838 S845 | V797-E841 HydrophobicContact CG2-CB 3.84Å; S838-E841 PolarHBondContact OG-N 2.94Å; E841-S845 WeakPolarHBondContact O-CB 3.49Å; E841-S845 PolarHBondContact O-N 2.75Å |
| 842 | L | 88.7 | Confident | 87.3 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -65.1 | -45.2 | 175.7 | -175 | 68.1 | 0 | 0 | 0 | 111.7 | V797 I800 L832 F833 A836 S838 I839 K840 L846 | V797-L842 HydrophobicContact CG1-CD1 4.26Å; V797-L842 HydrophobicContact CG2-CB 4.06Å; V797-L842 HydrophobicContact CG2-CD1 4.39Å; I800-L842 HydrophobicContact CB-CD1 4.35Å; I800-L842 HydrophobicContact CD1-CD1 4.39Å; I800-L842 HydrophobicContact CG2-CD1 3.92Å; L832-L842 HydrophobicContact CD1-CD2 4.34Å; L832-L842 HydrophobicContact CD2-CD2 4Å; L832-L842 HydrophobicContact CG-CD2 3.91Å; F833-L842 HydrophobicContact CD1-CD2 4Å; F833-L842 HydrophobicContact CE1-CD2 4.23Å; A836-L842 HydrophobicContact CB-CB 4.18Å; A836-L842 HydrophobicContact CB-CD1 4.24Å; A836-L842 HydrophobicContact CB-CD2 3.96Å; A836-L842 HydrophobicContact CB-CG 4.36Å; S838-L842 VanDerWaalsContact O-CB 3.32Å; S838-L842 WeakPolarHBondContact O-CB 3.46Å; S838-L842 PolarHBondContact O-N 2.94Å; I839-L842 PolarHBondContact O-N 3.23Å; K840-L842 PolarHBondContact O-N 3.29Å; L842-L846 HydrophobicContact CD1-CD1 3.72Å; L842-L846 HydrophobicContact CD1-CG 4.33Å; L842-L846 HydrophobicContact CG-CD1 4.05Å; L842-L846 VanDerWaalsContact O-CB 3.32Å; L842-L846 WeakPolarHBondContact O-CB 3.22Å; L842-L846 WeakPolarHBondContact O-CG 2.97Å; L842-L846 PolarHBondContact O-N 3.1Å |
| 843 | M | 90.7 | Very high | 87.2 | Confident | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.1 | -51.4 | 175.8 | -174.6 | -174.8 | 76.7 | 0 | 0 | 110.9 | I839 K840 S845 L846 F847 G848 G853 L854 L857 L888 | I839-M843 WeakPolarHBondContact O-CB 3.36Å; I839-M843 PolarHBondContact O-N 2.91Å; K840-M843 WeakPolarHBondContact O-CB 3.42Å; K840-M843 PolarHBondContact O-N 3.22Å; K840-M843 VanDerWaalsContact O-N 3.1Å; M843-S845 PolarHBondContact O-N 2.66Å; M843-L846 PolarHBondContact O-N 3.34Å; M843-F847 PolarHBondContact O-N 3.21Å; M843-G848 PolarHBondContact O-N 3.46Å; M843-G853 VanDerWaalsContact CG-C 3.46Å; M843-G853 WeakPolarHBondContact CG-O 3.31Å; M843-G853 VanDerWaalsContact SD-C 3.58Å; M843-L854 HydrophobicContact SD-CB 4.45Å; M843-L854 HydrophobicContact SD-CD2 3.73Å; M843-L854 HydrophobicContact SD-CG 3.79Å; M843-L857 HydrophobicContact CB-CD2 4.44Å; M843-L857 HydrophobicContact CG-CD2 4.4Å; M843-L857 HydrophobicContact SD-CD2 4.48Å; M843-L888 HydrophobicContact CE-CB 4.24Å; M843-L888 HydrophobicContact SD-CB 4.35Å; M843-L888 HydrophobicContact SD-CD1 4.19Å |
| 844 | E | 88.2 | Confident | 87.3 | Confident | 61 Ų | 61 | 45.4 Ų | 45.4 | 29% | 0.285 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -63.6 | -44.4 | -176.9 | -67.3 | 169.2 | 163.6 | 0 | 0 | 112 | K840 L846 G848 E849 | K840-E844 WeakPolarHBondContact CE-OE1 3.48Å; K840-E844 HydrophobicContact CG-CG 4.36Å; K840-E844 VanDerWaalsContact CG-OE1 3.27Å; K840-E844 WeakPolarHBondContact CG-OE1 3.28Å; K840-E844 IonicContact NZ-OE1 3.01Å; K840-E844 WeakPolarHBondContact O-CB 3.29Å; K840-E844 VanDerWaalsContact O-CG 3.28Å; K840-E844 WeakPolarHBondContact O-CG 2.99Å; K840-E844 PolarHBondContact O-N 3.39Å; E844-L846 VanDerWaalsContact C-N 3.28Å; E844-L846 PolarHBondContact O-N 3.25Å; E844-G848 WeakPolarHBondContact CA-O 3.4Å; E844-G848 PolarHBondContact O-N 3.43Å; E844-E849 HydrophobicContact CG-CG 3.77Å |
| 845 | S | 88 | Confident | 87.4 | Confident | 30 Ų | 30 | 42.9 Ų | 42.9 | 21% | 0.21 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -70.6 | -21.2 | -179 | -167.1 | 0 | 0 | 0 | 0 | 113.7 | V797 K801 E841 M843 | V797-S845 VanDerWaalsContact CG1-CB 3.44Å; K801-S845 WeakPolarHBondContact CD-OG 3.26Å; K801-S845 VanDerWaalsContact CE-O 3.29Å; K801-S845 WeakPolarHBondContact CE-O 3.38Å; K801-S845 PolarHBondContact NZ-O 3.26Å; K801-S845 PolarHBondContact NZ-OG 2.89Å; E841-S845 WeakPolarHBondContact O-CB 3.49Å; E841-S845 PolarHBondContact O-N 2.75Å; M843-S845 PolarHBondContact O-N 2.66Å |
| 846 | L | 88.5 | Confident | 87.6 | Confident | 7 Ų | 7 | 42.7 Ų | 42.7 | 4% | 0.037 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -102.3 | -48.4 | 178.9 | -63.2 | -178.2 | 0 | 0 | 0 | 113.4 | K801 L804 K811 L815 L842 M843 E844 | K801-L846 HydrophobicContact CB-CD2 4.24Å; K801-L846 HydrophobicContact CG-CD2 4.01Å; L804-L846 HydrophobicContact CD1-CD1 3.6Å; L804-L846 HydrophobicContact CD1-CD2 3.66Å; L804-L846 HydrophobicContact CD1-CG 4.31Å; K811-L846 WeakPolarHBondContact CD-O 3.33Å; K811-L846 WeakPolarHBondContact CE-O 3.34Å; K811-L846 PolarHBondContact NZ-O 2.93Å; L815-L846 HydrophobicContact CD1-CD1 4.4Å; L815-L846 HydrophobicContact CD2-CD1 4.02Å; L842-L846 HydrophobicContact CD1-CD1 3.72Å; L842-L846 HydrophobicContact CD1-CG 4.33Å; L842-L846 HydrophobicContact CG-CD1 4.05Å; L842-L846 VanDerWaalsContact O-CB 3.32Å; L842-L846 WeakPolarHBondContact O-CB 3.22Å; L842-L846 WeakPolarHBondContact O-CG 2.97Å; L842-L846 PolarHBondContact O-N 3.1Å; M843-L846 PolarHBondContact O-N 3.34Å; E844-L846 VanDerWaalsContact C-N 3.28Å; E844-L846 PolarHBondContact O-N 3.25Å |
| 847 | F | 88.1 | Confident | 87.7 | Confident | 31 Ų | 31 | 42.4 Ų | 42.4 | 14% | 0.136 | 24% | 0.244 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -121.1 | -17.8 | -168.6 | -55.2 | -60 | 0 | 0 | 0 | 114.1 | K811 Q812 L815 M843 L857 A860 | K811-F847 HydrophobicContact CB-CD1 4.49Å; K811-F847 HydrophobicContact CB-CE1 3.74Å; K811-F847 HydrophobicContact CB-CZ 4.43Å; Q812-F847 HydrophobicContact CB-CE1 4.48Å; Q812-F847 HydrophobicContact CG-CD1 4.34Å; Q812-F847 HydrophobicContact CG-CE1 3.61Å; Q812-F847 HydrophobicContact CG-CZ 4.2Å; L815-F847 HydrophobicContact CD2-CE2 3.56Å; L815-F847 HydrophobicContact CD2-CZ 3.69Å; M843-F847 PolarHBondContact O-N 3.21Å; F847-L857 HydrophobicContact CD2-CB 4.47Å; F847-A860 HydrophobicContact CZ-CB 4.42Å |
| 848 | G | 86.9 | Confident | 88 | Confident | 24 Ų | 24 | 39.5 Ų | 39.5 | 25% | 0.247 | 21% | 0.211 | C | C | . | . | trans | 108.2 | -175.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | M843 E844 G853 | M843-G848 PolarHBondContact O-N 3.46Å; E844-G848 WeakPolarHBondContact CA-O 3.4Å; E844-G848 PolarHBondContact O-N 3.43Å; G848-G853 WeakPolarHBondContact O-CA 3.31Å | ||
| 849 | E | 85.3 | Confident | 88.1 | Confident | 152 Ų | 152 | 39.3 Ų | 39.3 | 71% | 0.71 | 21% | 0.212 | S | C | * | . | S | Bend | trans | -86.2 | 163.3 | 179 | -72.2 | 167.4 | -139.4 | 0 | 0 | 111.6 | E844 G853 | E844-E849 HydrophobicContact CG-CG 3.77Å; E849-G853 PolarHBondContact O-N 3.17Å |
| 850 | G | 87.1 | Confident | 87.9 | Confident | 14 Ų | 14 | 37.6 Ų | 37.6 | 14% | 0.144 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | 60.4 | -138.8 | 171.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | G853 L854 | G850-G853 PolarHBondContact O-N 3.44Å; G850-L854 PolarHBondContact O-N 3.28Å |
| 851 | S | 87.1 | Confident | 87.9 | Confident | 32 Ų | 32 | 33.6 Ų | 33.6 | 22% | 0.224 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -67.7 | -37.8 | -172.3 | 54.3 | 0 | 0 | 0 | 0 | 114.5 | G853 A855 N898 A902 | S851-G853 VanDerWaalsContact C-N 3.33Å; S851-A855 VanDerWaalsContact O-CB 3.24Å; S851-A855 WeakPolarHBondContact O-CB 3.43Å; S851-A855 PolarHBondContact O-N 2.89Å; S851-N898 WeakPolarHBondContact CB-O 3.41Å; S851-A902 WeakPolarHBondContact O-CB 3.16Å |
| 852 | E | 86.3 | Confident | 87.7 | Confident | 154 Ų | 154 | 29.6 Ų | 29.6 | 72% | 0.72 | 18% | 0.177 | S | C | * | . | H | α-helix | trans | -64.8 | -39.5 | 174 | -67.8 | -165.6 | 159.8 | 0 | 0 | 111.4 | A855 G856 | E852-A855 PolarHBondContact O-N 2.86Å; E852-G856 PolarHBondContact O-N 3.35Å; E852-G856 VanDerWaalsContact O-N 3.08Å |
| 853 | G | 89.5 | Confident | 87.3 | Confident | 0 Ų | 0 | 30.6 Ų | 30.6 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -57.3 | -56.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | M843 G848 E849 G850 S851 A855 G856 L857 | M843-G853 VanDerWaalsContact CG-C 3.46Å; M843-G853 WeakPolarHBondContact CG-O 3.31Å; M843-G853 VanDerWaalsContact SD-C 3.58Å; G848-G853 WeakPolarHBondContact O-CA 3.31Å; E849-G853 PolarHBondContact O-N 3.17Å; G850-G853 PolarHBondContact O-N 3.44Å; S851-G853 VanDerWaalsContact C-N 3.33Å; G853-A855 PolarHBondContact O-N 2.97Å; G853-G856 PolarHBondContact O-N 3.31Å; G853-L857 PolarHBondContact O-N 3.45Å; G853-L857 VanDerWaalsContact O-N 3.14Å |
| 854 | L | 90.6 | Very high | 86.8 | Confident | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.9 | -41.1 | 179.2 | -74.4 | 168.5 | 0 | 0 | 0 | 111.9 | M843 G850 G856 L857 I858 L888 N898 L899 A902 | M843-L854 HydrophobicContact SD-CB 4.45Å; M843-L854 HydrophobicContact SD-CD2 3.73Å; M843-L854 HydrophobicContact SD-CG 3.79Å; G850-L854 PolarHBondContact O-N 3.28Å; L854-G856 PolarHBondContact O-N 3.03Å; L854-L857 PolarHBondContact O-N 2.91Å; L854-L857 VanDerWaalsContact O-N 3.16Å; L854-I858 VanDerWaalsContact O-CG1 3.31Å; L854-I858 WeakPolarHBondContact O-CG1 3.1Å; L854-I858 PolarHBondContact O-N 3.23Å; L854-L888 HydrophobicContact CD2-CB 4.03Å; L854-L888 HydrophobicContact CD2-CD1 4.1Å; L854-N898 HydrophobicContact CD1-CB 4.45Å; L854-L899 HydrophobicContact CD1-CB 4.23Å; L854-L899 HydrophobicContact CD1-CD1 4.28Å; L854-L899 HydrophobicContact CD2-CD1 4.5Å; L854-A902 HydrophobicContact CB-CB 3.42Å; L854-A902 VanDerWaalsContact CB-CB 3.42Å |
| 855 | A | 89.3 | Confident | 86.7 | Confident | 36 Ų | 36 | 38.5 Ų | 38.5 | 30% | 0.298 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -63 | -42.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S851 E852 G853 L857 I858 A859 A902 | S851-A855 VanDerWaalsContact O-CB 3.24Å; S851-A855 WeakPolarHBondContact O-CB 3.43Å; S851-A855 PolarHBondContact O-N 2.89Å; E852-A855 PolarHBondContact O-N 2.86Å; G853-A855 PolarHBondContact O-N 2.97Å; A855-L857 VanDerWaalsContact C-N 3.3Å; A855-L857 PolarHBondContact O-N 2.87Å; A855-I858 PolarHBondContact O-N 3.46Å; A855-A859 WeakPolarHBondContact O-CB 3.39Å; A855-A859 PolarHBondContact O-N 3.43Å; A855-A902 HydrophobicContact CB-CB 4.11Å |
| 856 | G | 88.2 | Confident | 86.6 | Confident | 2 Ų | 2 | 42.4 Ų | 42.4 | 2% | 0.021 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.3 | -36.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E852 G853 L854 A860 | E852-G856 PolarHBondContact O-N 3.35Å; E852-G856 VanDerWaalsContact O-N 3.08Å; G853-G856 PolarHBondContact O-N 3.31Å; L854-G856 PolarHBondContact O-N 3.03Å; G856-A860 WeakPolarHBondContact O-CB 3.43Å; G856-A860 PolarHBondContact O-N 2.98Å |
| 857 | L | 89.2 | Confident | 86.5 | Confident | 2 Ų | 2 | 42 Ų | 42 | 1% | 0.01 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -71.6 | -44.4 | 177.6 | -167.3 | 60.9 | 0 | 0 | 0 | 112.1 | L815 F833 I839 M843 F847 G853 L854 A855 A859 A860 A861 L871 L888 | L815-L857 HydrophobicContact CD2-CD1 4.44Å; F833-L857 HydrophobicContact CE1-CD1 4.26Å; F833-L857 HydrophobicContact CZ-CD1 4.45Å; F833-L857 HydrophobicContact CZ-CD2 4.48Å; I839-L857 HydrophobicContact CG2-CD2 4.21Å; M843-L857 HydrophobicContact CB-CD2 4.44Å; M843-L857 HydrophobicContact CG-CD2 4.4Å; M843-L857 HydrophobicContact SD-CD2 4.48Å; F847-L857 HydrophobicContact CD2-CB 4.47Å; G853-L857 PolarHBondContact O-N 3.45Å; G853-L857 VanDerWaalsContact O-N 3.14Å; L854-L857 PolarHBondContact O-N 2.91Å; L854-L857 VanDerWaalsContact O-N 3.16Å; A855-L857 VanDerWaalsContact C-N 3.3Å; A855-L857 PolarHBondContact O-N 2.87Å; L857-A859 PolarHBondContact O-N 3.08Å; L857-A860 PolarHBondContact O-N 3.36Å; L857-A861 VanDerWaalsContact O-CB 3.3Å; L857-A861 WeakPolarHBondContact O-CB 3.26Å; L857-A861 PolarHBondContact O-N 3.5Å; L857-L871 HydrophobicContact CD2-CD1 3.76Å; L857-L871 HydrophobicContact CD2-CD2 4.21Å; L857-L871 HydrophobicContact CG-CD1 3.92Å; L857-L871 HydrophobicContact CG-CD2 4.18Å; L857-L888 HydrophobicContact CD2-CD1 4.43Å |
| 858 | I | 89.9 | Confident | 86.7 | Confident | 8 Ų | 8 | 40.6 Ų | 40.6 | 4% | 0.041 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61.3 | -43.7 | 175.8 | -67.2 | 163.3 | 0 | 0 | 0 | 111 | L854 A855 A860 A861 G862 G863 L868 L871 L899 A902 I903 | L854-I858 VanDerWaalsContact O-CG1 3.31Å; L854-I858 WeakPolarHBondContact O-CG1 3.1Å; L854-I858 PolarHBondContact O-N 3.23Å; A855-I858 PolarHBondContact O-N 3.46Å; I858-A860 VanDerWaalsContact C-N 3.34Å; I858-A860 PolarHBondContact O-N 3Å; I858-A861 PolarHBondContact O-N 2.92Å; I858-G862 PolarHBondContact O-N 3.39Å; I858-G862 VanDerWaalsContact O-N 3.11Å; I858-G863 PolarHBondContact O-N 3.47Å; I858-L868 HydrophobicContact CD1-CD1 4.14Å; I858-L868 HydrophobicContact CG1-CD1 4.34Å; I858-L871 HydrophobicContact CG1-CD2 3.7Å; I858-L899 HydrophobicContact CD1-CD1 4.4Å; I858-A902 HydrophobicContact CD1-CB 4.16Å; I858-I903 HydrophobicContact CD1-CG1 3.9Å |
| 859 | A | 87.3 | Confident | 86.9 | Confident | 30 Ų | 30 | 43.3 Ų | 43.3 | 25% | 0.248 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.4 | -40 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q812 K816 A855 L857 | Q812-A859 HydrophobicContact CG-CB 4.43Å; K816-A859 PolarHBondContact NZ-O 3.46Å; A855-A859 WeakPolarHBondContact O-CB 3.39Å; A855-A859 PolarHBondContact O-N 3.43Å; L857-A859 PolarHBondContact O-N 3.08Å |
| 860 | A | 85.2 | Confident | 87.1 | Confident | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.008 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -71.9 | -39.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L815 K816 I819 F847 G856 L857 I858 G862 | L815-A860 HydrophobicContact CB-CB 3.92Å; L815-A860 HydrophobicContact CD2-CB 3.69Å; L815-A860 HydrophobicContact CG-CB 3.91Å; K816-A860 WeakPolarHBondContact CB-O 3.41Å; K816-A860 WeakPolarHBondContact CG-O 3.46Å; I819-A860 HydrophobicContact CD1-CB 4.38Å; F847-A860 HydrophobicContact CZ-CB 4.42Å; G856-A860 WeakPolarHBondContact O-CB 3.43Å; G856-A860 PolarHBondContact O-N 2.98Å; L857-A860 PolarHBondContact O-N 3.36Å; I858-A860 VanDerWaalsContact C-N 3.34Å; I858-A860 PolarHBondContact O-N 3Å; A860-G862 VanDerWaalsContact C-N 3.26Å; A860-G862 PolarHBondContact O-N 3.24Å |
| 861 | A | 86.2 | Confident | 87.3 | Confident | 9 Ų | 9 | 36.3 Ų | 36.3 | 7% | 0.074 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.2 | -32.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | L829 L857 I858 G867 L871 | L829-A861 HydrophobicContact CD1-CB 3.55Å; L829-A861 HydrophobicContact CD2-CB 4.11Å; L829-A861 HydrophobicContact CG-CB 4.41Å; L857-A861 VanDerWaalsContact O-CB 3.3Å; L857-A861 WeakPolarHBondContact O-CB 3.26Å; L857-A861 PolarHBondContact O-N 3.5Å; I858-A861 PolarHBondContact O-N 2.92Å; A861-G867 WeakPolarHBondContact CB-O 3.47Å; A861-L871 HydrophobicContact CB-CB 4.3Å |
| 862 | G | 81.6 | Confident | 87.5 | Confident | 29 Ų | 29 | 35 Ų | 35 | 30% | 0.299 | 19% | 0.192 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 173.7 | -32.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | K816 I858 A860 | K816-G862 PolarHBondContact NZ-O 3.3Å; I858-G862 PolarHBondContact O-N 3.39Å; I858-G862 VanDerWaalsContact O-N 3.11Å; A860-G862 VanDerWaalsContact C-N 3.26Å; A860-G862 PolarHBondContact O-N 3.24Å |
| 863 | G | 80.1 | Confident | 87.6 | Confident | 21 Ų | 21 | 34 Ų | 34 | 22% | 0.216 | 19% | 0.187 | C | C | . | . | S | Bend | trans | 85.7 | 151 | -162.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | I858 G867 | I858-G863 PolarHBondContact O-N 3.47Å; G863-G867 PolarHBondContact O-N 2.87Å |
| 864 | E | 80.4 | Confident | 87.5 | Confident | 166 Ų | 166 | 34.7 Ų | 34.7 | 78% | 0.776 | 19% | 0.192 | S | C | * | . | H | α-helix | trans | 53.3 | -152.5 | 174.3 | -55.7 | 171.8 | -169.7 | 0 | 0 | 113.2 | E866 G867 L868 | E864-E866 VanDerWaalsContact C-N 3.27Å; E864-E866 PolarHBondContact O-N 3.44Å; E864-G867 PolarHBondContact O-N 3.16Å; E864-L868 PolarHBondContact O-N 3.45Å; E864-L868 VanDerWaalsContact O-N 3.08Å |
| 865 | L | 86.1 | Confident | 87.3 | Confident | 60 Ų | 60 | 35 Ų | 35 | 31% | 0.314 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -52.7 | -40.9 | 179.4 | -177.4 | 69.5 | 0 | 0 | 0 | 113.2 | L868 K869 T914 K917 A918 | L865-L868 PolarHBondContact O-N 3.08Å; L865-K869 HydrophobicContact CG-CD 4.4Å; L865-K869 WeakPolarHBondContact O-CB 2.79Å; L865-K869 WeakPolarHBondContact O-CG 3.1Å; L865-K869 PolarHBondContact O-N 3.44Å; L865-T914 HydrophobicContact CB-CG2 4.31Å; L865-T914 HydrophobicContact CD1-CG2 4.18Å; L865-T914 WeakPolarHBondContact CD1-O 3.47Å; L865-K917 HydrophobicContact CD1-CB 3.7Å; L865-A918 HydrophobicContact CD1-CB 4Å |
| 866 | E | 85 | Confident | 87.1 | Confident | 112 Ų | 112 | 35.9 Ų | 35.9 | 52% | 0.523 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -74.5 | -40.6 | -174.7 | -171.6 | 58 | -154.7 | 0 | 0 | 111.2 | E864 L868 K869 N870 | E864-E866 VanDerWaalsContact C-N 3.27Å; E864-E866 PolarHBondContact O-N 3.44Å; E866-L868 VanDerWaalsContact C-N 3.31Å; E866-L868 PolarHBondContact O-N 3.37Å; E866-K869 PolarHBondContact O-N 3.26Å; E866-N870 WeakPolarHBondContact O-CB 3.27Å; E866-N870 PolarHBondContact O-N 3.43Å; E866-N870 PolarHBondContact O-ND2 3.17Å; E866-N870 PolarHBondContact OE1-ND2 3.19Å |
| 867 | G | 87.7 | Confident | 86.8 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -60.1 | -42.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A861 G863 E864 L871 | A861-G867 WeakPolarHBondContact CB-O 3.47Å; G863-G867 PolarHBondContact O-N 2.87Å; E864-G867 PolarHBondContact O-N 3.16Å; G867-L871 VanDerWaalsContact O-CB 3.26Å; G867-L871 WeakPolarHBondContact O-CB 3.4Å; G867-L871 PolarHBondContact O-N 3.14Å |
| 868 | L | 91 | Very high | 86.4 | Confident | 0 Ų | 0 | 38.6 Ų | 38.6 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.7 | -43.2 | 178.5 | -172.4 | 61.8 | 0 | 0 | 0 | 112.6 | I858 E864 L865 E866 L871 I872 L899 I903 T914 L915 A918 | I858-L868 HydrophobicContact CD1-CD1 4.14Å; I858-L868 HydrophobicContact CG1-CD1 4.34Å; E864-L868 PolarHBondContact O-N 3.45Å; E864-L868 VanDerWaalsContact O-N 3.08Å; L865-L868 PolarHBondContact O-N 3.08Å; E866-L868 VanDerWaalsContact C-N 3.31Å; E866-L868 PolarHBondContact O-N 3.37Å; L868-L871 PolarHBondContact O-N 3.04Å; L868-I872 HydrophobicContact CD1-CD1 4.47Å; L868-I872 HydrophobicContact CG-CD1 4.13Å; L868-I872 WeakPolarHBondContact O-CG1 3.27Å; L868-I872 PolarHBondContact O-N 2.73Å; L868-L899 HydrophobicContact CD1-CD1 4.37Å; L868-I903 HydrophobicContact CD1-CD1 4.11Å; L868-I903 HydrophobicContact CD1-CG1 4.16Å; L868-I903 HydrophobicContact CD2-CD1 3.46Å; L868-I903 VanDerWaalsContact CD2-CD1 3.46Å; L868-I903 HydrophobicContact CD2-CG1 3.81Å; L868-I903 HydrophobicContact CD2-CG2 4.49Å; L868-I903 HydrophobicContact CG-CD1 4.45Å; L868-T914 HydrophobicContact CD2-CG2 4.39Å; L868-L915 HydrophobicContact CD1-CD1 4.39Å; L868-L915 HydrophobicContact CD2-CB 4.41Å; L868-L915 HydrophobicContact CD2-CD1 3.94Å; L868-L915 HydrophobicContact CG-CD1 4.48Å; L868-A918 HydrophobicContact CB-CB 4.08Å; L868-A918 HydrophobicContact CD2-CB 3.6Å; L868-A918 HydrophobicContact CG-CB 3.65Å |
| 869 | K | 91 | Very high | 85.9 | Confident | 82 Ų | 82 | 40.4 Ų | 40.4 | 36% | 0.357 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -58.8 | -50.2 | 173.8 | -80 | -178.7 | 176 | -171.7 | 0 | 112.4 | L865 E866 L871 I872 Q873 K917 A918 | L865-K869 HydrophobicContact CG-CD 4.4Å; L865-K869 WeakPolarHBondContact O-CB 2.79Å; L865-K869 WeakPolarHBondContact O-CG 3.1Å; L865-K869 PolarHBondContact O-N 3.44Å; E866-K869 PolarHBondContact O-N 3.26Å; K869-L871 PolarHBondContact O-N 3.42Å; K869-I872 PolarHBondContact O-N 3.14Å; K869-Q873 WeakPolarHBondContact O-CB 3.08Å; K869-Q873 PolarHBondContact O-N 3.25Å; K869-K917 WeakPolarHBondContact CE-O 3.15Å; K869-K917 PolarHBondContact NZ-O 3.03Å; K869-A918 HydrophobicContact CG-CB 3.81Å |
| 870 | N | 90.7 | Very high | 85.8 | Confident | 19 Ų | 19 | 43 Ų | 43 | 10% | 0.102 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.8 | -33.6 | 178.6 | -75.7 | -72.1 | 0 | 0 | 0 | 111.4 | G825 A826 L829 E866 A874 | G825-N870 VanDerWaalsContact C-OD1 3.29Å; G825-N870 WeakPolarHBondContact CA-OD1 3.44Å; A826-N870 WeakPolarHBondContact CA-O 3.3Å; A826-N870 HydrophobicContact CB-CB 4.4Å; A826-N870 PolarHBondContact N-OD1 2.96Å; L829-N870 HydrophobicContact CD1-CB 3.87Å; E866-N870 WeakPolarHBondContact O-CB 3.27Å; E866-N870 PolarHBondContact O-N 3.43Å; E866-N870 PolarHBondContact O-ND2 3.17Å; E866-N870 PolarHBondContact OE1-ND2 3.19Å; N870-A874 VanDerWaalsContact O-CB 3.23Å; N870-A874 WeakPolarHBondContact O-CB 3.42Å; N870-A874 PolarHBondContact O-N 3.17Å |
| 871 | L | 91 | Very high | 85.9 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -72.5 | -45.8 | 176.2 | -175.8 | 59.4 | 0 | 0 | 0 | 113.1 | F833 L857 I858 A861 G867 L868 K869 Q873 A874 A875 L885 | F833-L871 HydrophobicContact CE2-CD1 4.03Å; F833-L871 HydrophobicContact CZ-CD1 3.65Å; L857-L871 HydrophobicContact CD2-CD1 3.76Å; L857-L871 HydrophobicContact CD2-CD2 4.21Å; L857-L871 HydrophobicContact CG-CD1 3.92Å; L857-L871 HydrophobicContact CG-CD2 4.18Å; I858-L871 HydrophobicContact CG1-CD2 3.7Å; A861-L871 HydrophobicContact CB-CB 4.3Å; G867-L871 VanDerWaalsContact O-CB 3.26Å; G867-L871 WeakPolarHBondContact O-CB 3.4Å; G867-L871 PolarHBondContact O-N 3.14Å; L868-L871 PolarHBondContact O-N 3.04Å; K869-L871 PolarHBondContact O-N 3.42Å; L871-Q873 VanDerWaalsContact C-N 3.33Å; L871-Q873 PolarHBondContact O-N 3.46Å; L871-A874 PolarHBondContact O-N 3.23Å; L871-A875 VanDerWaalsContact O-CB 3.3Å; L871-A875 WeakPolarHBondContact O-CB 3.38Å; L871-A875 PolarHBondContact O-N 3.41Å; L871-L885 HydrophobicContact CD1-CD2 4.12Å; L871-L885 HydrophobicContact CD2-CD1 4.13Å; L871-L885 HydrophobicContact CD2-CD2 3.98Å; L871-L885 HydrophobicContact CG-CD1 3.86Å; L871-L885 HydrophobicContact CG-CD2 3.75Å; L871-L885 HydrophobicContact CG-CG 4.46Å |
| 872 | I | 90.4 | Very high | 86 | Confident | 5 Ų | 5 | 42.5 Ų | 42.5 | 3% | 0.026 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -58.4 | -46.3 | 174.4 | -70.2 | 167.9 | 0 | 0 | 0 | 110.2 | L868 K869 A874 A875 G876 G877 G881 I882 L885 L915 A918 | L868-I872 HydrophobicContact CD1-CD1 4.47Å; L868-I872 HydrophobicContact CG-CD1 4.13Å; L868-I872 WeakPolarHBondContact O-CG1 3.27Å; L868-I872 PolarHBondContact O-N 2.73Å; K869-I872 PolarHBondContact O-N 3.14Å; I872-A874 PolarHBondContact O-N 2.7Å; I872-A875 PolarHBondContact O-N 3.42Å; I872-G876 PolarHBondContact O-N 3.1Å; I872-G877 WeakPolarHBondContact O-CA 3.5Å; I872-G877 PolarHBondContact O-N 3.06Å; I872-G881 WeakPolarHBondContact O-CA 3.48Å; I872-I882 HydrophobicContact CG2-CG1 4.45Å; I872-L885 HydrophobicContact CB-CD1 4.47Å; I872-L885 HydrophobicContact CG1-CD1 3.62Å; I872-L915 HydrophobicContact CD1-CD1 4.34Å; I872-A918 HydrophobicContact CD1-CB 3.74Å |
| 873 | Q | 89.1 | Confident | 86.3 | Confident | 133 Ų | 133 | 45.9 Ų | 45.9 | 62% | 0.621 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -66.9 | -35.2 | 180 | -169.7 | 172.1 | 18.7 | 0 | 0 | 112.7 | A826 K869 L871 | A826-Q873 HydrophobicContact CB-CB 3.77Å; A826-Q873 HydrophobicContact CB-CG 3.86Å; K869-Q873 WeakPolarHBondContact O-CB 3.08Å; K869-Q873 PolarHBondContact O-N 3.25Å; L871-Q873 VanDerWaalsContact C-N 3.33Å; L871-Q873 PolarHBondContact O-N 3.46Å |
| 874 | A | 88.1 | Confident | 86.7 | Confident | 13 Ų | 13 | 48.1 Ų | 48.1 | 11% | 0.107 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -74.3 | -24.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | A826 L829 K830 F833 N870 L871 I872 G876 | A826-A874 WeakPolarHBondContact O-CB 3.32Å; L829-A874 HydrophobicContact CB-CB 3.42Å; L829-A874 VanDerWaalsContact CB-CB 3.42Å; L829-A874 HydrophobicContact CD1-CB 4.37Å; K830-A874 HydrophobicContact CB-CB 4.37Å; F833-A874 HydrophobicContact CD2-CB 4.01Å; F833-A874 HydrophobicContact CE2-CB 3.64Å; N870-A874 VanDerWaalsContact O-CB 3.23Å; N870-A874 WeakPolarHBondContact O-CB 3.42Å; N870-A874 PolarHBondContact O-N 3.17Å; L871-A874 PolarHBondContact O-N 3.23Å; I872-A874 PolarHBondContact O-N 2.7Å; A874-G876 VanDerWaalsContact C-N 3.33Å |
| 875 | A | 86.3 | Confident | 87.2 | Confident | 7 Ų | 7 | 40.2 Ų | 40.2 | 6% | 0.058 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | 1.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114 | L871 I872 N884 L885 | L871-A875 VanDerWaalsContact O-CB 3.3Å; L871-A875 WeakPolarHBondContact O-CB 3.38Å; L871-A875 PolarHBondContact O-N 3.41Å; I872-A875 PolarHBondContact O-N 3.42Å; A875-N884 HydrophobicContact CB-CB 4.27Å; A875-N884 PolarHBondContact O-ND2 2.71Å; A875-L885 HydrophobicContact CB-CD2 4.07Å; A875-L885 HydrophobicContact CB-CG 4.16Å |
| 876 | G | 84.1 | Confident | 87.2 | Confident | 55 Ų | 55 | 37.7 Ų | 37.7 | 57% | 0.567 | 21% | 0.211 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 138.9 | -26.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | I872 A874 | I872-G876 PolarHBondContact O-N 3.1Å; A874-G876 VanDerWaalsContact C-N 3.33Å |
| 877 | G | 82.3 | Confident | 87.3 | Confident | 23 Ų | 23 | 34.2 Ų | 34.2 | 24% | 0.237 | 21% | 0.206 | C | C | . | . | S | Bend | trans | 82.9 | 149.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | I872 V879 E880 G881 | I872-G877 WeakPolarHBondContact O-CA 3.5Å; I872-G877 PolarHBondContact O-N 3.06Å; G877-V879 PolarHBondContact O-N 3.38Å; G877-E880 PolarHBondContact O-N 3.3Å; G877-G881 PolarHBondContact O-N 2.67Å |
| 878 | G | 80.4 | Confident | 87.2 | Confident | 37 Ų | 37 | 35.1 Ų | 35.1 | 38% | 0.381 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | 47.1 | -132.8 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | E880 G881 I882 | G878-E880 PolarHBondContact O-N 3.32Å; G878-G881 PolarHBondContact O-N 2.82Å; G878-I882 WeakPolarHBondContact O-CD1 3.43Å; G878-I882 WeakPolarHBondContact O-CG1 3.39Å; G878-I882 PolarHBondContact O-N 3.47Å; G878-I882 VanDerWaalsContact O-N 3.14Å |
| 879 | V | 80.4 | Confident | 86.6 | Confident | 47 Ų | 47 | 35.5 Ų | 35.5 | 29% | 0.285 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -50.5 | -51 | 177.6 | 179.1 | 0 | 0 | 0 | 0 | 112.3 | G877 G881 I882 R883 A928 E932 | G877-V879 PolarHBondContact O-N 3.38Å; V879-G881 PolarHBondContact O-N 2.82Å; V879-I882 PolarHBondContact O-N 3.04Å; V879-R883 PolarHBondContact O-N 2.99Å; V879-A928 HydrophobicContact CG2-CB 3.79Å; V879-E932 HydrophobicContact CG1-CG 3.7Å; V879-E932 WeakPolarHBondContact CG1-OE1 3.32Å |
| 880 | E | 84.3 | Confident | 86.3 | Confident | 83 Ų | 83 | 33.4 Ų | 33.4 | 39% | 0.388 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -63.1 | -41 | -178.4 | -166.1 | 64.7 | -120.6 | 0 | 0 | 112.1 | G877 G878 I882 R883 N884 | G877-E880 PolarHBondContact O-N 3.3Å; G878-E880 PolarHBondContact O-N 3.32Å; E880-I882 VanDerWaalsContact C-N 3.32Å; E880-I882 PolarHBondContact O-N 3.03Å; E880-R883 PolarHBondContact O-N 2.92Å; E880-R883 IonicContact OE1-CZ 2.68Å; E880-R883 IonicContact OE1-NH1 3.09Å; E880-R883 PolarHBondContact OE1-NH1 3.49Å; E880-R883 IonicContact OE2-CZ 3.57Å; E880-R883 IonicContact OE2-NH1 2.68Å; E880-R883 PolarHBondContact OE2-NH1 2.91Å; E880-N884 PolarHBondContact O-N 3.16Å; E880-N884 PolarHBondContact O-ND2 3.28Å; E880-N884 VanDerWaalsContact O-ND2 3.1Å; E880-N884 PolarHBondContact OE1-ND2 3.32Å |
| 881 | G | 88.3 | Confident | 85.9 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.4 | -39.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | I872 G877 G878 V879 L885 | I872-G881 WeakPolarHBondContact O-CA 3.48Å; G877-G881 PolarHBondContact O-N 2.67Å; G878-G881 PolarHBondContact O-N 2.82Å; V879-G881 PolarHBondContact O-N 2.82Å; G881-L885 VanDerWaalsContact O-CG 3.31Å; G881-L885 WeakPolarHBondContact O-CG 3.28Å; G881-L885 PolarHBondContact O-N 3.28Å |
| 882 | I | 88.1 | Confident | 85.3 | Confident | 1 Ų | 1 | 41.4 Ų | 41.4 | 1% | 0.005 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -68.7 | -48.4 | 177.7 | -63.8 | 157.4 | 0 | 0 | 0 | 110.4 | I872 G878 V879 E880 N884 L885 I886 A919 A928 L929 E932 | I872-I882 HydrophobicContact CG2-CG1 4.45Å; G878-I882 WeakPolarHBondContact O-CD1 3.43Å; G878-I882 WeakPolarHBondContact O-CG1 3.39Å; G878-I882 PolarHBondContact O-N 3.47Å; G878-I882 VanDerWaalsContact O-N 3.14Å; V879-I882 PolarHBondContact O-N 3.04Å; E880-I882 VanDerWaalsContact C-N 3.32Å; E880-I882 PolarHBondContact O-N 3.03Å; I882-N884 VanDerWaalsContact C-N 3.3Å; I882-N884 PolarHBondContact O-N 3.42Å; I882-L885 PolarHBondContact O-N 2.94Å; I882-L885 VanDerWaalsContact O-N 3.17Å; I882-I886 HydrophobicContact CG2-CD1 3.77Å; I882-I886 HydrophobicContact CG2-CG1 4.37Å; I882-I886 WeakPolarHBondContact O-CG1 3.48Å; I882-I886 PolarHBondContact O-N 2.98Å; I882-A919 HydrophobicContact CD1-CB 3.52Å; I882-A919 HydrophobicContact CG1-CB 4.23Å; I882-A928 HydrophobicContact CD1-CB 3.59Å; I882-L929 HydrophobicContact CG2-CD2 4.08Å; I882-E932 HydrophobicContact CG2-CB 4.29Å |
| 883 | R | 88.3 | Confident | 85.1 | Confident | 99 Ų | 99 | 41.8 Ų | 41.8 | 37% | 0.374 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -50.9 | -50.7 | 176.2 | -171.2 | -174.2 | -58.5 | 133.2 | 9 | 111.6 | V879 E880 L885 I886 G887 E932 | V879-R883 PolarHBondContact O-N 2.99Å; E880-R883 PolarHBondContact O-N 2.92Å; E880-R883 IonicContact OE1-CZ 2.68Å; E880-R883 IonicContact OE1-NH1 3.09Å; E880-R883 PolarHBondContact OE1-NH1 3.49Å; E880-R883 IonicContact OE2-CZ 3.57Å; E880-R883 IonicContact OE2-NH1 2.68Å; E880-R883 PolarHBondContact OE2-NH1 2.91Å; R883-L885 PolarHBondContact O-N 3.33Å; R883-I886 PolarHBondContact O-N 3.02Å; R883-G887 PolarHBondContact O-N 2.71Å; R883-E932 HydrophobicContact CB-CG 4.11Å; R883-E932 VanDerWaalsContact CB-OE2 3.25Å; R883-E932 WeakPolarHBondContact CB-OE2 3.23Å; R883-E932 WeakPolarHBondContact CD-OE2 3.24Å; R883-E932 WeakPolarHBondContact CG-OE2 3.36Å; R883-E932 IonicContact CZ-OE1 3.63Å; R883-E932 IonicContact CZ-OE2 3.4Å; R883-E932 VanDerWaalsContact NE-CD 3.35Å; R883-E932 IonicContact NE-OE1 2.73Å; R883-E932 PolarHBondContact NE-OE1 3.43Å; R883-E932 IonicContact NE-OE2 2.71Å; R883-E932 PolarHBondContact NE-OE2 3.31Å; R883-E932 IonicContact NH2-OE1 3.27Å; R883-E932 PolarHBondContact NH2-OE1 3.48Å; R883-E932 IonicContact NH2-OE2 2.72Å |
| 884 | N | 88.6 | Confident | 85.1 | Confident | 68 Ų | 68 | 38.5 Ų | 38.5 | 36% | 0.364 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65.5 | -38.2 | -177.1 | -73.2 | -40.4 | 0 | 0 | 0 | 112 | A875 E880 I882 G887 L888 | A875-N884 HydrophobicContact CB-CB 4.27Å; A875-N884 PolarHBondContact O-ND2 2.71Å; E880-N884 PolarHBondContact O-N 3.16Å; E880-N884 PolarHBondContact O-ND2 3.28Å; E880-N884 VanDerWaalsContact O-ND2 3.1Å; E880-N884 PolarHBondContact OE1-ND2 3.32Å; I882-N884 VanDerWaalsContact C-N 3.3Å; I882-N884 PolarHBondContact O-N 3.42Å; N884-G887 PolarHBondContact O-N 2.84Å; N884-L888 WeakPolarHBondContact O-CG 3.43Å; N884-L888 PolarHBondContact O-N 3.01Å |
| 885 | L | 89.3 | Confident | 85.2 | Confident | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.005 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -72.3 | -32.7 | 176.2 | -64.5 | -177.6 | 0 | 0 | 0 | 113.9 | L871 I872 A875 G881 I882 R883 L888 G889 L899 | L871-L885 HydrophobicContact CD1-CD2 4.12Å; L871-L885 HydrophobicContact CD2-CD1 4.13Å; L871-L885 HydrophobicContact CD2-CD2 3.98Å; L871-L885 HydrophobicContact CG-CD1 3.86Å; L871-L885 HydrophobicContact CG-CD2 3.75Å; L871-L885 HydrophobicContact CG-CG 4.46Å; I872-L885 HydrophobicContact CB-CD1 4.47Å; I872-L885 HydrophobicContact CG1-CD1 3.62Å; A875-L885 HydrophobicContact CB-CD2 4.07Å; A875-L885 HydrophobicContact CB-CG 4.16Å; G881-L885 VanDerWaalsContact O-CG 3.31Å; G881-L885 WeakPolarHBondContact O-CG 3.28Å; G881-L885 PolarHBondContact O-N 3.28Å; I882-L885 PolarHBondContact O-N 2.94Å; I882-L885 VanDerWaalsContact O-N 3.17Å; R883-L885 PolarHBondContact O-N 3.33Å; L885-L888 HydrophobicContact CD2-CD1 3.78Å; L885-L888 PolarHBondContact O-N 3.46Å; L885-G889 PolarHBondContact O-N 3.47Å; L885-L899 HydrophobicContact CB-CD2 4.21Å |
| 886 | I | 87.7 | Confident | 85.4 | Confident | 6 Ų | 6 | 37.5 Ų | 37.5 | 3% | 0.031 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.6 | -46.8 | 169.6 | -66.6 | 171.2 | 0 | 0 | 0 | 109.4 | I882 R883 L888 G889 G890 G895 L896 L899 E932 | I882-I886 HydrophobicContact CG2-CD1 3.77Å; I882-I886 HydrophobicContact CG2-CG1 4.37Å; I882-I886 WeakPolarHBondContact O-CG1 3.48Å; I882-I886 PolarHBondContact O-N 2.98Å; R883-I886 PolarHBondContact O-N 3.02Å; I886-L888 VanDerWaalsContact C-N 3.29Å; I886-L888 PolarHBondContact O-N 3.45Å; I886-G889 WeakPolarHBondContact O-CA 3.24Å; I886-G889 PolarHBondContact O-N 3.33Å; I886-G890 PolarHBondContact O-N 3.44Å; I886-G890 VanDerWaalsContact O-N 3.07Å; I886-G895 WeakPolarHBondContact O-CA 3.36Å; I886-L896 HydrophobicContact CD1-CD1 4.15Å; I886-L896 HydrophobicContact CG1-CD1 4.21Å; I886-L899 HydrophobicContact CG1-CD2 4.4Å; I886-E932 HydrophobicContact CD1-CB 4.44Å |
| 887 | G | 86.5 | Confident | 85.7 | Confident | 40 Ų | 40 | 38.3 Ų | 38.3 | 41% | 0.412 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -64.7 | -23.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | R883 N884 G889 | R883-G887 PolarHBondContact O-N 2.71Å; N884-G887 PolarHBondContact O-N 2.84Å; G887-G889 VanDerWaalsContact C-N 3.33Å |
| 888 | L | 86 | Confident | 86.2 | Confident | 18 Ų | 18 | 39 Ų | 39 | 9% | 0.094 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -68 | -33.5 | 166.7 | -70.1 | -173.3 | 0 | 0 | 0 | 112.1 | I839 K840 M843 L854 L857 N884 L885 I886 | I839-L888 HydrophobicContact CB-CD2 4.39Å; I839-L888 HydrophobicContact CG2-CD1 3.75Å; I839-L888 HydrophobicContact CG2-CD2 4.4Å; K840-L888 HydrophobicContact CB-CD2 3.58Å; K840-L888 HydrophobicContact CG-CD2 4.18Å; M843-L888 HydrophobicContact CE-CB 4.24Å; M843-L888 HydrophobicContact SD-CB 4.35Å; M843-L888 HydrophobicContact SD-CD1 4.19Å; L854-L888 HydrophobicContact CD2-CB 4.03Å; L854-L888 HydrophobicContact CD2-CD1 4.1Å; L857-L888 HydrophobicContact CD2-CD1 4.43Å; N884-L888 WeakPolarHBondContact O-CG 3.43Å; N884-L888 PolarHBondContact O-N 3.01Å; L885-L888 HydrophobicContact CD2-CD1 3.78Å; L885-L888 PolarHBondContact O-N 3.46Å; I886-L888 VanDerWaalsContact C-N 3.29Å; I886-L888 PolarHBondContact O-N 3.45Å |
| 889 | G | 78.3 | Confident | 86.7 | Confident | 8 Ų | 8 | 37.3 Ų | 37.3 | 8% | 0.082 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -86.5 | -23.1 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | L885 I886 G887 G895 N898 | L885-G889 PolarHBondContact O-N 3.47Å; I886-G889 WeakPolarHBondContact O-CA 3.24Å; I886-G889 PolarHBondContact O-N 3.33Å; G887-G889 VanDerWaalsContact C-N 3.33Å; G889-G895 VanDerWaalsContact C-CA 3.42Å; G889-N898 PolarHBondContact O-ND2 2.93Å |
| 890 | G | 84.8 | Confident | 87.3 | Confident | 38 Ų | 38 | 35.5 Ų | 35.5 | 39% | 0.392 | 20% | 0.196 | S | C | . | . | S | Bend | trans | 152.9 | -147 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | I886 | I886-G890 PolarHBondContact O-N 3.44Å; I886-G890 VanDerWaalsContact O-N 3.07Å |
| 891 | D | 81.9 | Confident | 87.6 | Confident | 93 Ų | 93 | 36 Ų | 36 | 50% | 0.497 | 21% | 0.205 | S | C | . | . | S | Bend | trans | -69.6 | 179.7 | 162.5 | 60.5 | 66.2 | 0 | 0 | 0 | 111.8 | V893 T894 G895 | D891-V893 VanDerWaalsContact C-N 3.32Å; D891-V893 PolarHBondContact O-N 2.92Å; D891-V893 PolarHBondContact OD1-N 2.75Å; D891-T894 VanDerWaalsContact CG-OG1 3.32Å; D891-T894 WeakPolarHBondContact OD1-CB 2.99Å; D891-T894 PolarHBondContact OD1-N 2.78Å; D891-T894 PolarHBondContact OD1-OG1 2.88Å; D891-T894 VanDerWaalsContact OD1-OG1 3.1Å; D891-T894 WeakPolarHBondContact OD2-CB 3.41Å; D891-T894 PolarHBondContact OD2-OG1 2.84Å; D891-G895 VanDerWaalsContact O-CA 3.25Å; D891-G895 WeakPolarHBondContact O-CA 3.24Å; D891-G895 PolarHBondContact O-N 3.07Å |
| 892 | H | 78.5 | Confident | 87.7 | Confident | 94 Ų | 94 | 36.6 Ų | 36.6 | 44% | 0.435 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -55.2 | -42 | -175.4 | -64.3 | -93.4 | 0 | 0 | 0 | 113.6 | L896 E932 | H892-L896 VanDerWaalsContact O-CB 3.23Å; H892-L896 WeakPolarHBondContact O-CB 3.32Å; H892-L896 PolarHBondContact O-N 3.38Å; H892-E932 PolarHBondContact CE1-O 3.38Å; H892-E932 PolarHBondContact ND1-O 3.34Å |
| 893 | V | 86.5 | Confident | 87.9 | Confident | 13 Ų | 13 | 38 Ų | 38 | 8% | 0.079 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -85.6 | -48 | -176.5 | 179 | 0 | 0 | 0 | 0 | 110.7 | D891 G895 L896 K897 N942 E945 | D891-V893 VanDerWaalsContact C-N 3.32Å; D891-V893 PolarHBondContact O-N 2.92Å; D891-V893 PolarHBondContact OD1-N 2.75Å; V893-G895 VanDerWaalsContact C-N 3.35Å; V893-G895 PolarHBondContact O-N 3.41Å; V893-L896 PolarHBondContact O-N 2.96Å; V893-K897 HydrophobicContact CG1-CD 4.02Å; V893-K897 VanDerWaalsContact CG1-CE 3.42Å; V893-K897 WeakPolarHBondContact O-CB 3.19Å; V893-K897 VanDerWaalsContact O-CG 3.28Å; V893-K897 WeakPolarHBondContact O-CG 3.25Å; V893-K897 PolarHBondContact O-N 2.92Å; V893-N942 HydrophobicContact CG2-CB 3.71Å; V893-N942 WeakPolarHBondContact CG2-OD1 3.43Å; V893-E945 HydrophobicContact CG1-CB 4.25Å |
| 894 | T | 88.6 | Confident | 87.7 | Confident | 64 Ų | 64 | 34.8 Ų | 34.8 | 39% | 0.393 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -65 | -40.8 | 179.9 | -54.2 | 0 | 0 | 0 | 0 | 111.2 | D891 N898 | D891-T894 VanDerWaalsContact CG-OG1 3.32Å; D891-T894 WeakPolarHBondContact OD1-CB 2.99Å; D891-T894 PolarHBondContact OD1-N 2.78Å; D891-T894 PolarHBondContact OD1-OG1 2.88Å; D891-T894 VanDerWaalsContact OD1-OG1 3.1Å; D891-T894 WeakPolarHBondContact OD2-CB 3.41Å; D891-T894 PolarHBondContact OD2-OG1 2.84Å; T894-N898 VanDerWaalsContact O-CB 3.32Å; T894-N898 WeakPolarHBondContact O-CB 3.4Å; T894-N898 PolarHBondContact O-N 2.85Å; T894-N898 PolarHBondContact O-ND2 2.81Å |
| 895 | G | 89.9 | Confident | 87.5 | Confident | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.5 | -41.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | I886 G889 D891 V893 N898 L899 | I886-G895 WeakPolarHBondContact O-CA 3.36Å; G889-G895 VanDerWaalsContact C-CA 3.42Å; D891-G895 VanDerWaalsContact O-CA 3.25Å; D891-G895 WeakPolarHBondContact O-CA 3.24Å; D891-G895 PolarHBondContact O-N 3.07Å; V893-G895 VanDerWaalsContact C-N 3.35Å; V893-G895 PolarHBondContact O-N 3.41Å; G895-N898 PolarHBondContact O-N 3.11Å; G895-L899 WeakPolarHBondContact O-CB 3.36Å; G895-L899 PolarHBondContact O-N 2.95Å |
| 896 | L | 90.5 | Very high | 87.4 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -69.4 | -41.4 | 175.9 | -166.8 | 62.5 | 0 | 0 | 0 | 112 | I886 H892 V893 N898 L899 L900 L915 L929 L943 A946 | I886-L896 HydrophobicContact CD1-CD1 4.15Å; I886-L896 HydrophobicContact CG1-CD1 4.21Å; H892-L896 VanDerWaalsContact O-CB 3.23Å; H892-L896 WeakPolarHBondContact O-CB 3.32Å; H892-L896 PolarHBondContact O-N 3.38Å; V893-L896 PolarHBondContact O-N 2.96Å; L896-N898 VanDerWaalsContact C-N 3.32Å; L896-N898 PolarHBondContact O-N 3.34Å; L896-L899 PolarHBondContact O-N 3.28Å; L896-L900 HydrophobicContact CG-CD1 4.17Å; L896-L900 WeakPolarHBondContact O-CB 3.46Å; L896-L900 VanDerWaalsContact O-CG 3.24Å; L896-L900 WeakPolarHBondContact O-CG 3.41Å; L896-L900 PolarHBondContact O-N 3.49Å; L896-L915 HydrophobicContact CD1-CD2 3.7Å; L896-L929 HydrophobicContact CD1-CD2 3.77Å; L896-L943 HydrophobicContact CD2-CD1 3.64Å; L896-A946 HydrophobicContact CB-CB 4.07Å; L896-A946 HydrophobicContact CD2-CB 3.8Å; L896-A946 HydrophobicContact CG-CB 4.03Å |
| 897 | K | 91.4 | Very high | 87.5 | Confident | 72 Ų | 72 | 44.7 Ų | 44.7 | 31% | 0.313 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -56.5 | -44.6 | 170.5 | -74 | 171.6 | -176.5 | 172.7 | 0 | 111.8 | V893 T901 E945 A946 | V893-K897 HydrophobicContact CG1-CD 4.02Å; V893-K897 VanDerWaalsContact CG1-CE 3.42Å; V893-K897 WeakPolarHBondContact O-CB 3.19Å; V893-K897 VanDerWaalsContact O-CG 3.28Å; V893-K897 WeakPolarHBondContact O-CG 3.25Å; V893-K897 PolarHBondContact O-N 2.92Å; K897-T901 WeakPolarHBondContact O-CB 3.29Å; K897-T901 PolarHBondContact O-N 3.39Å; K897-T901 PolarHBondContact O-OG1 3.17Å; K897-E945 WeakPolarHBondContact CE-O 3.38Å; K897-E945 PolarHBondContact NZ-O 3.01Å; K897-E945 IonicContact NZ-OE1 3.74Å; K897-E945 PolarHBondContact NZ-OE1 3.47Å; K897-A946 HydrophobicContact CG-CB 4.06Å |
| 898 | N | 92.2 | Very high | 87.7 | Confident | 38 Ų | 38 | 45.7 Ų | 45.7 | 20% | 0.203 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.8 | -40.6 | 177.5 | -82.7 | -27.8 | 0 | 0 | 0 | 112.5 | S851 L854 G889 T894 G895 L896 T901 A902 | S851-N898 WeakPolarHBondContact CB-O 3.41Å; L854-N898 HydrophobicContact CD1-CB 4.45Å; G889-N898 PolarHBondContact O-ND2 2.93Å; T894-N898 VanDerWaalsContact O-CB 3.32Å; T894-N898 WeakPolarHBondContact O-CB 3.4Å; T894-N898 PolarHBondContact O-N 2.85Å; T894-N898 PolarHBondContact O-ND2 2.81Å; G895-N898 PolarHBondContact O-N 3.11Å; L896-N898 VanDerWaalsContact C-N 3.32Å; L896-N898 PolarHBondContact O-N 3.34Å; N898-T901 PolarHBondContact O-N 3.01Å; N898-A902 VanDerWaalsContact O-CB 3.24Å; N898-A902 WeakPolarHBondContact O-CB 3.24Å; N898-A902 PolarHBondContact O-N 3.27Å |
| 899 | L | 91.8 | Very high | 87.9 | Confident | 1 Ų | 1 | 44.8 Ų | 44.8 | 1% | 0.005 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -66.4 | -44.4 | 177.4 | -178.2 | 58.9 | 0 | 0 | 0 | 112 | L854 I858 L868 L885 I886 G895 L896 A902 I903 L915 | L854-L899 HydrophobicContact CD1-CB 4.23Å; L854-L899 HydrophobicContact CD1-CD1 4.28Å; L854-L899 HydrophobicContact CD2-CD1 4.5Å; I858-L899 HydrophobicContact CD1-CD1 4.4Å; L868-L899 HydrophobicContact CD1-CD1 4.37Å; L885-L899 HydrophobicContact CB-CD2 4.21Å; I886-L899 HydrophobicContact CG1-CD2 4.4Å; G895-L899 WeakPolarHBondContact O-CB 3.36Å; G895-L899 PolarHBondContact O-N 2.95Å; L896-L899 PolarHBondContact O-N 3.28Å; L899-A902 WeakPolarHBondContact O-CB 3.01Å; L899-A902 PolarHBondContact O-N 2.98Å; L899-A902 VanDerWaalsContact O-N 3.15Å; L899-I903 HydrophobicContact CD1-CD1 4.24Å; L899-I903 HydrophobicContact CD1-CG1 4.49Å; L899-I903 HydrophobicContact CG-CD1 4.06Å; L899-I903 WeakPolarHBondContact O-CD1 3.29Å; L899-I903 VanDerWaalsContact O-CG1 3.24Å; L899-I903 WeakPolarHBondContact O-CG1 3.22Å; L899-I903 PolarHBondContact O-N 3.46Å; L899-L915 HydrophobicContact CD2-CD1 3.94Å; L899-L915 HydrophobicContact CD2-CD2 3.95Å; L899-L915 HydrophobicContact CG-CD1 4.47Å; L899-L915 HydrophobicContact CG-CD2 4.34Å |
| 900 | L | 91.9 | Very high | 88.6 | Confident | 8 Ų | 8 | 46.9 Ų | 46.9 | 4% | 0.042 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.3 | -43.3 | 175 | -68.3 | 168.5 | 0 | 0 | 0 | 111.7 | L896 A902 I903 G904 V908 A911 L912 L915 V947 | L896-L900 HydrophobicContact CG-CD1 4.17Å; L896-L900 WeakPolarHBondContact O-CB 3.46Å; L896-L900 VanDerWaalsContact O-CG 3.24Å; L896-L900 WeakPolarHBondContact O-CG 3.41Å; L896-L900 PolarHBondContact O-N 3.49Å; L900-A902 VanDerWaalsContact C-N 3.26Å; L900-A902 PolarHBondContact O-N 3.11Å; L900-I903 PolarHBondContact O-N 2.86Å; L900-G904 PolarHBondContact O-N 3.2Å; L900-G904 VanDerWaalsContact O-N 3.11Å; L900-V908 HydrophobicContact CD1-CG1 4.22Å; L900-A911 HydrophobicContact CB-CB 4.47Å; L900-A911 HydrophobicContact CD2-CB 4.25Å; L900-L912 VanDerWaalsContact CD2-CA 3.46Å; L900-L912 HydrophobicContact CD2-CB 3.81Å; L900-L912 HydrophobicContact CD2-CD1 4.15Å; L900-L915 HydrophobicContact CD2-CB 4.49Å; L900-L915 HydrophobicContact CD2-CD2 4.05Å; L900-V947 HydrophobicContact CD1-CG1 3.63Å |
| 901 | T | 91 | Very high | 88.9 | Confident | 95 Ų | 95 | 45.2 Ų | 45.2 | 58% | 0.583 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -61.6 | -35 | 174 | -56.5 | 0 | 0 | 0 | 0 | 111.9 | K897 N898 | K897-T901 WeakPolarHBondContact O-CB 3.29Å; K897-T901 PolarHBondContact O-N 3.39Å; K897-T901 PolarHBondContact O-OG1 3.17Å; N898-T901 PolarHBondContact O-N 3.01Å |
| 902 | A | 90.7 | Very high | 89.5 | Confident | 11 Ų | 11 | 40.8 Ų | 40.8 | 9% | 0.091 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -75.6 | -29.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | S851 L854 A855 I858 N898 L899 L900 | S851-A902 WeakPolarHBondContact O-CB 3.16Å; L854-A902 HydrophobicContact CB-CB 3.42Å; L854-A902 VanDerWaalsContact CB-CB 3.42Å; A855-A902 HydrophobicContact CB-CB 4.11Å; I858-A902 HydrophobicContact CD1-CB 4.16Å; N898-A902 VanDerWaalsContact O-CB 3.24Å; N898-A902 WeakPolarHBondContact O-CB 3.24Å; N898-A902 PolarHBondContact O-N 3.27Å; L899-A902 WeakPolarHBondContact O-CB 3.01Å; L899-A902 PolarHBondContact O-N 2.98Å; L899-A902 VanDerWaalsContact O-N 3.15Å; L900-A902 VanDerWaalsContact C-N 3.26Å; L900-A902 PolarHBondContact O-N 3.11Å |
| 903 | I | 91.5 | Very high | 90.2 | Very high | 30 Ų | 30 | 36.9 Ų | 36.9 | 15% | 0.154 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -74 | -44.3 | 174.8 | -67.4 | 161.9 | 0 | 0 | 0 | 110.1 | I858 L868 L899 L900 A911 T914 L915 | I858-I903 HydrophobicContact CD1-CG1 3.9Å; L868-I903 HydrophobicContact CD1-CD1 4.11Å; L868-I903 HydrophobicContact CD1-CG1 4.16Å; L868-I903 HydrophobicContact CD2-CD1 3.46Å; L868-I903 VanDerWaalsContact CD2-CD1 3.46Å; L868-I903 HydrophobicContact CD2-CG1 3.81Å; L868-I903 HydrophobicContact CD2-CG2 4.49Å; L868-I903 HydrophobicContact CG-CD1 4.45Å; L899-I903 HydrophobicContact CD1-CD1 4.24Å; L899-I903 HydrophobicContact CD1-CG1 4.49Å; L899-I903 HydrophobicContact CG-CD1 4.06Å; L899-I903 WeakPolarHBondContact O-CD1 3.29Å; L899-I903 VanDerWaalsContact O-CG1 3.24Å; L899-I903 WeakPolarHBondContact O-CG1 3.22Å; L899-I903 PolarHBondContact O-N 3.46Å; L900-I903 PolarHBondContact O-N 2.86Å; I903-A911 HydrophobicContact CG2-CB 4.4Å; I903-T914 HydrophobicContact CG2-CG2 3.73Å; I903-L915 HydrophobicContact CD1-CB 3.84Å; I903-L915 HydrophobicContact CD1-CD1 4Å; I903-L915 HydrophobicContact CD1-CD2 4.34Å; I903-L915 HydrophobicContact CD1-CG 4.26Å |
| 904 | G | 84.4 | Confident | 90.5 | Very high | 33 Ų | 33 | 38.1 Ų | 38.1 | 34% | 0.34 | 23% | 0.234 | S | C | . | . | trans | 73.4 | 178.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | L900 A911 | L900-G904 PolarHBondContact O-N 3.2Å; L900-G904 VanDerWaalsContact O-N 3.11Å; G904-A911 WeakPolarHBondContact O-CA 3.46Å; G904-A911 WeakPolarHBondContact O-CB 3.43Å | ||
| 905 | G | 85.1 | Confident | 90.7 | Very high | 57 Ų | 57 | 35.1 Ų | 35.1 | 59% | 0.588 | 22% | 0.216 | S | C | * | . | trans | 155 | -179.6 | -173.7 | 0 | 0 | 0 | 0 | 0 | 110 | N907 | G905-N907 VanDerWaalsContact C-N 3.26Š| ||
| 906 | D | 85.2 | Confident | 90.7 | Very high | 163 Ų | 163 | 35.1 Ų | 35.1 | 87% | 0.872 | 22% | 0.216 | S | C | * | . | S | Bend | trans | -74.8 | -20.6 | 174.2 | -69.6 | -34.6 | 0 | 0 | 0 | 111.8 | ||
| 907 | N | 89.8 | Confident | 90.7 | Very high | 62 Ų | 62 | 40 Ų | 40 | 33% | 0.332 | 24% | 0.236 | S | C | . | . | S | Bend | trans | -158.2 | 172.8 | 174 | 54.5 | 81.5 | 0 | 0 | 0 | 110.8 | G905 A909 D910 A911 K959 | G905-N907 VanDerWaalsContact C-N 3.26Å; N907-A909 VanDerWaalsContact C-N 3.32Å; N907-A909 PolarHBondContact O-N 3.13Å; N907-A909 WeakPolarHBondContact OD1-CB 3.48Å; N907-A909 PolarHBondContact OD1-N 3.34Å; N907-D910 PolarHBondContact N-OD2 3.15Å; N907-D910 PolarHBondContact ND2-OD2 2.92Å; N907-D910 PolarHBondContact O-N 2.98Å; N907-D910 PolarHBondContact OD1-N 3.47Å; N907-D910 PolarHBondContact OD1-OD2 2.92Å; N907-A911 PolarHBondContact O-N 3.5Å; N907-K959 PolarHBondContact ND2-NZ 2.89Å; N907-K959 PolarHBondContact OD1-NZ 2.83Å |
| 908 | V | 91.2 | Very high | 90.7 | Very high | 61 Ų | 61 | 37 Ų | 37 | 37% | 0.37 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -64.6 | -32.8 | -175.6 | -175.3 | 0 | 0 | 0 | 0 | 112.7 | L900 D910 A911 L912 V947 | L900-V908 HydrophobicContact CD1-CG1 4.22Å; V908-D910 VanDerWaalsContact C-N 3.32Å; V908-D910 PolarHBondContact O-N 3.01Å; V908-A911 PolarHBondContact O-N 3.39Å; V908-L912 WeakPolarHBondContact O-CB 3.34Å; V908-L912 PolarHBondContact O-N 3.46Å; V908-V947 HydrophobicContact CG1-CB 3.91Å; V908-V947 HydrophobicContact CG1-CG1 3.83Å |
| 909 | A | 91.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -64.6 | -35.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | N907 L912 S913 N956 K959 A960 | N907-A909 VanDerWaalsContact C-N 3.32Å; N907-A909 PolarHBondContact O-N 3.13Å; N907-A909 WeakPolarHBondContact OD1-CB 3.48Å; N907-A909 PolarHBondContact OD1-N 3.34Å; A909-L912 PolarHBondContact O-N 3.09Å; A909-S913 VanDerWaalsContact O-CB 3.3Å; A909-S913 WeakPolarHBondContact O-CB 3.49Å; A909-S913 PolarHBondContact O-N 3.33Å; A909-N956 HydrophobicContact CB-CB 4.14Å; A909-N956 VanDerWaalsContact CB-O 3.24Å; A909-N956 WeakPolarHBondContact CB-O 3.26Å; A909-K959 HydrophobicContact CB-CB 3.91Å; A909-K959 HydrophobicContact CB-CD 4Å; A909-K959 HydrophobicContact CB-CG 3.82Å; A909-A960 HydrophobicContact CB-CB 4.42Å; A909-A960 WeakPolarHBondContact O-CB 3.37Å |
| 910 | D | 91 | Very high | 90.2 | Very high | 51 Ų | 51 | 38.1 Ų | 38.1 | 27% | 0.273 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -70.8 | -38 | 177.7 | -55.5 | -32.8 | 0 | 0 | 0 | 111.6 | N907 V908 S913 T914 K959 | N907-D910 PolarHBondContact N-OD2 3.15Å; N907-D910 PolarHBondContact ND2-OD2 2.92Å; N907-D910 PolarHBondContact O-N 2.98Å; N907-D910 PolarHBondContact OD1-N 3.47Å; N907-D910 PolarHBondContact OD1-OD2 2.92Å; V908-D910 VanDerWaalsContact C-N 3.32Å; V908-D910 PolarHBondContact O-N 3.01Å; D910-S913 PolarHBondContact O-N 3.37Å; D910-T914 WeakPolarHBondContact O-CB 3.47Å; D910-T914 PolarHBondContact O-N 3.38Å; D910-T914 PolarHBondContact O-OG1 2.85Å; D910-K959 IonicContact OD1-NZ 3.49Å; D910-K959 PolarHBondContact OD1-NZ 2.89Å; D910-K959 IonicContact OD2-NZ 2.72Å |
| 911 | A | 92.9 | Very high | 90 | Very high | 4 Ų | 4 | 38.8 Ų | 38.8 | 3% | 0.033 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -64.1 | -45 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L900 I903 G904 N907 V908 T914 L915 | L900-A911 HydrophobicContact CB-CB 4.47Å; L900-A911 HydrophobicContact CD2-CB 4.25Å; I903-A911 HydrophobicContact CG2-CB 4.4Å; G904-A911 WeakPolarHBondContact O-CA 3.46Å; G904-A911 WeakPolarHBondContact O-CB 3.43Å; N907-A911 PolarHBondContact O-N 3.5Å; V908-A911 PolarHBondContact O-N 3.39Å; A911-T914 WeakPolarHBondContact O-CB 3.43Å; A911-T914 PolarHBondContact O-N 3.26Å; A911-L915 PolarHBondContact O-N 3.41Å |
| 912 | L | 93.7 | Very high | 89.8 | Confident | 0 Ų | 0 | 36.2 Ų | 36.2 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -64.6 | -42.9 | 176.1 | 177.1 | 63.3 | 0 | 0 | 0 | 111.4 | L900 V908 A909 T914 L915 I916 L929 L943 V947 L957 A960 | L900-L912 VanDerWaalsContact CD2-CA 3.46Å; L900-L912 HydrophobicContact CD2-CB 3.81Å; L900-L912 HydrophobicContact CD2-CD1 4.15Å; V908-L912 WeakPolarHBondContact O-CB 3.34Å; V908-L912 PolarHBondContact O-N 3.46Å; A909-L912 PolarHBondContact O-N 3.09Å; L912-T914 VanDerWaalsContact C-N 3.25Å; L912-T914 PolarHBondContact O-N 3.04Å; L912-L915 WeakPolarHBondContact O-CB 3.39Å; L912-L915 PolarHBondContact O-N 2.81Å; L912-L915 VanDerWaalsContact O-N 3.11Å; L912-I916 HydrophobicContact CD1-CD1 4.02Å; L912-I916 HydrophobicContact CD1-CG1 4.14Å; L912-I916 HydrophobicContact CD2-CD1 4.3Å; L912-I916 HydrophobicContact CG-CD1 3.77Å; L912-I916 HydrophobicContact CG-CG1 4.34Å; L912-I916 WeakPolarHBondContact O-CG1 3.43Å; L912-I916 PolarHBondContact O-N 2.9Å; L912-L929 HydrophobicContact CD1-CD1 4.04Å; L912-L943 HydrophobicContact CD1-CD1 4.09Å; L912-L943 HydrophobicContact CD2-CD1 4.5Å; L912-V947 HydrophobicContact CD2-CG1 3.97Å; L912-L957 HydrophobicContact CD2-CD1 3.74Å; L912-A960 HydrophobicContact CB-CB 3.82Å; L912-A960 HydrophobicContact CD2-CB 3.51Å; L912-A960 HydrophobicContact CG-CB 3.62Å |
| 913 | S | 93.2 | Very high | 89.5 | Confident | 12 Ų | 12 | 42.1 Ų | 42.1 | 8% | 0.084 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -60.9 | -38.2 | 176.1 | -156.7 | 0 | 0 | 0 | 0 | 111.3 | A909 D910 K917 A960 | A909-S913 VanDerWaalsContact O-CB 3.3Å; A909-S913 WeakPolarHBondContact O-CB 3.49Å; A909-S913 PolarHBondContact O-N 3.33Å; D910-S913 PolarHBondContact O-N 3.37Å; S913-K917 VanDerWaalsContact O-CB 3.24Å; S913-K917 WeakPolarHBondContact O-CB 3.33Å; S913-K917 VanDerWaalsContact O-CD 3.29Å; S913-K917 WeakPolarHBondContact O-CD 3.46Å; S913-K917 WeakPolarHBondContact O-CG 3.27Å; S913-K917 PolarHBondContact O-N 2.91Å; S913-K917 WeakPolarHBondContact OG-CE 3.49Å; S913-K917 PolarHBondContact OG-NZ 3.18Å; S913-A960 VanDerWaalsContact CB-O 3.27Å; S913-A960 WeakPolarHBondContact CB-O 3.37Å; S913-A960 PolarHBondContact OG-O 3.34Å |
| 914 | T | 92.1 | Very high | 89.2 | Confident | 39 Ų | 39 | 45.7 Ų | 45.7 | 24% | 0.239 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.8 | -39.8 | 174.3 | -58.1 | 0 | 0 | 0 | 0 | 111.9 | L865 L868 I903 D910 A911 L912 A918 | L865-T914 HydrophobicContact CB-CG2 4.31Å; L865-T914 HydrophobicContact CD1-CG2 4.18Å; L865-T914 WeakPolarHBondContact CD1-O 3.47Å; L868-T914 HydrophobicContact CD2-CG2 4.39Å; I903-T914 HydrophobicContact CG2-CG2 3.73Å; D910-T914 WeakPolarHBondContact O-CB 3.47Å; D910-T914 PolarHBondContact O-N 3.38Å; D910-T914 PolarHBondContact O-OG1 2.85Å; A911-T914 WeakPolarHBondContact O-CB 3.43Å; A911-T914 PolarHBondContact O-N 3.26Å; L912-T914 VanDerWaalsContact C-N 3.25Å; L912-T914 PolarHBondContact O-N 3.04Å; T914-A918 WeakPolarHBondContact O-CB 3.23Å; T914-A918 PolarHBondContact O-N 3.3Å |
| 915 | L | 92.5 | Very high | 89.4 | Confident | 1 Ų | 1 | 44.1 Ų | 44.1 | 1% | 0.005 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.8 | -48.5 | 174.4 | -175.1 | 55 | 0 | 0 | 0 | 112.1 | L868 I872 L896 L899 L900 I903 A911 L912 K917 A918 A919 L929 | L868-L915 HydrophobicContact CD1-CD1 4.39Å; L868-L915 HydrophobicContact CD2-CB 4.41Å; L868-L915 HydrophobicContact CD2-CD1 3.94Å; L868-L915 HydrophobicContact CG-CD1 4.48Å; I872-L915 HydrophobicContact CD1-CD1 4.34Å; L896-L915 HydrophobicContact CD1-CD2 3.7Å; L899-L915 HydrophobicContact CD2-CD1 3.94Å; L899-L915 HydrophobicContact CD2-CD2 3.95Å; L899-L915 HydrophobicContact CG-CD1 4.47Å; L899-L915 HydrophobicContact CG-CD2 4.34Å; L900-L915 HydrophobicContact CD2-CB 4.49Å; L900-L915 HydrophobicContact CD2-CD2 4.05Å; I903-L915 HydrophobicContact CD1-CB 3.84Å; I903-L915 HydrophobicContact CD1-CD1 4Å; I903-L915 HydrophobicContact CD1-CD2 4.34Å; I903-L915 HydrophobicContact CD1-CG 4.26Å; A911-L915 PolarHBondContact O-N 3.41Å; L912-L915 WeakPolarHBondContact O-CB 3.39Å; L912-L915 PolarHBondContact O-N 2.81Å; L912-L915 VanDerWaalsContact O-N 3.11Å; L915-K917 VanDerWaalsContact C-N 3.34Å; L915-K917 PolarHBondContact O-N 3.37Å; L915-A918 CarbonylContact O-C 2.8Å; L915-A918 WeakPolarHBondContact O-CA 3.36Å; L915-A918 WeakPolarHBondContact O-CB 3.33Å; L915-A918 PolarHBondContact O-N 2.85Å; L915-A919 WeakPolarHBondContact O-CB 3.24Å; L915-A919 PolarHBondContact O-N 3.19Å; L915-L929 HydrophobicContact CD2-CD1 4.3Å; L915-L929 HydrophobicContact CD2-CD2 3.87Å; L915-L929 HydrophobicContact CG-CD1 4.13Å; L915-L929 HydrophobicContact CG-CD2 4.34Å |
| 916 | I | 91.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -57.2 | -46.6 | 175.4 | -70.1 | 167.9 | 0 | 0 | 0 | 110.8 | L912 A918 A919 G920 G921 L926 L929 A960 T961 | L912-I916 HydrophobicContact CD1-CD1 4.02Å; L912-I916 HydrophobicContact CD1-CG1 4.14Å; L912-I916 HydrophobicContact CD2-CD1 4.3Å; L912-I916 HydrophobicContact CG-CD1 3.77Å; L912-I916 HydrophobicContact CG-CG1 4.34Å; L912-I916 WeakPolarHBondContact O-CG1 3.43Å; L912-I916 PolarHBondContact O-N 2.9Å; I916-A918 PolarHBondContact O-N 3.08Å; I916-A919 PolarHBondContact O-N 3.35Å; I916-G920 PolarHBondContact O-N 2.79Å; I916-G920 VanDerWaalsContact O-N 3.16Å; I916-G921 VanDerWaalsContact CG2-O 3.29Å; I916-G921 WeakPolarHBondContact CG2-O 3.32Å; I916-G921 PolarHBondContact O-N 3.42Å; I916-L926 HydrophobicContact CD1-CD1 4.09Å; I916-L929 HydrophobicContact CG1-CD1 3.54Å; I916-A960 HydrophobicContact CD1-CB 4.25Å; I916-T961 HydrophobicContact CD1-CG2 3.86Å |
| 917 | K | 90.5 | Very high | 89.9 | Confident | 101 Ų | 101 | 35.6 Ų | 35.6 | 44% | 0.439 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -66.9 | -18.8 | 176.8 | -72.4 | 162.7 | -178.4 | 153 | 0 | 113.6 | L865 K869 S913 L915 | L865-K917 HydrophobicContact CD1-CB 3.7Å; K869-K917 WeakPolarHBondContact CE-O 3.15Å; K869-K917 PolarHBondContact NZ-O 3.03Å; S913-K917 VanDerWaalsContact O-CB 3.24Å; S913-K917 WeakPolarHBondContact O-CB 3.33Å; S913-K917 VanDerWaalsContact O-CD 3.29Å; S913-K917 WeakPolarHBondContact O-CD 3.46Å; S913-K917 WeakPolarHBondContact O-CG 3.27Å; S913-K917 PolarHBondContact O-N 2.91Å; S913-K917 WeakPolarHBondContact OG-CE 3.49Å; S913-K917 PolarHBondContact OG-NZ 3.18Å; L915-K917 VanDerWaalsContact C-N 3.34Å; L915-K917 PolarHBondContact O-N 3.37Å |
| 918 | A | 89.6 | Confident | 89.8 | Confident | 11 Ų | 11 | 33 Ų | 33 | 9% | 0.091 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -89.5 | -36.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L865 L868 K869 I872 T914 L915 I916 | L865-A918 HydrophobicContact CD1-CB 4Å; L868-A918 HydrophobicContact CB-CB 4.08Å; L868-A918 HydrophobicContact CD2-CB 3.6Å; L868-A918 HydrophobicContact CG-CB 3.65Å; K869-A918 HydrophobicContact CG-CB 3.81Å; I872-A918 HydrophobicContact CD1-CB 3.74Å; T914-A918 WeakPolarHBondContact O-CB 3.23Å; T914-A918 PolarHBondContact O-N 3.3Å; L915-A918 CarbonylContact O-C 2.8Å; L915-A918 WeakPolarHBondContact O-CA 3.36Å; L915-A918 WeakPolarHBondContact O-CB 3.33Å; L915-A918 PolarHBondContact O-N 2.85Å; I916-A918 PolarHBondContact O-N 3.08Å |
| 919 | A | 88 | Confident | 89.7 | Confident | 13 Ų | 13 | 30 Ų | 30 | 11% | 0.107 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -66.5 | -36.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | I882 L915 I916 | I882-A919 HydrophobicContact CD1-CB 3.52Å; I882-A919 HydrophobicContact CG1-CB 4.23Å; L915-A919 WeakPolarHBondContact O-CB 3.24Å; L915-A919 PolarHBondContact O-N 3.19Å; I916-A919 PolarHBondContact O-N 3.35Å |
| 920 | G | 85.9 | Confident | 89.6 | Confident | 49 Ų | 49 | 30.2 Ų | 30.2 | 51% | 0.505 | 18% | 0.179 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 176.9 | -14.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | I916 | I916-G920 PolarHBondContact O-N 2.79Å; I916-G920 VanDerWaalsContact O-N 3.16Å |
| 921 | G | 87.1 | Confident | 89.3 | Confident | 22 Ų | 22 | 33.4 Ų | 33.4 | 23% | 0.227 | 19% | 0.192 | C | C | . | . | S | Bend | trans | 108.6 | 178.9 | -162.7 | 0 | 0 | 0 | 0 | 0 | 110.2 | I916 K923 G925 | I916-G921 VanDerWaalsContact CG2-O 3.29Å; I916-G921 WeakPolarHBondContact CG2-O 3.32Å; I916-G921 PolarHBondContact O-N 3.42Å; G921-K923 PolarHBondContact O-N 2.74Å; G921-G925 WeakPolarHBondContact O-CA 3.36Å; G921-G925 PolarHBondContact O-N 3.25Å |
| 922 | V | 88.1 | Confident | 89 | Confident | 41 Ų | 41 | 34 Ų | 34 | 25% | 0.248 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.8 | -47.8 | -168.7 | -179.8 | 0 | 0 | 0 | 0 | 112.7 | L926 T961 N971 | V922-L926 WeakPolarHBondContact O-CB 3.47Å; V922-L926 PolarHBondContact O-N 3.05Å; V922-T961 HydrophobicContact CG1-CG2 4.46Å; V922-T961 VanDerWaalsContact CG1-O 3.24Å; V922-T961 WeakPolarHBondContact CG1-O 3.36Å; V922-T961 WeakPolarHBondContact CG2-O 3.25Å; V922-N971 HydrophobicContact CG1-CB 3.68Å; V922-N971 VanDerWaalsContact CG1-CG 3.45Å |
| 923 | K | 84.5 | Confident | 88.5 | Confident | 134 Ų | 134 | 34 Ų | 34 | 58% | 0.583 | 19% | 0.194 | S | C | * | . | H | α-helix | trans | -68.8 | -74.9 | 179.7 | -172.9 | -175 | 179.4 | -172.8 | 0 | 111.4 | G921 G925 L926 S927 | G921-K923 PolarHBondContact O-N 2.74Å; K923-G925 VanDerWaalsContact C-N 3.29Å; K923-G925 PolarHBondContact O-N 3.5Å; K923-L926 PolarHBondContact O-N 3.42Å; K923-S927 PolarHBondContact O-N 3.1Å; K923-S927 PolarHBondContact O-OG 2.63Å |
| 924 | D | 85 | Confident | 87.9 | Confident | 105 Ų | 105 | 35.6 Ų | 35.6 | 56% | 0.561 | 21% | 0.213 | S | C | * | . | H | α-helix | trans | -65.9 | -33.5 | -168.7 | -46.1 | -26.4 | 0 | 0 | 0 | 112.3 | A928 | D924-A928 VanDerWaalsContact O-CB 3.28Å; D924-A928 WeakPolarHBondContact O-CB 3.45Å; D924-A928 PolarHBondContact O-N 2.82Å |
| 925 | G | 88.9 | Confident | 87.3 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -73.6 | -31.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114 | G921 K923 L929 | G921-G925 WeakPolarHBondContact O-CA 3.36Å; G921-G925 PolarHBondContact O-N 3.25Å; K923-G925 VanDerWaalsContact C-N 3.29Å; K923-G925 PolarHBondContact O-N 3.5Å; G925-L929 WeakPolarHBondContact O-CB 3.34Å; G925-L929 PolarHBondContact O-N 2.61Å; G925-L929 VanDerWaalsContact O-N 3.13Å |
| 926 | L | 91.6 | Very high | 86.9 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -76.1 | -41.8 | 172.7 | -177.5 | 65.1 | 0 | 0 | 0 | 111.4 | I916 V922 K923 A928 L929 L930 L943 L957 T961 I972 A975 | I916-L926 HydrophobicContact CD1-CD1 4.09Å; V922-L926 WeakPolarHBondContact O-CB 3.47Å; V922-L926 PolarHBondContact O-N 3.05Å; K923-L926 PolarHBondContact O-N 3.42Å; L926-A928 VanDerWaalsContact C-N 3.33Å; L926-A928 PolarHBondContact O-N 2.69Å; L926-L929 WeakPolarHBondContact O-CB 3.38Å; L926-L929 PolarHBondContact O-N 3.15Å; L926-L930 HydrophobicContact CD1-CD1 4.49Å; L926-L930 HydrophobicContact CD1-CG 4.44Å; L926-L930 HydrophobicContact CG-CD1 4.24Å; L926-L930 PolarHBondContact O-N 2.72Å; L926-L943 HydrophobicContact CD1-CD2 3.98Å; L926-L957 HydrophobicContact CD1-CD1 3.98Å; L926-T961 HydrophobicContact CD1-CG2 4.33Å; L926-T961 HydrophobicContact CD2-CG2 3.73Å; L926-I972 HydrophobicContact CD2-CG1 4.1Å; L926-A975 HydrophobicContact CB-CB 4.21Å; L926-A975 HydrophobicContact CD2-CB 3.78Å; L926-A975 HydrophobicContact CG-CB 3.75Å |
| 927 | S | 88.4 | Confident | 86.7 | Confident | 42 Ų | 42 | 38.6 Ų | 38.6 | 29% | 0.294 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -57.7 | -46.1 | 173.4 | -67.2 | 0 | 0 | 0 | 0 | 111.4 | K923 L929 L930 Q931 | K923-S927 PolarHBondContact O-N 3.1Å; K923-S927 PolarHBondContact O-OG 2.63Å; S927-L929 PolarHBondContact O-N 3.49Å; S927-L930 PolarHBondContact O-N 3.21Å; S927-Q931 VanDerWaalsContact O-CB 3.27Å; S927-Q931 WeakPolarHBondContact O-CB 3.27Å; S927-Q931 PolarHBondContact O-N 3.45Å |
| 928 | A | 87.5 | Confident | 86.7 | Confident | 6 Ų | 6 | 40 Ų | 40 | 5% | 0.05 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.1 | -38.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | V879 I882 D924 L926 E932 | V879-A928 HydrophobicContact CG2-CB 3.79Å; I882-A928 HydrophobicContact CD1-CB 3.59Å; D924-A928 VanDerWaalsContact O-CB 3.28Å; D924-A928 WeakPolarHBondContact O-CB 3.45Å; D924-A928 PolarHBondContact O-N 2.82Å; L926-A928 VanDerWaalsContact C-N 3.33Å; L926-A928 PolarHBondContact O-N 2.69Å; A928-E932 WeakPolarHBondContact O-CB 3.06Å; A928-E932 WeakPolarHBondContact O-CG 2.96Å; A928-E932 PolarHBondContact O-N 3.32Å; A928-E932 VanDerWaalsContact O-N 3.09Å |
| 929 | L | 89.9 | Confident | 86.7 | Confident | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -63.4 | -49.4 | 173.8 | -94.4 | 165 | 0 | 0 | 0 | 112.6 | I882 L896 L912 L915 I916 G925 L926 S927 Q931 E932 S933 | I882-L929 HydrophobicContact CG2-CD2 4.08Å; L896-L929 HydrophobicContact CD1-CD2 3.77Å; L912-L929 HydrophobicContact CD1-CD1 4.04Å; L915-L929 HydrophobicContact CD2-CD1 4.3Å; L915-L929 HydrophobicContact CD2-CD2 3.87Å; L915-L929 HydrophobicContact CG-CD1 4.13Å; L915-L929 HydrophobicContact CG-CD2 4.34Å; I916-L929 HydrophobicContact CG1-CD1 3.54Å; G925-L929 WeakPolarHBondContact O-CB 3.34Å; G925-L929 PolarHBondContact O-N 2.61Å; G925-L929 VanDerWaalsContact O-N 3.13Å; L926-L929 WeakPolarHBondContact O-CB 3.38Å; L926-L929 PolarHBondContact O-N 3.15Å; S927-L929 PolarHBondContact O-N 3.49Å; L929-Q931 PolarHBondContact O-N 2.89Å; L929-E932 PolarHBondContact O-N 2.78Å; L929-S933 WeakPolarHBondContact O-CB 3.06Å; L929-S933 PolarHBondContact O-N 2.97Å; L929-S933 PolarHBondContact O-OG 3.27Å |
| 930 | L | 89 | Confident | 86.9 | Confident | 3 Ų | 3 | 38.9 Ų | 38.9 | 2% | 0.016 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.9 | -40 | 179.9 | -78 | 173.8 | 0 | 0 | 0 | 111.8 | L926 S927 S933 G934 G935 G939 L940 L943 A975 | L926-L930 HydrophobicContact CD1-CD1 4.49Å; L926-L930 HydrophobicContact CD1-CG 4.44Å; L926-L930 HydrophobicContact CG-CD1 4.24Å; L926-L930 PolarHBondContact O-N 2.72Å; S927-L930 PolarHBondContact O-N 3.21Å; L930-S933 PolarHBondContact O-N 2.82Å; L930-G934 PolarHBondContact O-N 3.37Å; L930-G935 WeakPolarHBondContact O-CA 2.99Å; L930-G935 PolarHBondContact O-N 3.44Å; L930-G939 VanDerWaalsContact CD2-C 3.49Å; L930-G939 WeakPolarHBondContact CD2-O 3.34Å; L930-G939 WeakPolarHBondContact O-CA 3.24Å; L930-L940 HydrophobicContact CD2-CB 4.29Å; L930-L940 HydrophobicContact CD2-CG 3.97Å; L930-L943 HydrophobicContact CD2-CB 4.08Å; L930-L943 HydrophobicContact CD2-CD2 3.54Å; L930-L943 HydrophobicContact CD2-CG 4.46Å; L930-L943 HydrophobicContact CG-CD2 4.03Å; L930-A975 HydrophobicContact CD1-CB 3.7Å |
| 931 | Q | 86 | Confident | 87.2 | Confident | 119 Ų | 119 | 40.5 Ų | 40.5 | 56% | 0.556 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -58.2 | -48.6 | 174.4 | -172 | 170 | 19.1 | 0 | 0 | 111 | S927 L929 G934 G935 | S927-Q931 VanDerWaalsContact O-CB 3.27Å; S927-Q931 WeakPolarHBondContact O-CB 3.27Å; S927-Q931 PolarHBondContact O-N 3.45Å; L929-Q931 PolarHBondContact O-N 2.89Å; Q931-G934 PolarHBondContact O-N 3.05Å; Q931-G934 VanDerWaalsContact O-N 3.08Å; Q931-G935 PolarHBondContact O-N 3.2Å |
| 932 | E | 86.3 | Confident | 87.3 | Confident | 16 Ų | 16 | 41 Ų | 41 | 8% | 0.075 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -79.9 | -14.4 | 179.6 | -65.6 | -52.4 | 139.2 | 0 | 0 | 115.1 | V879 I882 R883 I886 H892 A928 L929 G934 | V879-E932 HydrophobicContact CG1-CG 3.7Å; V879-E932 WeakPolarHBondContact CG1-OE1 3.32Å; I882-E932 HydrophobicContact CG2-CB 4.29Å; R883-E932 HydrophobicContact CB-CG 4.11Å; R883-E932 VanDerWaalsContact CB-OE2 3.25Å; R883-E932 WeakPolarHBondContact CB-OE2 3.23Å; R883-E932 WeakPolarHBondContact CD-OE2 3.24Å; R883-E932 WeakPolarHBondContact CG-OE2 3.36Å; R883-E932 IonicContact CZ-OE1 3.63Å; R883-E932 IonicContact CZ-OE2 3.4Å; R883-E932 VanDerWaalsContact NE-CD 3.35Å; R883-E932 IonicContact NE-OE1 2.73Å; R883-E932 PolarHBondContact NE-OE1 3.43Å; R883-E932 IonicContact NE-OE2 2.71Å; R883-E932 PolarHBondContact NE-OE2 3.31Å; R883-E932 IonicContact NH2-OE1 3.27Å; R883-E932 PolarHBondContact NH2-OE1 3.48Å; R883-E932 IonicContact NH2-OE2 2.72Å; I886-E932 HydrophobicContact CD1-CB 4.44Å; H892-E932 PolarHBondContact CE1-O 3.38Å; H892-E932 PolarHBondContact ND1-O 3.34Å; A928-E932 WeakPolarHBondContact O-CB 3.06Å; A928-E932 WeakPolarHBondContact O-CG 2.96Å; A928-E932 PolarHBondContact O-N 3.32Å; A928-E932 VanDerWaalsContact O-N 3.09Å; L929-E932 PolarHBondContact O-N 2.78Å; E932-G934 VanDerWaalsContact C-N 3.27Å |
| 933 | S | 82.3 | Confident | 87.5 | Confident | 0 Ų | 0 | 39 Ų | 39 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -77.6 | -11.5 | 163.6 | -65.7 | 0 | 0 | 0 | 0 | 112.7 | L929 L930 G939 N942 | L929-S933 WeakPolarHBondContact O-CB 3.06Å; L929-S933 PolarHBondContact O-N 2.97Å; L929-S933 PolarHBondContact O-OG 3.27Å; L930-S933 PolarHBondContact O-N 2.82Å; S933-G939 WeakPolarHBondContact CB-O 3.36Å; S933-N942 WeakPolarHBondContact O-CB 3.34Å; S933-N942 PolarHBondContact O-ND2 3.22Å |
| 934 | G | 80 | Confident | 87.9 | Confident | 46 Ų | 46 | 32.8 Ų | 32.8 | 47% | 0.474 | 19% | 0.19 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 135.6 | -6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | L930 Q931 E932 | L930-G934 PolarHBondContact O-N 3.37Å; Q931-G934 PolarHBondContact O-N 3.05Å; Q931-G934 VanDerWaalsContact O-N 3.08Å; E932-G934 VanDerWaalsContact C-N 3.27Å |
| 935 | G | 79.6 | Confident | 88.3 | Confident | 27 Ų | 27 | 32.7 Ų | 32.7 | 28% | 0.278 | 19% | 0.186 | S | C | . | . | S | Bend | trans | 77.6 | 148.8 | -180 | 0 | 0 | 0 | 0 | 0 | 114.8 | L930 Q931 K938 G939 | L930-G935 WeakPolarHBondContact O-CA 2.99Å; L930-G935 PolarHBondContact O-N 3.44Å; Q931-G935 PolarHBondContact O-N 3.2Å; G935-K938 PolarHBondContact O-N 2.72Å; G935-K938 VanDerWaalsContact O-N 3.13Å; G935-G939 PolarHBondContact O-N 2.96Å |
| 936 | G | 84.4 | Confident | 88.3 | Confident | 30 Ų | 30 | 33.1 Ų | 33.1 | 31% | 0.309 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | 49.4 | -138.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | K938 G939 L940 | G936-K938 VanDerWaalsContact C-N 3.28Å; G936-K938 PolarHBondContact O-N 3.02Å; G936-G939 PolarHBondContact O-N 3.12Å; G936-L940 PolarHBondContact O-N 3.13Å; G936-L940 VanDerWaalsContact O-N 3.13Å |
| 937 | L | 88.9 | Confident | 88.3 | Confident | 46 Ų | 46 | 33.3 Ų | 33.3 | 24% | 0.241 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -43.8 | -51.1 | 171.4 | 172.8 | 60.4 | 0 | 0 | 0 | 112.7 | G939 L940 E941 N985 E988 A989 | L937-G939 PolarHBondContact O-N 3.16Å; L937-L940 CarbonylContact O-C 3.53Å; L937-L940 WeakPolarHBondContact O-CA 3.5Å; L937-L940 WeakPolarHBondContact O-CB 3.21Å; L937-L940 PolarHBondContact O-N 3.03Å; L937-E941 HydrophobicContact CD1-CG 4.02Å; L937-E941 HydrophobicContact CG-CG 4.29Å; L937-E941 WeakPolarHBondContact O-CG 3.3Å; L937-E941 PolarHBondContact O-N 2.91Å; L937-N985 HydrophobicContact CB-CB 4.36Å; L937-N985 WeakPolarHBondContact CB-OD1 3.24Å; L937-N985 WeakPolarHBondContact CD1-O 3.45Å; L937-N985 PolarHBondContact N-OD1 3.5Å; L937-E988 HydrophobicContact CD1-CB 3.75Å; L937-E988 HydrophobicContact CD2-CB 4.49Å; L937-A989 HydrophobicContact CD1-CB 3.89Å |
| 938 | K | 89.4 | Confident | 88.4 | Confident | 131 Ų | 131 | 33.9 Ų | 33.9 | 57% | 0.57 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -74.5 | -31.2 | -169.3 | -162.4 | 153.8 | -163.1 | 126.4 | 0 | 113.4 | G935 G936 L940 N942 | G935-K938 PolarHBondContact O-N 2.72Å; G935-K938 VanDerWaalsContact O-N 3.13Å; G936-K938 VanDerWaalsContact C-N 3.28Å; G936-K938 PolarHBondContact O-N 3.02Å; K938-L940 VanDerWaalsContact C-N 3.31Å; K938-N942 WeakPolarHBondContact O-CB 3.28Å; K938-N942 PolarHBondContact O-N 3.36Å; K938-N942 VanDerWaalsContact O-N 3.12Å; K938-N942 PolarHBondContact O-ND2 3.48Å |
| 939 | G | 89.6 | Confident | 88.3 | Confident | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -61.7 | -41 | 166 | 0 | 0 | 0 | 0 | 0 | 112 | L930 S933 G935 G936 L937 L943 | L930-G939 VanDerWaalsContact CD2-C 3.49Å; L930-G939 WeakPolarHBondContact CD2-O 3.34Å; L930-G939 WeakPolarHBondContact O-CA 3.24Å; S933-G939 WeakPolarHBondContact CB-O 3.36Å; G935-G939 PolarHBondContact O-N 2.96Å; G936-G939 PolarHBondContact O-N 3.12Å; L937-G939 PolarHBondContact O-N 3.16Å; G939-L943 WeakPolarHBondContact O-CB 3.33Å; G939-L943 PolarHBondContact O-N 2.93Å |
| 940 | L | 91.9 | Very high | 88.2 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.7 | -48.4 | 177.1 | -114 | 165 | 0 | 0 | 0 | 112.4 | L930 G936 L937 K938 N942 L943 L944 L957 A976 N985 L986 A989 | L930-L940 HydrophobicContact CD2-CB 4.29Å; L930-L940 HydrophobicContact CD2-CG 3.97Å; G936-L940 PolarHBondContact O-N 3.13Å; G936-L940 VanDerWaalsContact O-N 3.13Å; L937-L940 CarbonylContact O-C 3.53Å; L937-L940 WeakPolarHBondContact O-CA 3.5Å; L937-L940 WeakPolarHBondContact O-CB 3.21Å; L937-L940 PolarHBondContact O-N 3.03Å; K938-L940 VanDerWaalsContact C-N 3.31Å; L940-N942 PolarHBondContact O-N 3.36Å; L940-L943 PolarHBondContact O-N 3.48Å; L940-L944 HydrophobicContact CD2-CD1 3.76Å; L940-L944 HydrophobicContact CD2-CG 4.1Å; L940-L944 VanDerWaalsContact O-CB 3.29Å; L940-L944 WeakPolarHBondContact O-CB 3.37Å; L940-L944 VanDerWaalsContact O-CG 3.23Å; L940-L944 WeakPolarHBondContact O-CG 3.35Å; L940-L944 PolarHBondContact O-N 3.35Å; L940-L957 HydrophobicContact CD2-CD2 4.2Å; L940-A976 HydrophobicContact CD1-CB 3.51Å; L940-N985 HydrophobicContact CD1-CB 4.18Å; L940-L986 HydrophobicContact CD1-CB 4.16Å; L940-L986 HydrophobicContact CD1-CD1 4.36Å; L940-L986 HydrophobicContact CD2-CD1 3.78Å; L940-A989 HydrophobicContact CB-CB 4.01Å |
| 941 | E | 92 | Very high | 88.1 | Confident | 82 Ų | 82 | 38.1 Ų | 38.1 | 38% | 0.383 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -52.6 | -54.1 | 174 | -70.1 | 179.1 | 132.3 | 0 | 0 | 110.9 | L937 L943 L944 E945 A989 | L937-E941 HydrophobicContact CD1-CG 4.02Å; L937-E941 HydrophobicContact CG-CG 4.29Å; L937-E941 WeakPolarHBondContact O-CG 3.3Å; L937-E941 PolarHBondContact O-N 2.91Å; E941-L943 PolarHBondContact O-N 3.28Å; E941-L944 PolarHBondContact O-N 2.78Å; E941-E945 WeakPolarHBondContact O-CB 3.39Å; E941-E945 PolarHBondContact O-N 2.74Å; E941-A989 HydrophobicContact CG-CB 4.23Å |
| 942 | N | 90.8 | Very high | 88.3 | Confident | 33 Ų | 33 | 37.8 Ų | 37.8 | 18% | 0.176 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66 | -38.5 | -177.3 | -74.7 | -21.3 | 0 | 0 | 0 | 112.5 | V893 S933 K938 L940 A946 | V893-N942 HydrophobicContact CG2-CB 3.71Å; V893-N942 WeakPolarHBondContact CG2-OD1 3.43Å; S933-N942 WeakPolarHBondContact O-CB 3.34Å; S933-N942 PolarHBondContact O-ND2 3.22Å; K938-N942 WeakPolarHBondContact O-CB 3.28Å; K938-N942 PolarHBondContact O-N 3.36Å; K938-N942 VanDerWaalsContact O-N 3.12Å; K938-N942 PolarHBondContact O-ND2 3.48Å; L940-N942 PolarHBondContact O-N 3.36Å; N942-A946 WeakPolarHBondContact O-CB 3.42Å; N942-A946 PolarHBondContact O-N 3.39Å |
| 943 | L | 92.2 | Very high | 88.5 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.8 | -46 | 175.3 | 177.8 | 60.5 | 0 | 0 | 0 | 111.4 | L896 L912 L926 L930 G939 L940 E941 A946 V947 L957 | L896-L943 HydrophobicContact CD2-CD1 3.64Å; L912-L943 HydrophobicContact CD1-CD1 4.09Å; L912-L943 HydrophobicContact CD2-CD1 4.5Å; L926-L943 HydrophobicContact CD1-CD2 3.98Å; L930-L943 HydrophobicContact CD2-CB 4.08Å; L930-L943 HydrophobicContact CD2-CD2 3.54Å; L930-L943 HydrophobicContact CD2-CG 4.46Å; L930-L943 HydrophobicContact CG-CD2 4.03Å; G939-L943 WeakPolarHBondContact O-CB 3.33Å; G939-L943 PolarHBondContact O-N 2.93Å; L940-L943 PolarHBondContact O-N 3.48Å; E941-L943 PolarHBondContact O-N 3.28Å; L943-A946 WeakPolarHBondContact O-CB 3.49Å; L943-A946 PolarHBondContact O-N 3.13Å; L943-A946 VanDerWaalsContact O-N 3.16Å; L943-V947 WeakPolarHBondContact O-CG2 3.48Å; L943-V947 PolarHBondContact O-N 3.12Å; L943-V947 VanDerWaalsContact O-N 3.12Å; L943-L957 HydrophobicContact CD2-CD1 3.7Å; L943-L957 HydrophobicContact CD2-CD2 4.22Å; L943-L957 HydrophobicContact CG-CD1 4.34Å |
| 944 | L | 92.8 | Very high | 89.1 | Confident | 3 Ų | 3 | 37 Ų | 37 | 2% | 0.016 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -63.1 | -43.9 | 178.2 | -73.7 | 168.2 | 0 | 0 | 0 | 111.2 | L940 E941 A946 V947 G948 G949 L954 L957 A989 V990 | L940-L944 HydrophobicContact CD2-CD1 3.76Å; L940-L944 HydrophobicContact CD2-CG 4.1Å; L940-L944 VanDerWaalsContact O-CB 3.29Å; L940-L944 WeakPolarHBondContact O-CB 3.37Å; L940-L944 VanDerWaalsContact O-CG 3.23Å; L940-L944 WeakPolarHBondContact O-CG 3.35Å; L940-L944 PolarHBondContact O-N 3.35Å; E941-L944 PolarHBondContact O-N 2.78Å; L944-A946 PolarHBondContact O-N 2.85Å; L944-V947 PolarHBondContact O-N 3.39Å; L944-V947 VanDerWaalsContact O-N 3.14Å; L944-G948 PolarHBondContact O-N 3.07Å; L944-G949 WeakPolarHBondContact O-CA 3.49Å; L944-G949 PolarHBondContact O-N 2.8Å; L944-L954 HydrophobicContact CD2-CB 4.01Å; L944-L954 HydrophobicContact CD2-CD1 4.42Å; L944-L957 HydrophobicContact CD2-CB 4.45Å; L944-L957 HydrophobicContact CD2-CD2 4.02Å; L944-A989 HydrophobicContact CD1-CB 3.8Å; L944-V990 HydrophobicContact CD1-CG1 3.8Å |
| 945 | E | 92 | Very high | 89.7 | Confident | 102 Ų | 102 | 38.4 Ų | 38.4 | 48% | 0.477 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -63.5 | -31.7 | 174.9 | -151.1 | -138.1 | 114.9 | 0 | 0 | 111.9 | V893 K897 E941 | V893-E945 HydrophobicContact CG1-CB 4.25Å; K897-E945 WeakPolarHBondContact CE-O 3.38Å; K897-E945 PolarHBondContact NZ-O 3.01Å; K897-E945 IonicContact NZ-OE1 3.74Å; K897-E945 PolarHBondContact NZ-OE1 3.47Å; E941-E945 WeakPolarHBondContact O-CB 3.39Å; E941-E945 PolarHBondContact O-N 2.74Å |
| 946 | A | 90 | Very high | 90.3 | Very high | 10 Ų | 10 | 38.2 Ų | 38.2 | 8% | 0.083 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -68.6 | -28.7 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | L896 K897 N942 L943 L944 | L896-A946 HydrophobicContact CB-CB 4.07Å; L896-A946 HydrophobicContact CD2-CB 3.8Å; L896-A946 HydrophobicContact CG-CB 4.03Å; K897-A946 HydrophobicContact CG-CB 4.06Å; N942-A946 WeakPolarHBondContact O-CB 3.42Å; N942-A946 PolarHBondContact O-N 3.39Å; L943-A946 WeakPolarHBondContact O-CB 3.49Å; L943-A946 PolarHBondContact O-N 3.13Å; L943-A946 VanDerWaalsContact O-N 3.16Å; L944-A946 PolarHBondContact O-N 2.85Å |
| 947 | V | 92.4 | Very high | 90.8 | Very high | 3 Ų | 3 | 36.8 Ų | 36.8 | 2% | 0.018 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -110.5 | 9 | -177.1 | -55.3 | 0 | 0 | 0 | 0 | 116 | L900 V908 L912 L943 L944 G953 N956 | L900-V947 HydrophobicContact CD1-CG1 3.63Å; V908-V947 HydrophobicContact CG1-CB 3.91Å; V908-V947 HydrophobicContact CG1-CG1 3.83Å; L912-V947 HydrophobicContact CD2-CG1 3.97Å; L943-V947 WeakPolarHBondContact O-CG2 3.48Å; L943-V947 PolarHBondContact O-N 3.12Å; L943-V947 VanDerWaalsContact O-N 3.12Å; L944-V947 PolarHBondContact O-N 3.39Å; L944-V947 VanDerWaalsContact O-N 3.14Å; V947-G953 VanDerWaalsContact CG2-O 3.29Å; V947-G953 WeakPolarHBondContact CG2-O 3.3Å; V947-N956 HydrophobicContact CB-CB 4.19Å; V947-N956 HydrophobicContact CG2-CB 4.19Å; V947-N956 PolarHBondContact O-ND2 3.3Å |
| 948 | G | 89.1 | Confident | 91 | Very high | 55 Ų | 55 | 35.2 Ų | 35.2 | 57% | 0.567 | 20% | 0.199 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 144.4 | -19.8 | 166.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | L944 | L944-G948 PolarHBondContact O-N 3.07Š|
| 949 | G | 86.5 | Confident | 91.1 | Very high | 27 Ų | 27 | 33.6 Ų | 33.6 | 28% | 0.278 | 19% | 0.192 | S | C | . | . | S | Bend | trans | 78.2 | 148 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | L944 E952 G953 | L944-G949 WeakPolarHBondContact O-CA 3.49Å; L944-G949 PolarHBondContact O-N 2.8Å; G949-E952 PolarHBondContact O-N 3.35Å; G949-G953 PolarHBondContact O-N 2.94Å |
| 950 | G | 86.3 | Confident | 91.3 | Very high | 33 Ų | 33 | 33.6 Ų | 33.6 | 34% | 0.34 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | 51.7 | -139.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | E952 G953 L954 | G950-E952 VanDerWaalsContact C-N 3.34Å; G950-E952 PolarHBondContact O-N 3.34Å; G950-G953 PolarHBondContact O-N 3.22Å; G950-L954 PolarHBondContact O-N 3.4Å |
| 951 | V | 88 | Confident | 91.3 | Very high | 37 Ų | 37 | 34 Ų | 34 | 22% | 0.224 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -58.5 | -40.9 | -178.4 | -178.4 | 0 | 0 | 0 | 0 | 112.6 | L954 K955 N999 N1002 A1003 | V951-L954 PolarHBondContact O-N 2.88Å; V951-K955 HydrophobicContact CG1-CD 4.41Å; V951-K955 WeakPolarHBondContact O-CG 3.21Å; V951-K955 PolarHBondContact O-N 3.27Å; V951-N999 HydrophobicContact CG2-CB 3.61Å; V951-N999 VanDerWaalsContact CG2-OD1 3.26Å; V951-N999 WeakPolarHBondContact CG2-OD1 3.37Å; V951-N1002 HydrophobicContact CG1-CB 4.21Å; V951-A1003 HydrophobicContact CG1-CB 4.28Å |
| 952 | E | 89.5 | Confident | 91.1 | Very high | 113 Ų | 113 | 31.1 Ų | 31.1 | 53% | 0.528 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -71.9 | -38.5 | -177.7 | -168.9 | 64.4 | -169.1 | 0 | 0 | 111.3 | G949 G950 L954 K955 N956 | G949-E952 PolarHBondContact O-N 3.35Å; G950-E952 VanDerWaalsContact C-N 3.34Å; G950-E952 PolarHBondContact O-N 3.34Å; E952-L954 VanDerWaalsContact C-N 3.32Å; E952-L954 PolarHBondContact O-N 2.92Å; E952-K955 PolarHBondContact O-N 2.92Å; E952-N956 PolarHBondContact O-N 3.27Å; E952-N956 PolarHBondContact O-ND2 3.33Å |
| 953 | G | 92 | Very high | 90.8 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -58.5 | -44.1 | 169.1 | 0 | 0 | 0 | 0 | 0 | 112 | V947 G949 G950 N956 L957 | V947-G953 VanDerWaalsContact CG2-O 3.29Å; V947-G953 WeakPolarHBondContact CG2-O 3.3Å; G949-G953 PolarHBondContact O-N 2.94Å; G950-G953 PolarHBondContact O-N 3.22Å; G953-N956 PolarHBondContact O-N 3.05Å; G953-L957 WeakPolarHBondContact O-CB 3.48Å; G953-L957 PolarHBondContact O-N 3.02Å |
| 954 | L | 93.2 | Very high | 90.6 | Very high | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -67.8 | -39.7 | 178.4 | -177.3 | 56.1 | 0 | 0 | 0 | 112.5 | L944 G950 V951 E952 N956 L957 L958 I972 L986 V990 L1000 A1003 | L944-L954 HydrophobicContact CD2-CB 4.01Å; L944-L954 HydrophobicContact CD2-CD1 4.42Å; G950-L954 PolarHBondContact O-N 3.4Å; V951-L954 PolarHBondContact O-N 2.88Å; E952-L954 VanDerWaalsContact C-N 3.32Å; E952-L954 PolarHBondContact O-N 2.92Å; L954-N956 VanDerWaalsContact C-N 3.33Å; L954-N956 PolarHBondContact O-N 2.86Å; L954-L957 PolarHBondContact O-N 3.33Å; L954-L958 HydrophobicContact CD1-CD1 4.35Å; L954-L958 HydrophobicContact CD1-CG 4.26Å; L954-L958 HydrophobicContact CG-CD1 4.08Å; L954-L958 HydrophobicContact CG-CG 4.5Å; L954-L958 WeakPolarHBondContact O-CB 3.32Å; L954-L958 WeakPolarHBondContact O-CG 3.37Å; L954-L958 PolarHBondContact O-N 2.95Å; L954-I972 HydrophobicContact CD1-CD1 4.45Å; L954-L986 HydrophobicContact CD1-CD1 3.9Å; L954-V990 HydrophobicContact CB-CG1 4.38Å; L954-V990 HydrophobicContact CD2-CG1 4.07Å; L954-L1000 HydrophobicContact CD2-CD1 3.77Å; L954-A1003 HydrophobicContact CB-CB 4.08Å; L954-A1003 HydrophobicContact CD2-CB 3.53Å; L954-A1003 HydrophobicContact CG-CB 3.66Å |
| 955 | K | 92.8 | Very high | 90.5 | Very high | 74 Ų | 74 | 42.9 Ų | 42.9 | 32% | 0.322 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60.2 | -42 | 172.6 | -76.4 | -173.5 | 177.7 | -170.7 | 0 | 111.9 | V951 E952 K959 N1002 A1003 | V951-K955 HydrophobicContact CG1-CD 4.41Å; V951-K955 WeakPolarHBondContact O-CG 3.21Å; V951-K955 PolarHBondContact O-N 3.27Å; E952-K955 PolarHBondContact O-N 2.92Å; K955-K959 WeakPolarHBondContact O-CB 3.45Å; K955-K959 PolarHBondContact O-N 3.36Å; K955-N1002 WeakPolarHBondContact CE-O 3.38Å; K955-N1002 PolarHBondContact NZ-O 3.17Å; K955-A1003 HydrophobicContact CG-CB 4.12Å |
| 956 | N | 93.5 | Very high | 90.3 | Very high | 23 Ų | 23 | 38.3 Ų | 38.3 | 12% | 0.123 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -67 | -36.3 | 175.1 | -76.1 | -44.5 | 0 | 0 | 0 | 112.6 | A909 V947 E952 G953 L954 A960 | A909-N956 HydrophobicContact CB-CB 4.14Å; A909-N956 VanDerWaalsContact CB-O 3.24Å; A909-N956 WeakPolarHBondContact CB-O 3.26Å; V947-N956 HydrophobicContact CB-CB 4.19Å; V947-N956 HydrophobicContact CG2-CB 4.19Å; V947-N956 PolarHBondContact O-ND2 3.3Å; E952-N956 PolarHBondContact O-N 3.27Å; E952-N956 PolarHBondContact O-ND2 3.33Å; G953-N956 PolarHBondContact O-N 3.05Å; L954-N956 VanDerWaalsContact C-N 3.33Å; L954-N956 PolarHBondContact O-N 2.86Å; N956-A960 VanDerWaalsContact O-CB 3.23Å; N956-A960 WeakPolarHBondContact O-CB 3.24Å; N956-A960 PolarHBondContact O-N 3.11Å |
| 957 | L | 94.5 | Very high | 90.4 | Very high | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -68.9 | -42.7 | 176.2 | -177.7 | 57.9 | 0 | 0 | 0 | 112.5 | L912 L926 L940 L943 L944 G953 L954 A960 T961 I972 | L912-L957 HydrophobicContact CD2-CD1 3.74Å; L926-L957 HydrophobicContact CD1-CD1 3.98Å; L940-L957 HydrophobicContact CD2-CD2 4.2Å; L943-L957 HydrophobicContact CD2-CD1 3.7Å; L943-L957 HydrophobicContact CD2-CD2 4.22Å; L943-L957 HydrophobicContact CG-CD1 4.34Å; L944-L957 HydrophobicContact CD2-CB 4.45Å; L944-L957 HydrophobicContact CD2-CD2 4.02Å; G953-L957 WeakPolarHBondContact O-CB 3.48Å; G953-L957 PolarHBondContact O-N 3.02Å; L954-L957 PolarHBondContact O-N 3.33Å; L957-A960 PolarHBondContact O-N 2.91Å; L957-T961 HydrophobicContact CD1-CG2 4.3Å; L957-T961 WeakPolarHBondContact O-CG2 3.23Å; L957-T961 PolarHBondContact O-N 2.98Å; L957-T961 PolarHBondContact O-OG1 3.16Å; L957-I972 HydrophobicContact CB-CD1 4.49Å; L957-I972 HydrophobicContact CD2-CD1 4.08Å; L957-I972 HydrophobicContact CD2-CG1 4.22Å; L957-I972 HydrophobicContact CD2-CG2 4.19Å; L957-I972 HydrophobicContact CG-CD1 3.73Å; L957-I972 HydrophobicContact CG-CG1 4Å |
| 958 | L | 93.1 | Very high | 90.4 | Very high | 13 Ų | 13 | 43.6 Ų | 43.6 | 7% | 0.068 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.1 | -54.8 | 173.6 | -74.2 | 163.3 | 0 | 0 | 0 | 110.7 | L954 A960 T961 G962 A968 L969 I972 A1003 M1004 | L954-L958 HydrophobicContact CD1-CD1 4.35Å; L954-L958 HydrophobicContact CD1-CG 4.26Å; L954-L958 HydrophobicContact CG-CD1 4.08Å; L954-L958 HydrophobicContact CG-CG 4.5Å; L954-L958 WeakPolarHBondContact O-CB 3.32Å; L954-L958 WeakPolarHBondContact O-CG 3.37Å; L954-L958 PolarHBondContact O-N 2.95Å; L958-A960 PolarHBondContact O-N 3.07Å; L958-A960 VanDerWaalsContact O-N 3.16Å; L958-T961 PolarHBondContact O-N 2.79Å; L958-T961 PolarHBondContact O-OG1 3.33Å; L958-G962 PolarHBondContact O-N 3.01Å; L958-A968 HydrophobicContact CB-CB 4.4Å; L958-A968 HydrophobicContact CD2-CB 3.84Å; L958-A968 WeakPolarHBondContact O-CB 3.19Å; L958-L969 HydrophobicContact CD2-CB 3.94Å; L958-I972 HydrophobicContact CD2-CD1 3.65Å; L958-I972 HydrophobicContact CG-CD1 4Å; L958-A1003 HydrophobicContact CD1-CB 4.03Å; L958-M1004 HydrophobicContact CD1-CG 4.46Å; L958-M1004 HydrophobicContact CD1-SD 3.75Å; L958-M1004 HydrophobicContact CD2-SD 3.76Å; L958-M1004 HydrophobicContact CG-SD 4.45Å |
| 959 | K | 91.9 | Very high | 90.6 | Very high | 97 Ų | 97 | 41 Ų | 41 | 42% | 0.422 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -59.9 | -27.4 | 177.7 | 178.5 | 172.5 | 174.4 | -73.8 | 0 | 113.4 | N907 A909 D910 K955 | N907-K959 PolarHBondContact ND2-NZ 2.89Å; N907-K959 PolarHBondContact OD1-NZ 2.83Å; A909-K959 HydrophobicContact CB-CB 3.91Å; A909-K959 HydrophobicContact CB-CD 4Å; A909-K959 HydrophobicContact CB-CG 3.82Å; D910-K959 IonicContact OD1-NZ 3.49Å; D910-K959 PolarHBondContact OD1-NZ 2.89Å; D910-K959 IonicContact OD2-NZ 2.72Å; K955-K959 WeakPolarHBondContact O-CB 3.45Å; K955-K959 PolarHBondContact O-N 3.36Å |
| 960 | A | 92.7 | Very high | 90.8 | Very high | 1 Ų | 1 | 41.5 Ų | 41.5 | 1% | 0.008 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -75.8 | -25.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | A909 L912 S913 I916 N956 L957 L958 | A909-A960 HydrophobicContact CB-CB 4.42Å; A909-A960 WeakPolarHBondContact O-CB 3.37Å; L912-A960 HydrophobicContact CB-CB 3.82Å; L912-A960 HydrophobicContact CD2-CB 3.51Å; L912-A960 HydrophobicContact CG-CB 3.62Å; S913-A960 VanDerWaalsContact CB-O 3.27Å; S913-A960 WeakPolarHBondContact CB-O 3.37Å; S913-A960 PolarHBondContact OG-O 3.34Å; I916-A960 HydrophobicContact CD1-CB 4.25Å; N956-A960 VanDerWaalsContact O-CB 3.23Å; N956-A960 WeakPolarHBondContact O-CB 3.24Å; N956-A960 PolarHBondContact O-N 3.11Å; L957-A960 PolarHBondContact O-N 2.91Å; L958-A960 PolarHBondContact O-N 3.07Å; L958-A960 VanDerWaalsContact O-N 3.16Å |
| 961 | T | 91.9 | Very high | 91.1 | Very high | 7 Ų | 7 | 41.4 Ų | 41.4 | 4% | 0.043 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -102 | -27.7 | -170.6 | 48.9 | 0 | 0 | 0 | 0 | 113.8 | I916 V922 L926 L957 L958 I972 | I916-T961 HydrophobicContact CD1-CG2 3.86Å; V922-T961 HydrophobicContact CG1-CG2 4.46Å; V922-T961 VanDerWaalsContact CG1-O 3.24Å; V922-T961 WeakPolarHBondContact CG1-O 3.36Å; V922-T961 WeakPolarHBondContact CG2-O 3.25Å; L926-T961 HydrophobicContact CD1-CG2 4.33Å; L926-T961 HydrophobicContact CD2-CG2 3.73Å; L957-T961 HydrophobicContact CD1-CG2 4.3Å; L957-T961 WeakPolarHBondContact O-CG2 3.23Å; L957-T961 PolarHBondContact O-N 2.98Å; L957-T961 PolarHBondContact O-OG1 3.16Å; L958-T961 PolarHBondContact O-N 2.79Å; L958-T961 PolarHBondContact O-OG1 3.33Å; T961-I972 HydrophobicContact CG2-CG1 4.27Å |
| 962 | G | 87.6 | Confident | 91.3 | Very high | 22 Ų | 22 | 39.6 Ų | 39.6 | 23% | 0.227 | 21% | 0.21 | C | C | . | . | trans | -168 | 163 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | L958 | L958-G962 PolarHBondContact O-N 3.01Š| ||
| 963 | D | 85.1 | Confident | 91.3 | Very high | 174 Ų | 174 | 34.6 Ų | 34.6 | 93% | 0.93 | 19% | 0.187 | S | C | * | . | S | Bend | trans | -85.8 | -27.4 | 173.7 | -64.6 | -49.2 | 0 | 0 | 0 | 112.3 | ||
| 964 | D | 89.2 | Confident | 91.2 | Very high | 58 Ų | 58 | 37.4 Ų | 37.4 | 31% | 0.31 | 21% | 0.21 | S | C | . | . | S | Bend | trans | -88.6 | 124.2 | 169 | 175 | 118.9 | 0 | 0 | 0 | 109.1 | S966 E967 A968 K1017 | D964-S966 VanDerWaalsContact C-N 3.29Å; D964-S966 PolarHBondContact O-N 3.01Å; D964-S966 WeakPolarHBondContact OD2-CA 3.29Å; D964-S966 WeakPolarHBondContact OD2-CB 3.47Å; D964-S966 PolarHBondContact OD2-N 2.86Å; D964-S966 PolarHBondContact OD2-OG 2.98Å; D964-E967 HydrophobicContact CB-CB 4.12Å; D964-E967 PolarHBondContact O-N 3.46Å; D964-E967 PolarHBondContact OD2-N 3.33Å; D964-A968 WeakPolarHBondContact O-CB 3.44Å; D964-A968 PolarHBondContact O-N 3.47Å; D964-K1017 IonicContact OD1-NZ 2.75Å; D964-K1017 PolarHBondContact OD1-NZ 2.92Å; D964-K1017 VanDerWaalsContact OD1-NZ 3.08Å; D964-K1017 IonicContact OD2-NZ 2.6Å |
| 965 | P | 89.2 | Confident | 90.9 | Very high | 51 Ų | 51 | 38.1 Ų | 38.1 | 33% | 0.331 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -59.6 | -34.6 | -176.8 | -27.2 | 35.3 | 0 | 0 | 0 | 114.5 | L969 M1004 | P965-L969 VanDerWaalsContact O-CB 3.24Å; P965-L969 WeakPolarHBondContact O-CB 3.23Å; P965-L969 PolarHBondContact O-N 3.23Å; P965-M1004 HydrophobicContact CB-CE 3.81Å; P965-M1004 HydrophobicContact CB-SD 4.27Å; P965-M1004 WeakPolarHBondContact O-CE 3.45Å |
| 966 | S | 88.9 | Confident | 90.7 | Very high | 6 Ų | 6 | 34.7 Ų | 34.7 | 4% | 0.042 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -77.7 | -33.2 | -179.5 | 68.9 | 0 | 0 | 0 | 0 | 112.7 | D964 A970 N1014 K1017 A1018 | D964-S966 VanDerWaalsContact C-N 3.29Å; D964-S966 PolarHBondContact O-N 3.01Å; D964-S966 WeakPolarHBondContact OD2-CA 3.29Å; D964-S966 WeakPolarHBondContact OD2-CB 3.47Å; D964-S966 PolarHBondContact OD2-N 2.86Å; D964-S966 PolarHBondContact OD2-OG 2.98Å; S966-A970 WeakPolarHBondContact O-CB 3.46Å; S966-A970 PolarHBondContact O-N 2.92Å; S966-N1014 VanDerWaalsContact CB-O 3.3Å; S966-N1014 WeakPolarHBondContact CB-O 3.26Å; S966-K1017 VanDerWaalsContact OG-CD 3.24Å; S966-K1017 WeakPolarHBondContact OG-CD 2.85Å; S966-K1017 WeakPolarHBondContact OG-CE 3.43Å; S966-K1017 PolarHBondContact OG-NZ 3.18Å; S966-A1018 WeakPolarHBondContact O-CB 3.41Å |
| 967 | E | 90.4 | Very high | 90.3 | Very high | 125 Ų | 125 | 36.5 Ų | 36.5 | 58% | 0.584 | 23% | 0.225 | S | C | * | . | H | α-helix | trans | -70.5 | -42.6 | 171 | -173.8 | 175.9 | -179.2 | 0 | 0 | 110.6 | D964 A970 N971 | D964-E967 HydrophobicContact CB-CB 4.12Å; D964-E967 PolarHBondContact O-N 3.46Å; D964-E967 PolarHBondContact OD2-N 3.33Å; E967-A970 PolarHBondContact O-N 3.2Å; E967-N971 PolarHBondContact O-N 3.19Å; E967-N971 PolarHBondContact O-ND2 2.91Å |
| 968 | A | 93 | Very high | 89.7 | Confident | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -56.9 | -50.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L958 D964 N971 I972 | L958-A968 HydrophobicContact CB-CB 4.4Å; L958-A968 HydrophobicContact CD2-CB 3.84Å; L958-A968 WeakPolarHBondContact O-CB 3.19Å; D964-A968 WeakPolarHBondContact O-CB 3.44Å; D964-A968 PolarHBondContact O-N 3.47Å; A968-N971 PolarHBondContact O-N 2.75Å; A968-I972 WeakPolarHBondContact O-CG1 3.38Å; A968-I972 PolarHBondContact O-N 3.31Å; A968-I972 VanDerWaalsContact O-N 3.07Å |
| 969 | L | 93.4 | Very high | 89.3 | Confident | 1 Ų | 1 | 39.2 Ų | 39.2 | 1% | 0.005 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.9 | -42.6 | 177.3 | -179.1 | 59.9 | 0 | 0 | 0 | 112.3 | L958 P965 N971 I972 L973 L986 L1000 M1004 I1015 A1018 | L958-L969 HydrophobicContact CD2-CB 3.94Å; P965-L969 VanDerWaalsContact O-CB 3.24Å; P965-L969 WeakPolarHBondContact O-CB 3.23Å; P965-L969 PolarHBondContact O-N 3.23Å; L969-N971 VanDerWaalsContact C-N 3.28Å; L969-N971 PolarHBondContact O-N 3.23Å; L969-I972 PolarHBondContact O-N 2.82Å; L969-I972 VanDerWaalsContact O-N 3.11Å; L969-L973 HydrophobicContact CD1-CD1 4.23Å; L969-L973 HydrophobicContact CD1-CD2 4.31Å; L969-L973 HydrophobicContact CD1-CG 3.96Å; L969-L973 HydrophobicContact CG-CD1 3.9Å; L969-L973 HydrophobicContact CG-CG 4.13Å; L969-L973 WeakPolarHBondContact O-CB 3.29Å; L969-L973 VanDerWaalsContact O-CG 3.26Å; L969-L973 WeakPolarHBondContact O-CG 2.94Å; L969-L973 PolarHBondContact O-N 2.86Å; L969-L986 HydrophobicContact CD1-CD2 3.41Å; L969-L986 VanDerWaalsContact CD1-CD2 3.41Å; L969-L1000 HydrophobicContact CD1-CD1 4.09Å; L969-L1000 HydrophobicContact CD2-CD1 4.37Å; L969-M1004 HydrophobicContact CB-CE 3.93Å; L969-M1004 HydrophobicContact CB-SD 3.93Å; L969-M1004 HydrophobicContact CD2-CE 3.55Å; L969-M1004 HydrophobicContact CD2-CG 4.39Å; L969-M1004 HydrophobicContact CD2-SD 3.75Å; L969-M1004 HydrophobicContact CG-CE 4.38Å; L969-M1004 HydrophobicContact CG-SD 4.32Å; L969-I1015 HydrophobicContact CD2-CB 4.22Å; L969-I1015 HydrophobicContact CD2-CG1 3.82Å; L969-I1015 HydrophobicContact CD2-CG2 4.47Å; L969-A1018 HydrophobicContact CB-CB 3.76Å; L969-A1018 HydrophobicContact CD2-CB 3.68Å; L969-A1018 HydrophobicContact CG-CB 3.65Å |
| 970 | A | 91.2 | Very high | 89 | Confident | 36 Ų | 36 | 36.5 Ų | 36.5 | 30% | 0.298 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -59.5 | -39.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | S966 E967 A974 A1018 | S966-A970 WeakPolarHBondContact O-CB 3.46Å; S966-A970 PolarHBondContact O-N 2.92Å; E967-A970 PolarHBondContact O-N 3.2Å; A970-A974 VanDerWaalsContact O-CB 3.3Å; A970-A974 WeakPolarHBondContact O-CB 3.45Å; A970-A974 PolarHBondContact O-N 2.94Å; A970-A1018 HydrophobicContact CB-CB 4.21Å |
| 971 | N | 91.4 | Very high | 88.8 | Confident | 31 Ų | 31 | 40.8 Ų | 40.8 | 17% | 0.166 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -65.9 | -41.6 | 174.1 | -77.6 | -70.8 | 0 | 0 | 0 | 112.3 | V922 E967 A968 L969 A975 | V922-N971 HydrophobicContact CG1-CB 3.68Å; V922-N971 VanDerWaalsContact CG1-CG 3.45Å; E967-N971 PolarHBondContact O-N 3.19Å; E967-N971 PolarHBondContact O-ND2 2.91Å; A968-N971 PolarHBondContact O-N 2.75Å; L969-N971 VanDerWaalsContact C-N 3.28Å; L969-N971 PolarHBondContact O-N 3.23Å; N971-A975 WeakPolarHBondContact O-CB 3.46Å; N971-A975 PolarHBondContact O-N 3.5Å |
| 972 | I | 92.9 | Very high | 88.7 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.8 | -48.9 | 174.5 | -64.8 | 162.7 | 0 | 0 | 0 | 110.6 | L926 L954 L957 L958 T961 A968 L969 A974 A975 A976 L986 | L926-I972 HydrophobicContact CD2-CG1 4.1Å; L954-I972 HydrophobicContact CD1-CD1 4.45Å; L957-I972 HydrophobicContact CB-CD1 4.49Å; L957-I972 HydrophobicContact CD2-CD1 4.08Å; L957-I972 HydrophobicContact CD2-CG1 4.22Å; L957-I972 HydrophobicContact CD2-CG2 4.19Å; L957-I972 HydrophobicContact CG-CD1 3.73Å; L957-I972 HydrophobicContact CG-CG1 4Å; L958-I972 HydrophobicContact CD2-CD1 3.65Å; L958-I972 HydrophobicContact CG-CD1 4Å; T961-I972 HydrophobicContact CG2-CG1 4.27Å; A968-I972 WeakPolarHBondContact O-CG1 3.38Å; A968-I972 PolarHBondContact O-N 3.31Å; A968-I972 VanDerWaalsContact O-N 3.07Å; L969-I972 PolarHBondContact O-N 2.82Å; L969-I972 VanDerWaalsContact O-N 3.11Å; I972-A974 PolarHBondContact O-N 3.46Å; I972-A975 CarbonylContact O-C 3.57Å; I972-A975 PolarHBondContact O-N 3.19Å; I972-A976 VanDerWaalsContact O-CB 3.23Å; I972-A976 WeakPolarHBondContact O-CB 3.36Å; I972-A976 PolarHBondContact O-N 3.48Å; I972-L986 HydrophobicContact CG2-CD1 4.22Å; I972-L986 HydrophobicContact CG2-CD2 4.4Å |
| 973 | L | 90.6 | Very high | 88.8 | Confident | 8 Ų | 8 | 39.5 Ų | 39.5 | 4% | 0.042 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.6 | -45.2 | -179.9 | -68.1 | 173.7 | 0 | 0 | 0 | 111.6 | L969 A975 A976 G977 G978 L983 L986 A1018 | L969-L973 HydrophobicContact CD1-CD1 4.23Å; L969-L973 HydrophobicContact CD1-CD2 4.31Å; L969-L973 HydrophobicContact CD1-CG 3.96Å; L969-L973 HydrophobicContact CG-CD1 3.9Å; L969-L973 HydrophobicContact CG-CG 4.13Å; L969-L973 WeakPolarHBondContact O-CB 3.29Å; L969-L973 VanDerWaalsContact O-CG 3.26Å; L969-L973 WeakPolarHBondContact O-CG 2.94Å; L969-L973 PolarHBondContact O-N 2.86Å; L973-A975 VanDerWaalsContact C-N 3.32Å; L973-A975 PolarHBondContact O-N 2.85Å; L973-A976 PolarHBondContact O-N 3.4Å; L973-G977 PolarHBondContact O-N 2.87Å; L973-G978 WeakPolarHBondContact O-CA 3.45Å; L973-G978 PolarHBondContact O-N 3.26Å; L973-L983 HydrophobicContact CD1-CD1 3.63Å; L973-L983 HydrophobicContact CD1-CG 4.37Å; L973-L983 HydrophobicContact CD2-CB 4.28Å; L973-L983 HydrophobicContact CD2-CD1 3.67Å; L973-L983 HydrophobicContact CD2-CG 3.76Å; L973-L983 HydrophobicContact CG-CD1 4.24Å; L973-L986 HydrophobicContact CD2-CB 4.43Å; L973-L986 HydrophobicContact CD2-CD2 3.89Å; L973-A1018 HydrophobicContact CD1-CB 4.16Å |
| 974 | A | 88.6 | Confident | 89.2 | Confident | 58 Ų | 58 | 34.2 Ų | 34.2 | 48% | 0.479 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.3 | -39.3 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | A970 I972 | A970-A974 VanDerWaalsContact O-CB 3.3Å; A970-A974 WeakPolarHBondContact O-CB 3.45Å; A970-A974 PolarHBondContact O-N 2.94Å; I972-A974 PolarHBondContact O-N 3.46Å |
| 975 | A | 88.2 | Confident | 89.3 | Confident | 16 Ų | 16 | 32.1 Ų | 32.1 | 13% | 0.132 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -77.6 | -20.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | L926 L930 N971 I972 L973 | L926-A975 HydrophobicContact CB-CB 4.21Å; L926-A975 HydrophobicContact CD2-CB 3.78Å; L926-A975 HydrophobicContact CG-CB 3.75Å; L930-A975 HydrophobicContact CD1-CB 3.7Å; N971-A975 WeakPolarHBondContact O-CB 3.46Å; N971-A975 PolarHBondContact O-N 3.5Å; I972-A975 CarbonylContact O-C 3.57Å; I972-A975 PolarHBondContact O-N 3.19Å; L973-A975 VanDerWaalsContact C-N 3.32Å; L973-A975 PolarHBondContact O-N 2.85Å |
| 976 | A | 87.7 | Confident | 89.5 | Confident | 2 Ų | 2 | 29.7 Ų | 29.7 | 2% | 0.017 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -86 | -7.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | L940 I972 L973 N985 | L940-A976 HydrophobicContact CD1-CB 3.51Å; I972-A976 VanDerWaalsContact O-CB 3.23Å; I972-A976 WeakPolarHBondContact O-CB 3.36Å; I972-A976 PolarHBondContact O-N 3.48Å; L973-A976 PolarHBondContact O-N 3.4Å; A976-N985 PolarHBondContact O-ND2 3.38Å |
| 977 | G | 85.2 | Confident | 89.6 | Confident | 60 Ų | 60 | 29.6 Ų | 29.6 | 62% | 0.619 | 20% | 0.196 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 136.4 | -16.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | L973 | L973-G977 PolarHBondContact O-N 2.87Š|
| 978 | G | 82.6 | Confident | 89.6 | Confident | 26 Ų | 26 | 27.7 Ų | 27.7 | 27% | 0.268 | 19% | 0.187 | S | C | . | . | S | Bend | trans | 77.7 | 158.4 | -177.3 | 0 | 0 | 0 | 0 | 0 | 114 | L973 E981 G982 | L973-G978 WeakPolarHBondContact O-CA 3.45Å; L973-G978 PolarHBondContact O-N 3.26Å; G978-E981 PolarHBondContact O-N 3.07Å; G978-G982 PolarHBondContact O-N 2.83Å |
| 979 | G | 83.2 | Confident | 89.5 | Confident | 44 Ų | 44 | 28.7 Ų | 28.7 | 45% | 0.454 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | 51.9 | -139.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | E981 G982 L983 | G979-E981 PolarHBondContact O-N 3.14Å; G979-G982 PolarHBondContact O-N 2.98Å; G979-L983 WeakPolarHBondContact O-CD1 3.22Å; G979-L983 PolarHBondContact O-N 2.82Å; G979-L983 VanDerWaalsContact O-N 3.15Å |
| 980 | V | 85.9 | Confident | 89.4 | Confident | 40 Ų | 40 | 28.9 Ų | 28.9 | 24% | 0.242 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -60.7 | -43.2 | -179.2 | -171.4 | 0 | 0 | 0 | 0 | 112.2 | L983 K984 N1028 E1031 | V980-L983 PolarHBondContact O-N 2.59Å; V980-K984 WeakPolarHBondContact O-CB 3.37Å; V980-K984 PolarHBondContact O-N 3.47Å; V980-N1028 HydrophobicContact CG2-CB 4.01Å; V980-N1028 WeakPolarHBondContact CG2-OD1 3.33Å; V980-E1031 HydrophobicContact CG1-CB 3.93Å; V980-E1031 HydrophobicContact CG2-CB 4.5Å |
| 981 | E | 88.2 | Confident | 89.3 | Confident | 91 Ų | 91 | 29.9 Ų | 29.9 | 43% | 0.425 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -71.9 | -35.2 | -176.1 | -168.5 | 64.4 | -174.3 | 0 | 0 | 111.5 | G978 G979 K984 N985 | G978-E981 PolarHBondContact O-N 3.07Å; G979-E981 PolarHBondContact O-N 3.14Å; E981-K984 VanDerWaalsContact CD-NZ 3.3Å; E981-K984 PolarHBondContact O-N 3.37Å; E981-K984 IonicContact OE1-NZ 2.62Å; E981-K984 PolarHBondContact OE1-NZ 2.9Å; E981-K984 IonicContact OE2-NZ 2.74Å; E981-K984 PolarHBondContact OE2-NZ 2.8Å; E981-N985 VanDerWaalsContact O-CB 3.26Å; E981-N985 WeakPolarHBondContact O-CB 3.3Å; E981-N985 PolarHBondContact O-N 3.04Å; E981-N985 PolarHBondContact O-ND2 3.39Å |
| 982 | G | 90 | Very high | 89 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.6 | -40.6 | 169.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | G978 G979 L986 | G978-G982 PolarHBondContact O-N 2.83Å; G979-G982 PolarHBondContact O-N 2.98Å; G982-L986 WeakPolarHBondContact O-CB 3.06Å; G982-L986 PolarHBondContact O-N 3.41Å |
| 983 | L | 91.1 | Very high | 88.7 | Confident | 3 Ų | 3 | 31.3 Ų | 31.3 | 2% | 0.016 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -66.5 | -47.4 | 173.1 | -100.3 | 94.5 | 0 | 0 | 0 | 111.9 | L973 G979 V980 L986 L987 S1019 L1029 | L973-L983 HydrophobicContact CD1-CD1 3.63Å; L973-L983 HydrophobicContact CD1-CG 4.37Å; L973-L983 HydrophobicContact CD2-CB 4.28Å; L973-L983 HydrophobicContact CD2-CD1 3.67Å; L973-L983 HydrophobicContact CD2-CG 3.76Å; L973-L983 HydrophobicContact CG-CD1 4.24Å; G979-L983 WeakPolarHBondContact O-CD1 3.22Å; G979-L983 PolarHBondContact O-N 2.82Å; G979-L983 VanDerWaalsContact O-N 3.15Å; V980-L983 PolarHBondContact O-N 2.59Å; L983-L986 WeakPolarHBondContact O-CB 3.43Å; L983-L986 PolarHBondContact O-N 3.01Å; L983-L986 VanDerWaalsContact O-N 3.17Å; L983-L987 HydrophobicContact CB-CD1 4.43Å; L983-L987 WeakPolarHBondContact O-CB 3.41Å; L983-L987 VanDerWaalsContact O-CG 3.25Å; L983-L987 WeakPolarHBondContact O-CG 3.24Å; L983-L987 PolarHBondContact O-N 3.08Å; L983-S1019 WeakPolarHBondContact CD1-OG 3.46Å; L983-L1029 HydrophobicContact CD2-CB 4.24Å; L983-L1029 HydrophobicContact CD2-CD1 3.63Å |
| 984 | K | 91.7 | Very high | 88.4 | Confident | 63 Ų | 63 | 32 Ų | 32 | 27% | 0.274 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60.7 | -47.8 | -179 | 177.4 | 171.2 | 141.8 | -99.7 | 0 | 111.4 | V980 E981 L986 L987 E988 | V980-K984 WeakPolarHBondContact O-CB 3.37Å; V980-K984 PolarHBondContact O-N 3.47Å; E981-K984 VanDerWaalsContact CD-NZ 3.3Å; E981-K984 PolarHBondContact O-N 3.37Å; E981-K984 IonicContact OE1-NZ 2.62Å; E981-K984 PolarHBondContact OE1-NZ 2.9Å; E981-K984 IonicContact OE2-NZ 2.74Å; E981-K984 PolarHBondContact OE2-NZ 2.8Å; K984-L986 VanDerWaalsContact C-N 3.28Å; K984-L986 PolarHBondContact O-N 3.31Å; K984-L987 PolarHBondContact O-N 2.76Å; K984-E988 WeakPolarHBondContact CE-OE1 3.34Å; K984-E988 HydrophobicContact CG-CG 4.43Å; K984-E988 WeakPolarHBondContact CG-OE1 3.3Å; K984-E988 WeakPolarHBondContact O-CB 3.39Å; K984-E988 WeakPolarHBondContact O-CG 3.24Å; K984-E988 PolarHBondContact O-N 3.03Å |
| 985 | N | 91.8 | Very high | 88.4 | Confident | 14 Ų | 14 | 33.7 Ų | 33.7 | 8% | 0.075 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -56.7 | -41.1 | 174 | -76 | -26.9 | 0 | 0 | 0 | 112.1 | L937 L940 A976 E981 A989 | L937-N985 HydrophobicContact CB-CB 4.36Å; L937-N985 WeakPolarHBondContact CB-OD1 3.24Å; L937-N985 WeakPolarHBondContact CD1-O 3.45Å; L937-N985 PolarHBondContact N-OD1 3.5Å; L940-N985 HydrophobicContact CD1-CB 4.18Å; A976-N985 PolarHBondContact O-ND2 3.38Å; E981-N985 VanDerWaalsContact O-CB 3.26Å; E981-N985 WeakPolarHBondContact O-CB 3.3Å; E981-N985 PolarHBondContact O-N 3.04Å; E981-N985 PolarHBondContact O-ND2 3.39Å; N985-A989 VanDerWaalsContact O-CB 3.25Å; N985-A989 WeakPolarHBondContact O-CB 3.39Å; N985-A989 PolarHBondContact O-N 2.54Å; N985-A989 VanDerWaalsContact O-N 3.16Å |
| 986 | L | 92.9 | Very high | 88.5 | Confident | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -68 | -46.5 | 176.6 | 179.5 | 61.7 | 0 | 0 | 0 | 112.3 | L940 L954 L969 I972 L973 G982 L983 K984 A989 V990 L1000 | L940-L986 HydrophobicContact CD1-CB 4.16Å; L940-L986 HydrophobicContact CD1-CD1 4.36Å; L940-L986 HydrophobicContact CD2-CD1 3.78Å; L954-L986 HydrophobicContact CD1-CD1 3.9Å; L969-L986 HydrophobicContact CD1-CD2 3.41Å; L969-L986 VanDerWaalsContact CD1-CD2 3.41Å; I972-L986 HydrophobicContact CG2-CD1 4.22Å; I972-L986 HydrophobicContact CG2-CD2 4.4Å; L973-L986 HydrophobicContact CD2-CB 4.43Å; L973-L986 HydrophobicContact CD2-CD2 3.89Å; G982-L986 WeakPolarHBondContact O-CB 3.06Å; G982-L986 PolarHBondContact O-N 3.41Å; L983-L986 WeakPolarHBondContact O-CB 3.43Å; L983-L986 PolarHBondContact O-N 3.01Å; L983-L986 VanDerWaalsContact O-N 3.17Å; K984-L986 VanDerWaalsContact C-N 3.28Å; K984-L986 PolarHBondContact O-N 3.31Å; L986-A989 PolarHBondContact O-N 3.07Å; L986-V990 WeakPolarHBondContact O-CG2 3.35Å; L986-V990 PolarHBondContact O-N 3.46Å; L986-V990 VanDerWaalsContact O-N 3.17Å; L986-L1000 HydrophobicContact CD2-CD1 4Å |
| 987 | L | 91.8 | Very high | 88.6 | Confident | 3 Ų | 3 | 32.8 Ų | 32.8 | 2% | 0.016 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.3 | -43.2 | -177.5 | -73.6 | 164.7 | 0 | 0 | 0 | 112 | L983 K984 V990 G991 G992 L997 L1000 S1032 I1033 | L983-L987 HydrophobicContact CB-CD1 4.43Å; L983-L987 WeakPolarHBondContact O-CB 3.41Å; L983-L987 VanDerWaalsContact O-CG 3.25Å; L983-L987 WeakPolarHBondContact O-CG 3.24Å; L983-L987 PolarHBondContact O-N 3.08Å; K984-L987 PolarHBondContact O-N 2.76Å; L987-V990 PolarHBondContact O-N 2.79Å; L987-G991 PolarHBondContact O-N 3.38Å; L987-G992 WeakPolarHBondContact O-CA 3.38Å; L987-G992 PolarHBondContact O-N 3.33Å; L987-L997 HydrophobicContact CD2-CB 3.95Å; L987-L997 HydrophobicContact CD2-CD1 4.03Å; L987-L1000 HydrophobicContact CD2-CB 4.27Å; L987-L1000 HydrophobicContact CD2-CD2 3.85Å; L987-L1000 HydrophobicContact CG-CD2 4.5Å; L987-S1032 WeakPolarHBondContact CD1-OG 3.39Å; L987-I1033 HydrophobicContact CD1-CG2 3.67Å |
| 988 | E | 91.1 | Very high | 88.9 | Confident | 86 Ų | 86 | 33.3 Ų | 33.3 | 40% | 0.402 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -60.9 | -46.2 | 172.6 | -73.5 | 179.5 | -164.4 | 0 | 0 | 110.6 | L937 K984 V990 G991 | L937-E988 HydrophobicContact CD1-CB 3.75Å; L937-E988 HydrophobicContact CD2-CB 4.49Å; K984-E988 WeakPolarHBondContact CE-OE1 3.34Å; K984-E988 HydrophobicContact CG-CG 4.43Å; K984-E988 WeakPolarHBondContact CG-OE1 3.3Å; K984-E988 WeakPolarHBondContact O-CB 3.39Å; K984-E988 WeakPolarHBondContact O-CG 3.24Å; K984-E988 PolarHBondContact O-N 3.03Å; E988-V990 PolarHBondContact O-N 2.85Å; E988-V990 VanDerWaalsContact O-N 3.15Å; E988-G991 PolarHBondContact O-N 3.35Å; E988-G991 VanDerWaalsContact O-N 3.08Å |
| 989 | A | 90.6 | Very high | 89.3 | Confident | 20 Ų | 20 | 33.4 Ų | 33.4 | 17% | 0.165 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62.6 | -20.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | L937 L940 E941 L944 N985 L986 | L937-A989 HydrophobicContact CD1-CB 3.89Å; L940-A989 HydrophobicContact CB-CB 4.01Å; E941-A989 HydrophobicContact CG-CB 4.23Å; L944-A989 HydrophobicContact CD1-CB 3.8Å; N985-A989 VanDerWaalsContact O-CB 3.25Å; N985-A989 WeakPolarHBondContact O-CB 3.39Å; N985-A989 PolarHBondContact O-N 2.54Å; N985-A989 VanDerWaalsContact O-N 3.16Å; L986-A989 PolarHBondContact O-N 3.07Å |
| 990 | V | 91.1 | Very high | 89.8 | Confident | 6 Ų | 6 | 31.4 Ų | 31.4 | 4% | 0.036 | 19% | 0.188 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -108.4 | 10.8 | 174.8 | -56.9 | 0 | 0 | 0 | 0 | 114.6 | L944 L954 L986 L987 E988 G996 N999 | L944-V990 HydrophobicContact CD1-CG1 3.8Å; L954-V990 HydrophobicContact CB-CG1 4.38Å; L954-V990 HydrophobicContact CD2-CG1 4.07Å; L986-V990 WeakPolarHBondContact O-CG2 3.35Å; L986-V990 PolarHBondContact O-N 3.46Å; L986-V990 VanDerWaalsContact O-N 3.17Å; L987-V990 PolarHBondContact O-N 2.79Å; E988-V990 PolarHBondContact O-N 2.85Å; E988-V990 VanDerWaalsContact O-N 3.15Å; V990-G996 VanDerWaalsContact CG2-O 3.29Å; V990-G996 WeakPolarHBondContact CG2-O 3.48Å; V990-N999 HydrophobicContact CB-CB 4.24Å; V990-N999 HydrophobicContact CG2-CB 4.16Å; V990-N999 PolarHBondContact O-ND2 3.27Å |
| 991 | G | 88 | Confident | 90 | Very high | 57 Ų | 57 | 29.8 Ų | 29.8 | 59% | 0.588 | 18% | 0.178 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 134.2 | -10.4 | 165.6 | 0 | 0 | 0 | 0 | 0 | 116.6 | L987 E988 | L987-G991 PolarHBondContact O-N 3.38Å; E988-G991 PolarHBondContact O-N 3.35Å; E988-G991 VanDerWaalsContact O-N 3.08Å |
| 992 | G | 85.2 | Confident | 90 | Very high | 23 Ų | 23 | 29.1 Ų | 29.1 | 24% | 0.237 | 18% | 0.177 | C | C | . | . | S | Bend | trans | 73.9 | 154.1 | -180 | 0 | 0 | 0 | 0 | 0 | 114.9 | L987 E995 G996 | L987-G992 WeakPolarHBondContact O-CA 3.38Å; L987-G992 PolarHBondContact O-N 3.33Å; G992-E995 PolarHBondContact O-N 3.12Å; G992-G996 PolarHBondContact O-N 3.03Å |
| 993 | G | 86.2 | Confident | 90.1 | Very high | 37 Ų | 37 | 29.7 Ų | 29.7 | 38% | 0.381 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | 51 | -138.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | E995 G996 L997 | G993-E995 PolarHBondContact O-N 3.25Å; G993-G996 PolarHBondContact O-N 2.92Å; G993-L997 WeakPolarHBondContact O-CB 3.35Å; G993-L997 PolarHBondContact O-N 3.2Å |
| 994 | A | 85.8 | Confident | 90 | Very high | 22 Ų | 22 | 30 Ų | 30 | 18% | 0.182 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -65 | -36.1 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | K998 T1042 Q1045 A1046 | A994-K998 WeakPolarHBondContact O-CB 3.35Å; A994-K998 PolarHBondContact O-N 2.85Å; A994-T1042 HydrophobicContact CB-CG2 3.92Å; A994-T1042 VanDerWaalsContact N-CG2 3.29Å; A994-Q1045 HydrophobicContact CB-CB 3.97Å; A994-A1046 HydrophobicContact CB-CB 4.42Å; A994-A1046 WeakPolarHBondContact O-CB 3.49Å |
| 995 | E | 87.5 | Confident | 89.7 | Confident | 94 Ų | 94 | 28.3 Ų | 28.3 | 44% | 0.439 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -75.5 | -38.5 | -179 | -167.1 | 62.4 | -158.7 | 0 | 0 | 111.3 | G992 G993 K998 N999 | G992-E995 PolarHBondContact O-N 3.12Å; G993-E995 PolarHBondContact O-N 3.25Å; E995-K998 PolarHBondContact O-N 2.97Å; E995-K998 IonicContact OE1-NZ 2.71Å; E995-K998 PolarHBondContact OE1-NZ 2.97Å; E995-K998 IonicContact OE2-NZ 2.65Å; E995-K998 PolarHBondContact OE2-NZ 3.4Å; E995-N999 WeakPolarHBondContact O-CB 3.34Å; E995-N999 PolarHBondContact O-N 3.48Å; E995-N999 PolarHBondContact O-ND2 2.98Å |
| 996 | G | 90.2 | Very high | 89.1 | Confident | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61 | -44.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | V990 G992 G993 N999 L1000 | V990-G996 VanDerWaalsContact CG2-O 3.29Å; V990-G996 WeakPolarHBondContact CG2-O 3.48Å; G992-G996 PolarHBondContact O-N 3.03Å; G993-G996 PolarHBondContact O-N 2.92Å; G996-N999 WeakPolarHBondContact O-CB 3.44Å; G996-N999 PolarHBondContact O-N 2.68Å; G996-L1000 PolarHBondContact O-N 3.32Å |
| 997 | L | 91.5 | Very high | 88.6 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -65.7 | -40.8 | 176.4 | -179.4 | 58 | 0 | 0 | 0 | 112.8 | L987 G993 N999 L1000 L1001 L1029 I1033 L1043 A1046 | L987-L997 HydrophobicContact CD2-CB 3.95Å; L987-L997 HydrophobicContact CD2-CD1 4.03Å; G993-L997 WeakPolarHBondContact O-CB 3.35Å; G993-L997 PolarHBondContact O-N 3.2Å; L997-N999 VanDerWaalsContact C-N 3.32Å; L997-N999 PolarHBondContact O-N 3.39Å; L997-L1000 PolarHBondContact O-N 3.43Å; L997-L1001 HydrophobicContact CG-CD1 4.44Å; L997-L1001 WeakPolarHBondContact O-CG 3.48Å; L997-L1001 PolarHBondContact O-N 3.15Å; L997-L1029 HydrophobicContact CD1-CD1 3.94Å; L997-I1033 HydrophobicContact CD2-CD1 3.71Å; L997-I1033 HydrophobicContact CD2-CG2 4.42Å; L997-L1043 HydrophobicContact CD2-CB 4.38Å; L997-L1043 HydrophobicContact CD2-CD1 3.73Å; L997-A1046 HydrophobicContact CB-CB 3.9Å; L997-A1046 HydrophobicContact CD2-CB 3.7Å; L997-A1046 HydrophobicContact CG-CB 3.73Å |
| 998 | K | 90.2 | Very high | 88 | Confident | 71 Ų | 71 | 41.5 Ų | 41.5 | 31% | 0.309 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -62.7 | -37.3 | 172.2 | 171.9 | 162.5 | 151 | -83.3 | 0 | 112 | A994 E995 L1001 N1002 A1046 | A994-K998 WeakPolarHBondContact O-CB 3.35Å; A994-K998 PolarHBondContact O-N 2.85Å; E995-K998 PolarHBondContact O-N 2.97Å; E995-K998 IonicContact OE1-NZ 2.71Å; E995-K998 PolarHBondContact OE1-NZ 2.97Å; E995-K998 IonicContact OE2-NZ 2.65Å; E995-K998 PolarHBondContact OE2-NZ 3.4Å; K998-L1001 PolarHBondContact O-N 2.84Å; K998-N1002 WeakPolarHBondContact O-CB 3.25Å; K998-N1002 PolarHBondContact O-N 3.34Å; K998-N1002 PolarHBondContact O-ND2 3.33Å; K998-A1046 HydrophobicContact CB-CB 4.29Å |
| 999 | N | 91.4 | Very high | 87.2 | Confident | 28 Ų | 28 | 40.1 Ų | 40.1 | 15% | 0.15 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -68.1 | -37.2 | 173.8 | -74.7 | -22.4 | 0 | 0 | 0 | 112.7 | V951 V990 E995 G996 L997 A1003 | V951-N999 HydrophobicContact CG2-CB 3.61Å; V951-N999 VanDerWaalsContact CG2-OD1 3.26Å; V951-N999 WeakPolarHBondContact CG2-OD1 3.37Å; V990-N999 HydrophobicContact CB-CB 4.24Å; V990-N999 HydrophobicContact CG2-CB 4.16Å; V990-N999 PolarHBondContact O-ND2 3.27Å; E995-N999 WeakPolarHBondContact O-CB 3.34Å; E995-N999 PolarHBondContact O-N 3.48Å; E995-N999 PolarHBondContact O-ND2 2.98Å; G996-N999 WeakPolarHBondContact O-CB 3.44Å; G996-N999 PolarHBondContact O-N 2.68Å; L997-N999 VanDerWaalsContact C-N 3.32Å; L997-N999 PolarHBondContact O-N 3.39Å; N999-A1003 WeakPolarHBondContact O-CB 3.45Å; N999-A1003 PolarHBondContact O-N 2.87Å |
| 1000 | L | 93.4 | Very high | 86.8 | Confident | 1 Ų | 1 | 44.8 Ų | 44.8 | 1% | 0.005 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.7 | -46.5 | 171.4 | 177.1 | 59.7 | 0 | 0 | 0 | 111.6 | L954 L969 L986 L987 G996 L997 N1002 A1003 M1004 I1015 | L954-L1000 HydrophobicContact CD2-CD1 3.77Å; L969-L1000 HydrophobicContact CD1-CD1 4.09Å; L969-L1000 HydrophobicContact CD2-CD1 4.37Å; L986-L1000 HydrophobicContact CD2-CD1 4Å; L987-L1000 HydrophobicContact CD2-CB 4.27Å; L987-L1000 HydrophobicContact CD2-CD2 3.85Å; L987-L1000 HydrophobicContact CG-CD2 4.5Å; G996-L1000 PolarHBondContact O-N 3.32Å; L997-L1000 PolarHBondContact O-N 3.43Å; L1000-N1002 PolarHBondContact O-N 3.38Å; L1000-A1003 WeakPolarHBondContact O-CB 3.42Å; L1000-A1003 PolarHBondContact O-N 3.24Å; L1000-A1003 VanDerWaalsContact O-N 3.12Å; L1000-M1004 HydrophobicContact CD1-CG 3.99Å; L1000-M1004 HydrophobicContact CG-CG 4.48Å; L1000-M1004 WeakPolarHBondContact O-CB 3.21Å; L1000-M1004 VanDerWaalsContact O-CG 3.24Å; L1000-M1004 WeakPolarHBondContact O-CG 3.37Å; L1000-M1004 PolarHBondContact O-N 3.15Å; L1000-I1015 HydrophobicContact CD2-CD1 3.98Å; L1000-I1015 HydrophobicContact CD2-CG1 4.18Å; L1000-I1015 HydrophobicContact CD2-CG2 4.38Å; L1000-I1015 HydrophobicContact CG-CD1 3.75Å; L1000-I1015 HydrophobicContact CG-CG1 4.12Å |
| 1001 | L | 90.5 | Very high | 86.7 | Confident | 7 Ų | 7 | 44.5 Ų | 44.5 | 4% | 0.037 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -56.7 | -51.5 | 174.9 | -74.1 | 163.9 | 0 | 0 | 0 | 111.4 | L997 K998 A1003 M1004 G1005 A1011 L1012 I1015 A1046 L1047 | L997-L1001 HydrophobicContact CG-CD1 4.44Å; L997-L1001 WeakPolarHBondContact O-CG 3.48Å; L997-L1001 PolarHBondContact O-N 3.15Å; K998-L1001 PolarHBondContact O-N 2.84Å; L1001-A1003 PolarHBondContact O-N 2.82Å; L1001-M1004 PolarHBondContact O-N 3.24Å; L1001-G1005 PolarHBondContact O-N 3.17Å; L1001-G1005 VanDerWaalsContact O-N 3.14Å; L1001-A1011 HydrophobicContact CD2-CB 3.87Å; L1001-A1011 WeakPolarHBondContact O-CB 3.37Å; L1001-L1012 HydrophobicContact CD2-CB 3.92Å; L1001-I1015 HydrophobicContact CD2-CD1 3.69Å; L1001-I1015 HydrophobicContact CG-CD1 4.1Å; L1001-A1046 HydrophobicContact CD1-CB 4.46Å; L1001-L1047 HydrophobicContact CD1-CD2 3.9Å; L1001-L1047 HydrophobicContact CD1-CG 4.46Å |
| 1002 | N | 89.2 | Confident | 86.7 | Confident | 77 Ų | 77 | 41.9 Ų | 41.9 | 41% | 0.412 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -61.5 | -22.6 | 177.3 | -71.7 | -33.5 | 0 | 0 | 0 | 113.9 | V951 K955 K998 L1000 | V951-N1002 HydrophobicContact CG1-CB 4.21Å; K955-N1002 WeakPolarHBondContact CE-O 3.38Å; K955-N1002 PolarHBondContact NZ-O 3.17Å; K998-N1002 WeakPolarHBondContact O-CB 3.25Å; K998-N1002 PolarHBondContact O-N 3.34Å; K998-N1002 PolarHBondContact O-ND2 3.33Å; L1000-N1002 PolarHBondContact O-N 3.38Å |
| 1003 | A | 90.4 | Very high | 86.6 | Confident | 12 Ų | 12 | 42.4 Ų | 42.4 | 10% | 0.099 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -81.8 | -33.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.7 | V951 L954 K955 L958 N999 L1000 L1001 | V951-A1003 HydrophobicContact CG1-CB 4.28Å; L954-A1003 HydrophobicContact CB-CB 4.08Å; L954-A1003 HydrophobicContact CD2-CB 3.53Å; L954-A1003 HydrophobicContact CG-CB 3.66Å; K955-A1003 HydrophobicContact CG-CB 4.12Å; L958-A1003 HydrophobicContact CD1-CB 4.03Å; N999-A1003 WeakPolarHBondContact O-CB 3.45Å; N999-A1003 PolarHBondContact O-N 2.87Å; L1000-A1003 WeakPolarHBondContact O-CB 3.42Å; L1000-A1003 PolarHBondContact O-N 3.24Å; L1000-A1003 VanDerWaalsContact O-N 3.12Å; L1001-A1003 PolarHBondContact O-N 2.82Å |
| 1004 | M | 90.2 | Very high | 86.7 | Confident | 9 Ų | 9 | 42 Ų | 42 | 4% | 0.044 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -84 | -20.5 | -175.1 | -70.1 | -69.2 | -67.4 | 0 | 0 | 114.4 | L958 P965 L969 L1000 L1001 A1011 N1014 I1015 | L958-M1004 HydrophobicContact CD1-CG 4.46Å; L958-M1004 HydrophobicContact CD1-SD 3.75Å; L958-M1004 HydrophobicContact CD2-SD 3.76Å; L958-M1004 HydrophobicContact CG-SD 4.45Å; P965-M1004 HydrophobicContact CB-CE 3.81Å; P965-M1004 HydrophobicContact CB-SD 4.27Å; P965-M1004 WeakPolarHBondContact O-CE 3.45Å; L969-M1004 HydrophobicContact CB-CE 3.93Å; L969-M1004 HydrophobicContact CB-SD 3.93Å; L969-M1004 HydrophobicContact CD2-CE 3.55Å; L969-M1004 HydrophobicContact CD2-CG 4.39Å; L969-M1004 HydrophobicContact CD2-SD 3.75Å; L969-M1004 HydrophobicContact CG-CE 4.38Å; L969-M1004 HydrophobicContact CG-SD 4.32Å; L1000-M1004 HydrophobicContact CD1-CG 3.99Å; L1000-M1004 HydrophobicContact CG-CG 4.48Å; L1000-M1004 WeakPolarHBondContact O-CB 3.21Å; L1000-M1004 VanDerWaalsContact O-CG 3.24Å; L1000-M1004 WeakPolarHBondContact O-CG 3.37Å; L1000-M1004 PolarHBondContact O-N 3.15Å; L1001-M1004 PolarHBondContact O-N 3.24Å; M1004-A1011 HydrophobicContact CB-CB 3.88Å; M1004-N1014 HydrophobicContact CE-CB 3.53Å; M1004-I1015 HydrophobicContact CE-CG1 4.31Å; M1004-I1015 HydrophobicContact CG-CD1 4.33Å; M1004-I1015 HydrophobicContact CG-CG1 3.95Å |
| 1005 | G | 84.4 | Confident | 86.9 | Confident | 28 Ų | 28 | 41 Ų | 41 | 29% | 0.289 | 23% | 0.225 | S | C | . | . | trans | 169.6 | 166.1 | 171.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | L1001 N1007 | L1001-G1005 PolarHBondContact O-N 3.17Å; L1001-G1005 VanDerWaalsContact O-N 3.14Å; G1005-N1007 VanDerWaalsContact C-N 3.29Å | ||
| 1006 | D | 79.9 | Confident | 86.9 | Confident | 160 Ų | 160 | 36.8 Ų | 36.8 | 86% | 0.856 | 21% | 0.206 | S | C | * | . | S | Bend | trans | -79.1 | -12.6 | 177.8 | -60.7 | -32.8 | 0 | 0 | 0 | 112.9 | ||
| 1007 | N | 82.8 | Confident | 86.7 | Confident | 74 Ų | 74 | 42.1 Ų | 42.1 | 40% | 0.396 | 23% | 0.229 | S | C | . | . | S | Bend | trans | -104.1 | 111.8 | 176 | 174.4 | 3.5 | 0 | 0 | 0 | 109.6 | G1005 N1009 E1010 A1011 | G1005-N1007 VanDerWaalsContact C-N 3.29Å; N1007-N1009 PolarHBondContact O-N 3.33Å; N1007-N1009 VanDerWaalsContact O-N 3.15Å; N1007-N1009 PolarHBondContact OD1-N 3.16Å; N1007-E1010 HydrophobicContact CB-CB 4.06Å; N1007-E1010 PolarHBondContact ND2-OE2 2.88Å; N1007-E1010 PolarHBondContact O-N 3.35Å; N1007-A1011 WeakPolarHBondContact O-CB 3.39Å; N1007-A1011 PolarHBondContact O-N 3.48Å |
| 1008 | P | 78.1 | Confident | 86.5 | Confident | 60 Ų | 60 | 42.8 Ų | 42.8 | 39% | 0.39 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -56.2 | -34 | -176.4 | -27.4 | 35.2 | 0 | 0 | 0 | 114.1 | L1012 L1047 | P1008-L1012 WeakPolarHBondContact O-CB 3.37Å; P1008-L1012 PolarHBondContact O-N 2.89Å; P1008-L1047 HydrophobicContact CB-CD2 3.99Å |
| 1009 | N | 75.3 | Confident | 86.3 | Confident | 57 Ų | 57 | 40.2 Ų | 40.2 | 31% | 0.305 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -76.4 | -34.6 | -174.6 | -61.3 | 10 | 0 | 0 | 0 | 111.4 | N1007 A1013 S1057 | N1007-N1009 PolarHBondContact O-N 3.33Å; N1007-N1009 VanDerWaalsContact O-N 3.15Å; N1007-N1009 PolarHBondContact OD1-N 3.16Å; N1009-A1013 VanDerWaalsContact O-CB 3.3Å; N1009-A1013 WeakPolarHBondContact O-CB 3.44Å; N1009-A1013 PolarHBondContact O-N 3.08Å; N1009-S1057 WeakPolarHBondContact ND2-CB 3.25Å; N1009-S1057 PolarHBondContact ND2-OG 3.41Å; N1009-S1057 WeakPolarHBondContact OD1-CB 3.39Å |
| 1010 | E | 82.6 | Confident | 85.5 | Confident | 118 Ų | 118 | 42.2 Ų | 42.2 | 55% | 0.551 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -77.5 | -40.3 | 175.3 | -175.4 | 173 | -174.6 | 0 | 0 | 111.2 | N1007 L1012 A1013 N1014 | N1007-E1010 HydrophobicContact CB-CB 4.06Å; N1007-E1010 PolarHBondContact ND2-OE2 2.88Å; N1007-E1010 PolarHBondContact O-N 3.35Å; E1010-L1012 PolarHBondContact O-N 3.37Å; E1010-A1013 PolarHBondContact O-N 3.49Å; E1010-N1014 WeakPolarHBondContact O-CB 3.2Å; E1010-N1014 VanDerWaalsContact O-CG 3.27Å; E1010-N1014 PolarHBondContact O-N 3.39Å; E1010-N1014 PolarHBondContact O-ND2 3.48Å |
| 1011 | A | 88.5 | Confident | 84.6 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -57.1 | -47.8 | 170 | 0 | 0 | 0 | 0 | 0 | 111.3 | L1001 M1004 N1007 N1014 I1015 | L1001-A1011 HydrophobicContact CD2-CB 3.87Å; L1001-A1011 WeakPolarHBondContact O-CB 3.37Å; M1004-A1011 HydrophobicContact CB-CB 3.88Å; N1007-A1011 WeakPolarHBondContact O-CB 3.39Å; N1007-A1011 PolarHBondContact O-N 3.48Å; A1011-N1014 PolarHBondContact O-N 3.49Å; A1011-I1015 VanDerWaalsContact O-CG1 3.27Å; A1011-I1015 WeakPolarHBondContact O-CG1 3.27Å; A1011-I1015 PolarHBondContact O-N 3.48Å |
| 1012 | L | 87.1 | Confident | 83.8 | Confident | 1 Ų | 1 | 45.3 Ų | 45.3 | 1% | 0.005 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64.5 | -44.6 | 177 | -179.2 | 61.5 | 0 | 0 | 0 | 112.4 | L1001 P1008 E1010 N1014 I1015 L1016 L1029 L1043 L1047 L1058 S1061 | L1001-L1012 HydrophobicContact CD2-CB 3.92Å; P1008-L1012 WeakPolarHBondContact O-CB 3.37Å; P1008-L1012 PolarHBondContact O-N 2.89Å; E1010-L1012 PolarHBondContact O-N 3.37Å; L1012-N1014 VanDerWaalsContact C-N 3.29Å; L1012-N1014 PolarHBondContact O-N 3.18Å; L1012-I1015 PolarHBondContact O-N 3.42Å; L1012-L1016 HydrophobicContact CD1-CD1 4.19Å; L1012-L1016 HydrophobicContact CD1-CG 4.3Å; L1012-L1016 HydrophobicContact CG-CD1 3.96Å; L1012-L1016 VanDerWaalsContact O-CG 3.3Å; L1012-L1016 WeakPolarHBondContact O-CG 3.5Å; L1012-L1016 PolarHBondContact O-N 2.88Å; L1012-L1029 HydrophobicContact CD1-CD2 3.87Å; L1012-L1043 HydrophobicContact CD1-CD1 4.34Å; L1012-L1047 HydrophobicContact CD2-CD1 4.42Å; L1012-L1047 HydrophobicContact CD2-CD2 4.48Å; L1012-L1058 HydrophobicContact CD2-CD2 3.59Å; L1012-L1058 HydrophobicContact CD2-CG 4.14Å; L1012-S1061 WeakPolarHBondContact CD2-OG 3.38Å |
| 1013 | A | 83.9 | Confident | 83.2 | Confident | 35 Ų | 35 | 43.1 Ų | 43.1 | 29% | 0.289 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.5 | -38.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112 | N1009 E1010 L1016 K1017 | N1009-A1013 VanDerWaalsContact O-CB 3.3Å; N1009-A1013 WeakPolarHBondContact O-CB 3.44Å; N1009-A1013 PolarHBondContact O-N 3.08Å; E1010-A1013 PolarHBondContact O-N 3.49Å; A1013-L1016 PolarHBondContact O-N 3.39Å; A1013-K1017 VanDerWaalsContact O-CB 3.22Å; A1013-K1017 WeakPolarHBondContact O-CB 3.44Å; A1013-K1017 PolarHBondContact O-N 3.31Å |
| 1014 | N | 87.8 | Confident | 82.7 | Confident | 28 Ų | 28 | 47.2 Ų | 47.2 | 15% | 0.15 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -69.5 | -35.5 | 174.9 | -72.8 | -33.5 | 0 | 0 | 0 | 112.7 | S966 M1004 E1010 A1011 L1012 A1018 | S966-N1014 VanDerWaalsContact CB-O 3.3Å; S966-N1014 WeakPolarHBondContact CB-O 3.26Å; M1004-N1014 HydrophobicContact CE-CB 3.53Å; E1010-N1014 WeakPolarHBondContact O-CB 3.2Å; E1010-N1014 VanDerWaalsContact O-CG 3.27Å; E1010-N1014 PolarHBondContact O-N 3.39Å; E1010-N1014 PolarHBondContact O-ND2 3.48Å; A1011-N1014 PolarHBondContact O-N 3.49Å; L1012-N1014 VanDerWaalsContact C-N 3.29Å; L1012-N1014 PolarHBondContact O-N 3.18Å; N1014-A1018 WeakPolarHBondContact O-CB 3.27Å; N1014-A1018 PolarHBondContact O-N 3.14Å |
| 1015 | I | 90.7 | Very high | 82.4 | Confident | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -62.5 | -51.2 | 170.9 | -67.8 | 160.6 | 0 | 0 | 0 | 110.2 | L969 L1000 L1001 M1004 A1011 L1012 K1017 A1018 S1019 L1029 | L969-I1015 HydrophobicContact CD2-CB 4.22Å; L969-I1015 HydrophobicContact CD2-CG1 3.82Å; L969-I1015 HydrophobicContact CD2-CG2 4.47Å; L1000-I1015 HydrophobicContact CD2-CD1 3.98Å; L1000-I1015 HydrophobicContact CD2-CG1 4.18Å; L1000-I1015 HydrophobicContact CD2-CG2 4.38Å; L1000-I1015 HydrophobicContact CG-CD1 3.75Å; L1000-I1015 HydrophobicContact CG-CG1 4.12Å; L1001-I1015 HydrophobicContact CD2-CD1 3.69Å; L1001-I1015 HydrophobicContact CG-CD1 4.1Å; M1004-I1015 HydrophobicContact CE-CG1 4.31Å; M1004-I1015 HydrophobicContact CG-CD1 4.33Å; M1004-I1015 HydrophobicContact CG-CG1 3.95Å; A1011-I1015 VanDerWaalsContact O-CG1 3.27Å; A1011-I1015 WeakPolarHBondContact O-CG1 3.27Å; A1011-I1015 PolarHBondContact O-N 3.48Å; L1012-I1015 PolarHBondContact O-N 3.42Å; I1015-K1017 VanDerWaalsContact C-N 3.34Å; I1015-K1017 PolarHBondContact O-N 3.41Å; I1015-A1018 WeakPolarHBondContact O-CB 3.3Å; I1015-A1018 PolarHBondContact O-N 3.05Å; I1015-A1018 VanDerWaalsContact O-N 3.12Å; I1015-S1019 PolarHBondContact O-N 3.02Å; I1015-S1019 PolarHBondContact O-OG 3.38Å; I1015-L1029 HydrophobicContact CG2-CD1 4.37Å; I1015-L1029 HydrophobicContact CG2-CD2 4.47Å |
| 1016 | L | 87.4 | Confident | 82.6 | Confident | 6 Ų | 6 | 45.5 Ų | 45.5 | 3% | 0.031 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 179.5 | -67.9 | 164.6 | 0 | 0 | 0 | 112 | L1012 A1013 S1019 G1020 G1021 A1025 L1026 L1029 V1062 | L1012-L1016 HydrophobicContact CD1-CD1 4.19Å; L1012-L1016 HydrophobicContact CD1-CG 4.3Å; L1012-L1016 HydrophobicContact CG-CD1 3.96Å; L1012-L1016 VanDerWaalsContact O-CG 3.3Å; L1012-L1016 WeakPolarHBondContact O-CG 3.5Å; L1012-L1016 PolarHBondContact O-N 2.88Å; A1013-L1016 PolarHBondContact O-N 3.39Å; L1016-S1019 PolarHBondContact O-N 2.96Å; L1016-G1020 PolarHBondContact O-N 3.48Å; L1016-G1021 WeakPolarHBondContact O-CA 3.46Å; L1016-G1021 PolarHBondContact O-N 3.41Å; L1016-A1025 HydrophobicContact CD2-CB 4.41Å; L1016-A1025 VanDerWaalsContact O-CB 3.24Å; L1016-A1025 WeakPolarHBondContact O-CB 3.24Å; L1016-L1026 HydrophobicContact CD2-CB 3.86Å; L1016-L1026 HydrophobicContact CD2-CD1 4.14Å; L1016-L1029 HydrophobicContact CD2-CD2 4.13Å; L1016-V1062 HydrophobicContact CD1-CG1 3.65Å |
| 1017 | K | 85.9 | Confident | 82.9 | Confident | 112 Ų | 112 | 40.9 Ų | 40.9 | 49% | 0.487 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -61.4 | -41.3 | 173.4 | -179.6 | -179 | 165.9 | -145.8 | 0 | 111.8 | D964 S966 A1013 I1015 S1019 G1020 | D964-K1017 IonicContact OD1-NZ 2.75Å; D964-K1017 PolarHBondContact OD1-NZ 2.92Å; D964-K1017 VanDerWaalsContact OD1-NZ 3.08Å; D964-K1017 IonicContact OD2-NZ 2.6Å; S966-K1017 VanDerWaalsContact OG-CD 3.24Å; S966-K1017 WeakPolarHBondContact OG-CD 2.85Å; S966-K1017 WeakPolarHBondContact OG-CE 3.43Å; S966-K1017 PolarHBondContact OG-NZ 3.18Å; A1013-K1017 VanDerWaalsContact O-CB 3.22Å; A1013-K1017 WeakPolarHBondContact O-CB 3.44Å; A1013-K1017 PolarHBondContact O-N 3.31Å; I1015-K1017 VanDerWaalsContact C-N 3.34Å; I1015-K1017 PolarHBondContact O-N 3.41Å; K1017-S1019 VanDerWaalsContact C-N 3.34Å; K1017-G1020 PolarHBondContact O-N 3.19Å |
| 1018 | A | 87.4 | Confident | 83.1 | Confident | 15 Ų | 15 | 38.7 Ų | 38.7 | 12% | 0.124 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -67.1 | -33.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S966 L969 A970 L973 N1014 I1015 G1020 | S966-A1018 WeakPolarHBondContact O-CB 3.41Å; L969-A1018 HydrophobicContact CB-CB 3.76Å; L969-A1018 HydrophobicContact CD2-CB 3.68Å; L969-A1018 HydrophobicContact CG-CB 3.65Å; A970-A1018 HydrophobicContact CB-CB 4.21Å; L973-A1018 HydrophobicContact CD1-CB 4.16Å; N1014-A1018 WeakPolarHBondContact O-CB 3.27Å; N1014-A1018 PolarHBondContact O-N 3.14Å; I1015-A1018 WeakPolarHBondContact O-CB 3.3Å; I1015-A1018 PolarHBondContact O-N 3.05Å; I1015-A1018 VanDerWaalsContact O-N 3.12Å; A1018-G1020 PolarHBondContact O-N 2.83Å |
| 1019 | S | 85 | Confident | 83.6 | Confident | 16 Ų | 16 | 35.9 Ų | 35.9 | 11% | 0.112 | 22% | 0.221 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | 4.6 | 176.5 | -56.5 | 0 | 0 | 0 | 0 | 114.6 | L983 I1015 L1016 K1017 | L983-S1019 WeakPolarHBondContact CD1-OG 3.46Å; I1015-S1019 PolarHBondContact O-N 3.02Å; I1015-S1019 PolarHBondContact O-OG 3.38Å; L1016-S1019 PolarHBondContact O-N 2.96Å; K1017-S1019 VanDerWaalsContact C-N 3.34Å |
| 1020 | G | 75.9 | Confident | 84.3 | Confident | 70 Ų | 70 | 33.2 Ų | 33.2 | 72% | 0.722 | 21% | 0.207 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 113 | -10.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | L1016 K1017 A1018 | L1016-G1020 PolarHBondContact O-N 3.48Å; K1017-G1020 PolarHBondContact O-N 3.19Å; A1018-G1020 PolarHBondContact O-N 2.83Å |
| 1021 | G | 73.5 | Confident | 84.6 | Confident | 30 Ų | 30 | 32 Ų | 32 | 31% | 0.309 | 20% | 0.201 | S | C | . | . | S | Bend | trans | 76.2 | 166.5 | -174.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | L1016 A1025 | L1016-G1021 WeakPolarHBondContact O-CA 3.46Å; L1016-G1021 PolarHBondContact O-N 3.41Å; G1021-A1025 VanDerWaalsContact C-CB 3.45Å; G1021-A1025 VanDerWaalsContact N-CB 3.33Å; G1021-A1025 WeakPolarHBondContact O-CB 3.47Å; G1021-A1025 PolarHBondContact O-N 3.17Å |
| 1022 | G | 74.3 | Confident | 84.6 | Confident | 43 Ų | 43 | 32.6 Ų | 32.6 | 44% | 0.443 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | 70 | -163.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | A1025 L1026 | G1022-A1025 PolarHBondContact O-N 3.02Å; G1022-L1026 PolarHBondContact O-N 2.84Å |
| 1023 | S | 75.3 | Confident | 84.7 | Confident | 32 Ų | 32 | 33.3 Ų | 33.3 | 22% | 0.224 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -64.8 | -38.4 | 179.5 | 48.6 | 0 | 0 | 0 | 0 | 112.9 | A1025 L1026 K1027 N1071 | S1023-A1025 VanDerWaalsContact C-N 3.33Å; S1023-A1025 PolarHBondContact O-N 3.34Å; S1023-L1026 PolarHBondContact O-N 3.47Å; S1023-K1027 WeakPolarHBondContact O-CB 3.43Å; S1023-K1027 PolarHBondContact O-N 3.26Å; S1023-N1071 WeakPolarHBondContact CB-O 3.44Å |
| 1024 | E | 81.1 | Confident | 84.7 | Confident | 98 Ų | 98 | 34.4 Ų | 34.4 | 46% | 0.458 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -65.6 | -34.8 | 179.6 | -160.7 | 66.9 | -169.2 | 0 | 0 | 112 | K1027 N1028 | E1024-K1027 PolarHBondContact O-N 2.91Å; E1024-K1027 IonicContact OE1-NZ 3.52Å; E1024-K1027 PolarHBondContact OE1-NZ 2.85Å; E1024-K1027 IonicContact OE2-NZ 2.62Å; E1024-K1027 PolarHBondContact OE2-NZ 3.3Å; E1024-N1028 WeakPolarHBondContact O-CB 3.48Å; E1024-N1028 PolarHBondContact O-N 2.82Å; E1024-N1028 PolarHBondContact O-ND2 3.11Å |
| 1025 | A | 84.5 | Confident | 84.5 | Confident | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.008 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -67.1 | -37.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L1016 G1021 G1022 S1023 L1029 | L1016-A1025 HydrophobicContact CD2-CB 4.41Å; L1016-A1025 VanDerWaalsContact O-CB 3.24Å; L1016-A1025 WeakPolarHBondContact O-CB 3.24Å; G1021-A1025 VanDerWaalsContact C-CB 3.45Å; G1021-A1025 VanDerWaalsContact N-CB 3.33Å; G1021-A1025 WeakPolarHBondContact O-CB 3.47Å; G1021-A1025 PolarHBondContact O-N 3.17Å; G1022-A1025 PolarHBondContact O-N 3.02Å; S1023-A1025 VanDerWaalsContact C-N 3.33Å; S1023-A1025 PolarHBondContact O-N 3.34Å; A1025-L1029 WeakPolarHBondContact O-CB 3.4Å; A1025-L1029 PolarHBondContact O-N 2.89Å |
| 1026 | L | 87.1 | Confident | 84.1 | Confident | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -68.1 | -41.6 | 173.6 | 176 | 64.8 | 0 | 0 | 0 | 111 | L1016 G1022 S1023 L1029 L1030 L1043 V1062 F1072 A1075 | L1016-L1026 HydrophobicContact CD2-CB 3.86Å; L1016-L1026 HydrophobicContact CD2-CD1 4.14Å; G1022-L1026 PolarHBondContact O-N 2.84Å; S1023-L1026 PolarHBondContact O-N 3.47Å; L1026-L1029 WeakPolarHBondContact O-CB 3.26Å; L1026-L1029 PolarHBondContact O-N 3.49Å; L1026-L1030 HydrophobicContact CD1-CD1 4.22Å; L1026-L1030 HydrophobicContact CD1-CG 4.28Å; L1026-L1030 HydrophobicContact CG-CD1 3.94Å; L1026-L1030 HydrophobicContact CG-CG 4.44Å; L1026-L1030 WeakPolarHBondContact O-CB 2.94Å; L1026-L1030 VanDerWaalsContact O-CG 3.27Å; L1026-L1030 WeakPolarHBondContact O-CG 3.45Å; L1026-L1030 PolarHBondContact O-N 3.12Å; L1026-L1043 HydrophobicContact CD1-CD2 4.13Å; L1026-V1062 HydrophobicContact CB-CG1 4.37Å; L1026-V1062 HydrophobicContact CD2-CG1 4.15Å; L1026-F1072 HydrophobicContact CD1-CE2 4.17Å; L1026-F1072 HydrophobicContact CD2-CB 4.41Å; L1026-F1072 HydrophobicContact CD2-CD2 3.27Å; L1026-F1072 HydrophobicContact CD2-CE2 3.6Å; L1026-F1072 HydrophobicContact CD2-CG 4Å; L1026-A1075 HydrophobicContact CB-CB 3.97Å; L1026-A1075 HydrophobicContact CD2-CB 3.58Å; L1026-A1075 HydrophobicContact CG-CB 3.67Å |
| 1027 | K | 86.9 | Confident | 84 | Confident | 63 Ų | 63 | 35.9 Ų | 35.9 | 27% | 0.274 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -60.4 | -48.4 | 174 | 177.7 | -171.7 | 151.2 | -152.1 | 0 | 111 | S1023 E1024 L1029 L1030 E1031 A1075 | S1023-K1027 WeakPolarHBondContact O-CB 3.43Å; S1023-K1027 PolarHBondContact O-N 3.26Å; E1024-K1027 PolarHBondContact O-N 2.91Å; E1024-K1027 IonicContact OE1-NZ 3.52Å; E1024-K1027 PolarHBondContact OE1-NZ 2.85Å; E1024-K1027 IonicContact OE2-NZ 2.62Å; E1024-K1027 PolarHBondContact OE2-NZ 3.3Å; K1027-L1029 VanDerWaalsContact C-N 3.29Å; K1027-L1029 PolarHBondContact O-N 2.68Å; K1027-L1030 PolarHBondContact O-N 3.07Å; K1027-L1030 VanDerWaalsContact O-N 3.11Å; K1027-E1031 WeakPolarHBondContact CE-OE1 3.45Å; K1027-E1031 HydrophobicContact CG-CG 4.44Å; K1027-E1031 WeakPolarHBondContact CG-OE1 3.32Å; K1027-E1031 WeakPolarHBondContact O-CB 3.29Å; K1027-E1031 WeakPolarHBondContact O-CG 3.49Å; K1027-E1031 PolarHBondContact O-N 3.39Å; K1027-A1075 HydrophobicContact CB-CB 4.1Å |
| 1028 | N | 86.5 | Confident | 84 | Confident | 28 Ų | 28 | 37.5 Ų | 37.5 | 15% | 0.15 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -57.3 | -41.8 | 175.5 | -72.5 | -25.9 | 0 | 0 | 0 | 112 | V980 E1024 S1032 | V980-N1028 HydrophobicContact CG2-CB 4.01Å; V980-N1028 WeakPolarHBondContact CG2-OD1 3.33Å; E1024-N1028 WeakPolarHBondContact O-CB 3.48Å; E1024-N1028 PolarHBondContact O-N 2.82Å; E1024-N1028 PolarHBondContact O-ND2 3.11Å; N1028-S1032 WeakPolarHBondContact O-CB 3.29Å; N1028-S1032 PolarHBondContact O-N 3.01Å; N1028-S1032 VanDerWaalsContact O-N 3.1Å; N1028-S1032 PolarHBondContact O-OG 3.27Å |
| 1029 | L | 89.7 | Confident | 84 | Confident | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.2 | -50 | 173.4 | 175.9 | 62.1 | 0 | 0 | 0 | 111.3 | L983 L997 L1012 I1015 L1016 A1025 L1026 K1027 S1032 I1033 L1043 | L983-L1029 HydrophobicContact CD2-CB 4.24Å; L983-L1029 HydrophobicContact CD2-CD1 3.63Å; L997-L1029 HydrophobicContact CD1-CD1 3.94Å; L1012-L1029 HydrophobicContact CD1-CD2 3.87Å; I1015-L1029 HydrophobicContact CG2-CD1 4.37Å; I1015-L1029 HydrophobicContact CG2-CD2 4.47Å; L1016-L1029 HydrophobicContact CD2-CD2 4.13Å; A1025-L1029 WeakPolarHBondContact O-CB 3.4Å; A1025-L1029 PolarHBondContact O-N 2.89Å; L1026-L1029 WeakPolarHBondContact O-CB 3.26Å; L1026-L1029 PolarHBondContact O-N 3.49Å; K1027-L1029 VanDerWaalsContact C-N 3.29Å; K1027-L1029 PolarHBondContact O-N 2.68Å; L1029-S1032 PolarHBondContact O-N 3.23Å; L1029-S1032 PolarHBondContact O-OG 3.29Å; L1029-I1033 WeakPolarHBondContact O-CG1 3.45Å; L1029-I1033 PolarHBondContact O-N 3.46Å; L1029-L1043 HydrophobicContact CD2-CD1 4.29Å |
| 1030 | L | 89.5 | Confident | 84.1 | Confident | 2 Ų | 2 | 36 Ų | 36 | 1% | 0.01 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.3 | -44.5 | -180 | -72.6 | 167.6 | 0 | 0 | 0 | 112.4 | L1026 K1027 S1032 I1033 G1034 G1035 L1040 L1043 A1075 V1076 | L1026-L1030 HydrophobicContact CD1-CD1 4.22Å; L1026-L1030 HydrophobicContact CD1-CG 4.28Å; L1026-L1030 HydrophobicContact CG-CD1 3.94Å; L1026-L1030 HydrophobicContact CG-CG 4.44Å; L1026-L1030 WeakPolarHBondContact O-CB 2.94Å; L1026-L1030 VanDerWaalsContact O-CG 3.27Å; L1026-L1030 WeakPolarHBondContact O-CG 3.45Å; L1026-L1030 PolarHBondContact O-N 3.12Å; K1027-L1030 PolarHBondContact O-N 3.07Å; K1027-L1030 VanDerWaalsContact O-N 3.11Å; L1030-S1032 VanDerWaalsContact C-N 3.32Å; L1030-S1032 PolarHBondContact O-N 2.86Å; L1030-I1033 CarbonylContact O-C 3.45Å; L1030-I1033 VanDerWaalsContact O-CG1 3.31Å; L1030-I1033 WeakPolarHBondContact O-CG1 3.48Å; L1030-I1033 PolarHBondContact O-N 3.23Å; L1030-I1033 VanDerWaalsContact O-N 3.16Å; L1030-G1034 PolarHBondContact O-N 3.1Å; L1030-G1035 WeakPolarHBondContact O-CA 3.39Å; L1030-G1035 PolarHBondContact O-N 3.46Å; L1030-L1040 HydrophobicContact CD1-CD1 3.9Å; L1030-L1040 HydrophobicContact CD2-CB 3.96Å; L1030-L1040 HydrophobicContact CD2-CD1 3.64Å; L1030-L1040 HydrophobicContact CD2-CG 4.09Å; L1030-L1040 HydrophobicContact CG-CD1 4.43Å; L1030-L1043 HydrophobicContact CD2-CB 4.49Å; L1030-L1043 HydrophobicContact CD2-CD2 3.79Å; L1030-A1075 HydrophobicContact CD1-CB 4.09Å; L1030-V1076 HydrophobicContact CD1-CG1 3.8Å |
| 1031 | E | 88.1 | Confident | 84.7 | Confident | 93 Ų | 93 | 36.9 Ų | 36.9 | 44% | 0.435 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -60.6 | -40.4 | 175.5 | -72.9 | 178.4 | -172.2 | 0 | 0 | 111.5 | V980 K1027 I1033 G1034 | V980-E1031 HydrophobicContact CG1-CB 3.93Å; V980-E1031 HydrophobicContact CG2-CB 4.5Å; K1027-E1031 WeakPolarHBondContact CE-OE1 3.45Å; K1027-E1031 HydrophobicContact CG-CG 4.44Å; K1027-E1031 WeakPolarHBondContact CG-OE1 3.32Å; K1027-E1031 WeakPolarHBondContact O-CB 3.29Å; K1027-E1031 WeakPolarHBondContact O-CG 3.49Å; K1027-E1031 PolarHBondContact O-N 3.39Å; E1031-I1033 PolarHBondContact O-N 3.14Å; E1031-I1033 VanDerWaalsContact O-N 3.14Å; E1031-G1034 PolarHBondContact O-N 2.82Å |
| 1032 | S | 88.7 | Confident | 85.4 | Confident | 12 Ų | 12 | 36.9 Ų | 36.9 | 8% | 0.084 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -66.4 | -12.4 | 176.9 | 75.2 | 0 | 0 | 0 | 0 | 115 | L987 N1028 L1029 L1030 | L987-S1032 WeakPolarHBondContact CD1-OG 3.39Å; N1028-S1032 WeakPolarHBondContact O-CB 3.29Å; N1028-S1032 PolarHBondContact O-N 3.01Å; N1028-S1032 VanDerWaalsContact O-N 3.1Å; N1028-S1032 PolarHBondContact O-OG 3.27Å; L1029-S1032 PolarHBondContact O-N 3.23Å; L1029-S1032 PolarHBondContact O-OG 3.29Å; L1030-S1032 VanDerWaalsContact C-N 3.32Å; L1030-S1032 PolarHBondContact O-N 2.86Å |
| 1033 | I | 88.6 | Confident | 86.2 | Confident | 16 Ų | 16 | 34.8 Ų | 34.8 | 8% | 0.082 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -121 | 15.7 | 178.6 | 63.6 | -171.9 | 0 | 0 | 0 | 113.7 | L987 L997 L1029 L1030 E1031 G1039 T1042 L1043 | L987-I1033 HydrophobicContact CD1-CG2 3.67Å; L997-I1033 HydrophobicContact CD2-CD1 3.71Å; L997-I1033 HydrophobicContact CD2-CG2 4.42Å; L1029-I1033 WeakPolarHBondContact O-CG1 3.45Å; L1029-I1033 PolarHBondContact O-N 3.46Å; L1030-I1033 CarbonylContact O-C 3.45Å; L1030-I1033 VanDerWaalsContact O-CG1 3.31Å; L1030-I1033 WeakPolarHBondContact O-CG1 3.48Å; L1030-I1033 PolarHBondContact O-N 3.23Å; L1030-I1033 VanDerWaalsContact O-N 3.16Å; E1031-I1033 PolarHBondContact O-N 3.14Å; E1031-I1033 VanDerWaalsContact O-N 3.14Å; I1033-G1039 VanDerWaalsContact CD1-O 3.29Å; I1033-G1039 WeakPolarHBondContact CD1-O 3.49Å; I1033-G1039 WeakPolarHBondContact O-CA 3.38Å; I1033-T1042 HydrophobicContact CB-CG2 4.09Å; I1033-L1043 HydrophobicContact CD1-CB 3.87Å |
| 1034 | G | 85 | Confident | 86.7 | Confident | 57 Ų | 57 | 33.9 Ų | 33.9 | 59% | 0.588 | 19% | 0.194 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 123.2 | -16.2 | 170.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | L1030 E1031 | L1030-G1034 PolarHBondContact O-N 3.1Å; E1031-G1034 PolarHBondContact O-N 2.82Å |
| 1035 | G | 82.5 | Confident | 87 | Confident | 19 Ų | 19 | 35.7 Ų | 35.7 | 20% | 0.196 | 20% | 0.202 | C | C | . | . | S | Bend | trans | 75.1 | 163.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | L1030 A1037 E1038 G1039 | L1030-G1035 WeakPolarHBondContact O-CA 3.39Å; L1030-G1035 PolarHBondContact O-N 3.46Å; G1035-A1037 PolarHBondContact O-N 3.18Å; G1035-E1038 PolarHBondContact O-N 2.71Å; G1035-G1039 PolarHBondContact O-N 2.84Å |
| 1036 | G | 83.7 | Confident | 87.1 | Confident | 26 Ų | 26 | 36 Ų | 36 | 27% | 0.268 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | 50.9 | -131.5 | 175 | 0 | 0 | 0 | 0 | 0 | 114 | L1040 | G1036-L1040 PolarHBondContact O-N 3.17Å |
| 1037 | A | 84.6 | Confident | 87 | Confident | 21 Ų | 21 | 37.6 Ų | 37.6 | 17% | 0.174 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -72.3 | -36.8 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | G1035 L1040 Q1041 N1085 K1088 | G1035-A1037 PolarHBondContact O-N 3.18Å; A1037-L1040 PolarHBondContact O-N 3.38Å; A1037-Q1041 VanDerWaalsContact O-CB 3.3Å; A1037-Q1041 WeakPolarHBondContact O-CB 3.3Å; A1037-Q1041 PolarHBondContact O-N 3.15Å; A1037-N1085 HydrophobicContact CB-CB 4.19Å; A1037-N1085 WeakPolarHBondContact CB-O 3.43Å; A1037-K1088 HydrophobicContact CB-CB 4.08Å |
| 1038 | E | 85.3 | Confident | 86.6 | Confident | 146 Ų | 146 | 36.2 Ų | 36.2 | 68% | 0.682 | 22% | 0.217 | S | C | * | . | H | α-helix | trans | -71.5 | -42.1 | -178.6 | -66.9 | -173.2 | 162.5 | 0 | 0 | 111.2 | G1035 L1040 Q1041 T1042 | G1035-E1038 PolarHBondContact O-N 2.71Å; E1038-L1040 VanDerWaalsContact C-N 3.34Å; E1038-L1040 PolarHBondContact O-N 2.89Å; E1038-Q1041 PolarHBondContact O-N 3.4Å; E1038-T1042 WeakPolarHBondContact O-CB 3.34Å; E1038-T1042 PolarHBondContact O-N 3.42Å; E1038-T1042 PolarHBondContact O-OG1 3.5Å |
| 1039 | G | 87.7 | Confident | 86.3 | Confident | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.7 | -40.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | I1033 G1035 T1042 L1043 | I1033-G1039 VanDerWaalsContact CD1-O 3.29Å; I1033-G1039 WeakPolarHBondContact CD1-O 3.49Å; I1033-G1039 WeakPolarHBondContact O-CA 3.38Å; G1035-G1039 PolarHBondContact O-N 2.84Å; G1039-T1042 WeakPolarHBondContact O-CB 3.36Å; G1039-T1042 PolarHBondContact O-N 3.22Å; G1039-L1043 WeakPolarHBondContact O-CB 3.13Å; G1039-L1043 PolarHBondContact O-N 3.1Å |
| 1040 | L | 87.8 | Confident | 85.9 | Confident | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -72 | -35.8 | 177.7 | -150 | 113.5 | 0 | 0 | 0 | 113 | L1030 G1036 A1037 E1038 T1042 L1043 L1044 F1072 V1076 S1089 | L1030-L1040 HydrophobicContact CD1-CD1 3.9Å; L1030-L1040 HydrophobicContact CD2-CB 3.96Å; L1030-L1040 HydrophobicContact CD2-CD1 3.64Å; L1030-L1040 HydrophobicContact CD2-CG 4.09Å; L1030-L1040 HydrophobicContact CG-CD1 4.43Å; G1036-L1040 PolarHBondContact O-N 3.17Å; A1037-L1040 PolarHBondContact O-N 3.38Å; E1038-L1040 VanDerWaalsContact C-N 3.34Å; E1038-L1040 PolarHBondContact O-N 2.89Å; L1040-T1042 VanDerWaalsContact C-N 3.29Å; L1040-T1042 PolarHBondContact O-N 3.16Å; L1040-L1043 WeakPolarHBondContact O-CB 3.4Å; L1040-L1043 PolarHBondContact O-N 3.4Å; L1040-L1044 HydrophobicContact CD2-CD1 3.93Å; L1040-L1044 HydrophobicContact CD2-CG 4.3Å; L1040-L1044 WeakPolarHBondContact O-CG 3.35Å; L1040-L1044 PolarHBondContact O-N 3.47Å; L1040-F1072 HydrophobicContact CD1-CD1 4.27Å; L1040-F1072 HydrophobicContact CD1-CE1 3.33Å; L1040-F1072 HydrophobicContact CD1-CE2 4.43Å; L1040-F1072 HydrophobicContact CD1-CZ 3.43Å; L1040-F1072 VanDerWaalsContact CD1-CZ 3.43Å; L1040-F1072 HydrophobicContact CD2-CE1 3.79Å; L1040-F1072 HydrophobicContact CD2-CZ 4.15Å; L1040-F1072 HydrophobicContact CG-CE1 4.11Å; L1040-F1072 HydrophobicContact CG-CZ 4.15Å; L1040-V1076 HydrophobicContact CB-CG1 4.36Å; L1040-V1076 HydrophobicContact CD1-CG1 3.36Å; L1040-V1076 HydrophobicContact CG-CG1 4.4Å; L1040-S1089 WeakPolarHBondContact CD2-OG 3.25Å |
| 1041 | Q | 88 | Confident | 85.5 | Confident | 88 Ų | 88 | 44.7 Ų | 44.7 | 41% | 0.411 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -66 | -35.1 | 173.9 | -171.2 | 161.8 | 86.9 | 0 | 0 | 111.5 | A1037 E1038 L1044 Q1045 S1089 | A1037-Q1041 VanDerWaalsContact O-CB 3.3Å; A1037-Q1041 WeakPolarHBondContact O-CB 3.3Å; A1037-Q1041 PolarHBondContact O-N 3.15Å; E1038-Q1041 PolarHBondContact O-N 3.4Å; Q1041-L1044 PolarHBondContact O-N 2.96Å; Q1041-Q1045 PolarHBondContact O-N 3.35Å; Q1041-S1089 PolarHBondContact NE2-O 3.32Å |
| 1042 | T | 89 | Confident | 85.2 | Confident | 29 Ų | 29 | 40.7 Ų | 40.7 | 18% | 0.178 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.7 | -41.7 | 171.5 | -58.4 | 0 | 0 | 0 | 0 | 111.9 | A994 I1033 E1038 G1039 L1040 Q1045 A1046 | A994-T1042 HydrophobicContact CB-CG2 3.92Å; A994-T1042 VanDerWaalsContact N-CG2 3.29Å; I1033-T1042 HydrophobicContact CB-CG2 4.09Å; E1038-T1042 WeakPolarHBondContact O-CB 3.34Å; E1038-T1042 PolarHBondContact O-N 3.42Å; E1038-T1042 PolarHBondContact O-OG1 3.5Å; G1039-T1042 WeakPolarHBondContact O-CB 3.36Å; G1039-T1042 PolarHBondContact O-N 3.22Å; L1040-T1042 VanDerWaalsContact C-N 3.29Å; L1040-T1042 PolarHBondContact O-N 3.16Å; T1042-Q1045 PolarHBondContact O-N 3.4Å; T1042-A1046 WeakPolarHBondContact O-CB 3.46Å; T1042-A1046 PolarHBondContact O-N 3.25Å |
| 1043 | L | 89.8 | Confident | 84.9 | Confident | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -64 | -44 | 174.4 | -179.7 | 55.3 | 0 | 0 | 0 | 112.3 | L997 L1012 L1026 L1029 L1030 I1033 G1039 L1040 A1046 L1047 L1058 | L997-L1043 HydrophobicContact CD2-CB 4.38Å; L997-L1043 HydrophobicContact CD2-CD1 3.73Å; L1012-L1043 HydrophobicContact CD1-CD1 4.34Å; L1026-L1043 HydrophobicContact CD1-CD2 4.13Å; L1029-L1043 HydrophobicContact CD2-CD1 4.29Å; L1030-L1043 HydrophobicContact CD2-CB 4.49Å; L1030-L1043 HydrophobicContact CD2-CD2 3.79Å; I1033-L1043 HydrophobicContact CD1-CB 3.87Å; G1039-L1043 WeakPolarHBondContact O-CB 3.13Å; G1039-L1043 PolarHBondContact O-N 3.1Å; L1040-L1043 WeakPolarHBondContact O-CB 3.4Å; L1040-L1043 PolarHBondContact O-N 3.4Å; L1043-A1046 PolarHBondContact O-N 2.9Å; L1043-L1047 HydrophobicContact CD1-CD1 4.39Å; L1043-L1047 WeakPolarHBondContact O-CG 3.29Å; L1043-L1047 PolarHBondContact O-N 3.26Å; L1043-L1058 HydrophobicContact CD1-CD2 4.13Å; L1043-L1058 HydrophobicContact CD2-CD1 4.45Å; L1043-L1058 HydrophobicContact CD2-CD2 3.49Å; L1043-L1058 VanDerWaalsContact CD2-CD2 3.49Å; L1043-L1058 HydrophobicContact CG-CD1 4.23Å; L1043-L1058 HydrophobicContact CG-CD2 3.77Å |
| 1044 | L | 87.6 | Confident | 84.7 | Confident | 13 Ų | 13 | 45.8 Ų | 45.8 | 7% | 0.068 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64 | -40.2 | 174.9 | -70.6 | 169.6 | 0 | 0 | 0 | 111.9 | L1040 Q1041 G1048 A1054 L1055 L1058 L1090 | L1040-L1044 HydrophobicContact CD2-CD1 3.93Å; L1040-L1044 HydrophobicContact CD2-CG 4.3Å; L1040-L1044 WeakPolarHBondContact O-CG 3.35Å; L1040-L1044 PolarHBondContact O-N 3.47Å; Q1041-L1044 PolarHBondContact O-N 2.96Å; L1044-G1048 PolarHBondContact O-N 3.39Å; L1044-A1054 HydrophobicContact CD2-CB 3.69Å; L1044-L1055 HydrophobicContact CD2-CB 4.3Å; L1044-L1058 HydrophobicContact CD2-CD1 3.65Å; L1044-L1058 HydrophobicContact CG-CD1 4.41Å; L1044-L1090 HydrophobicContact CD1-CD2 4.24Å |
| 1045 | Q | 86.3 | Confident | 84.8 | Confident | 136 Ų | 136 | 43.1 Ų | 43.1 | 64% | 0.636 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -64.7 | -37.9 | 173.6 | -81.7 | -169.1 | -4.4 | 0 | 0 | 113.3 | A994 Q1041 T1042 G1048 | A994-Q1045 HydrophobicContact CB-CB 3.97Å; Q1041-Q1045 PolarHBondContact O-N 3.35Å; T1042-Q1045 PolarHBondContact O-N 3.4Å; Q1045-G1048 PolarHBondContact O-N 3.21Å |
| 1046 | A | 87.5 | Confident | 84.9 | Confident | 8 Ų | 8 | 44 Ų | 44 | 7% | 0.066 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -67.5 | -36.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113 | A994 L997 K998 L1001 T1042 L1043 | A994-A1046 HydrophobicContact CB-CB 4.42Å; A994-A1046 WeakPolarHBondContact O-CB 3.49Å; L997-A1046 HydrophobicContact CB-CB 3.9Å; L997-A1046 HydrophobicContact CD2-CB 3.7Å; L997-A1046 HydrophobicContact CG-CB 3.73Å; K998-A1046 HydrophobicContact CB-CB 4.29Å; L1001-A1046 HydrophobicContact CD1-CB 4.46Å; T1042-A1046 WeakPolarHBondContact O-CB 3.46Å; T1042-A1046 PolarHBondContact O-N 3.25Å; L1043-A1046 PolarHBondContact O-N 2.9Å |
| 1047 | L | 84.8 | Confident | 84.7 | Confident | 33 Ų | 33 | 44.2 Ų | 44.2 | 17% | 0.173 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -74.2 | -39.7 | 173.2 | -66.9 | 165.2 | 0 | 0 | 0 | 111.7 | L1001 P1008 L1012 L1043 A1054 L1058 | L1001-L1047 HydrophobicContact CD1-CD2 3.9Å; L1001-L1047 HydrophobicContact CD1-CG 4.46Å; P1008-L1047 HydrophobicContact CB-CD2 3.99Å; L1012-L1047 HydrophobicContact CD2-CD1 4.42Å; L1012-L1047 HydrophobicContact CD2-CD2 4.48Å; L1043-L1047 HydrophobicContact CD1-CD1 4.39Å; L1043-L1047 WeakPolarHBondContact O-CG 3.29Å; L1043-L1047 PolarHBondContact O-N 3.26Å; L1047-A1054 HydrophobicContact CB-CB 4.32Å; L1047-L1058 HydrophobicContact CD1-CD1 3.56Å; L1047-L1058 HydrophobicContact CD1-CD2 4.08Å; L1047-L1058 HydrophobicContact CD1-CG 3.56Å |
| 1048 | G | 78.7 | Confident | 84.7 | Confident | 34 Ų | 34 | 43.2 Ų | 43.2 | 35% | 0.351 | 26% | 0.257 | S | S | . | . | trans | 73.2 | -177.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | L1044 Q1045 | L1044-G1048 PolarHBondContact O-N 3.39Å; Q1045-G1048 PolarHBondContact O-N 3.21Å | ||
| 1049 | G | 79.3 | Confident | 84.6 | Confident | 81 Ų | 81 | 36.6 Ų | 36.6 | 84% | 0.835 | 23% | 0.226 | S | C | * | . | S | Bend | trans | 82.6 | -148.3 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 1050 | D | 82.4 | Confident | 84.3 | Confident | 72 Ų | 72 | 39.5 Ų | 39.5 | 39% | 0.385 | 25% | 0.25 | S | C | . | . | trans | -78.7 | 125.4 | 175.4 | 162.5 | 23.6 | 0 | 0 | 0 | 110 | A1052 Q1053 A1054 | D1050-A1052 PolarHBondContact O-N 2.97Å; D1050-A1052 VanDerWaalsContact O-N 3.12Å; D1050-A1052 PolarHBondContact OD1-N 2.91Å; D1050-Q1053 HydrophobicContact CB-CB 4.26Å; D1050-Q1053 HydrophobicContact CB-CG 4.34Å; D1050-Q1053 PolarHBondContact O-N 3.15Å; D1050-Q1053 WeakPolarHBondContact OD2-CG 3.45Å; D1050-Q1053 PolarHBondContact OD2-NE2 3.2Å; D1050-A1054 PolarHBondContact O-N 3.2Å | ||
| 1051 | P | 80.8 | Confident | 83.8 | Confident | 55 Ų | 55 | 40.5 Ų | 40.5 | 36% | 0.357 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -52.2 | -33.4 | 179.1 | -28.4 | 35.6 | 0 | 0 | 0 | 114.4 | L1055 L1090 | P1051-L1055 WeakPolarHBondContact O-CB 3.36Å; P1051-L1055 PolarHBondContact O-N 3.34Å; P1051-L1090 HydrophobicContact CB-CD2 3.78Å |
| 1052 | A | 80.4 | Confident | 83.4 | Confident | 9 Ų | 9 | 37.1 Ų | 37.1 | 7% | 0.074 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -69.3 | -38.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | D1050 A1056 A1100 A1104 | D1050-A1052 PolarHBondContact O-N 2.97Å; D1050-A1052 VanDerWaalsContact O-N 3.12Å; D1050-A1052 PolarHBondContact OD1-N 2.91Å; A1052-A1056 WeakPolarHBondContact O-CB 3.47Å; A1052-A1056 PolarHBondContact O-N 3.04Å; A1052-A1100 HydrophobicContact CB-CB 4.06Å; A1052-A1104 WeakPolarHBondContact O-CB 3.49Å |
| 1053 | Q | 82.6 | Confident | 82.7 | Confident | 129 Ų | 129 | 38.6 Ų | 38.6 | 60% | 0.603 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -75.8 | -36.9 | 176.5 | -72.6 | 173 | 51.5 | 0 | 0 | 112.7 | D1050 A1056 S1057 | D1050-Q1053 HydrophobicContact CB-CB 4.26Å; D1050-Q1053 HydrophobicContact CB-CG 4.34Å; D1050-Q1053 PolarHBondContact O-N 3.15Å; D1050-Q1053 WeakPolarHBondContact OD2-CG 3.45Å; D1050-Q1053 PolarHBondContact OD2-NE2 3.2Å; Q1053-A1056 PolarHBondContact O-N 3.2Å; Q1053-S1057 WeakPolarHBondContact O-CB 3.39Å; Q1053-S1057 PolarHBondContact O-N 3.19Å; Q1053-S1057 PolarHBondContact O-OG 2.87Å |
| 1054 | A | 85.1 | Confident | 82.1 | Confident | 6 Ų | 6 | 39.6 Ų | 39.6 | 5% | 0.05 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.1 | -45.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | L1044 L1047 D1050 S1057 L1058 | L1044-A1054 HydrophobicContact CD2-CB 3.69Å; L1047-A1054 HydrophobicContact CB-CB 4.32Å; D1050-A1054 PolarHBondContact O-N 3.2Å; A1054-S1057 WeakPolarHBondContact O-CB 3.16Å; A1054-S1057 PolarHBondContact O-N 2.94Å; A1054-L1058 WeakPolarHBondContact O-CB 3.47Å; A1054-L1058 WeakPolarHBondContact O-CD1 3.31Å; A1054-L1058 WeakPolarHBondContact O-CG 3.46Å; A1054-L1058 PolarHBondContact O-N 2.84Å |
| 1055 | L | 87.2 | Confident | 81.7 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 174.9 | -178.4 | 63.9 | 0 | 0 | 0 | 112.4 | L1044 P1051 S1057 L1058 I1059 F1072 L1086 L1090 L1101 A1104 | L1044-L1055 HydrophobicContact CD2-CB 4.3Å; P1051-L1055 WeakPolarHBondContact O-CB 3.36Å; P1051-L1055 PolarHBondContact O-N 3.34Å; L1055-S1057 VanDerWaalsContact C-N 3.25Å; L1055-S1057 PolarHBondContact O-N 2.66Å; L1055-L1058 WeakPolarHBondContact O-CB 3.36Å; L1055-L1058 PolarHBondContact O-N 3.26Å; L1055-I1059 HydrophobicContact CD1-CD1 4.17Å; L1055-I1059 HydrophobicContact CD1-CG1 4.29Å; L1055-I1059 HydrophobicContact CD2-CD1 4.48Å; L1055-I1059 HydrophobicContact CG-CD1 3.79Å; L1055-I1059 HydrophobicContact CG-CG1 4.4Å; L1055-I1059 WeakPolarHBondContact O-CD1 3.26Å; L1055-I1059 WeakPolarHBondContact O-CG1 3.48Å; L1055-I1059 PolarHBondContact O-N 3.21Å; L1055-F1072 HydrophobicContact CD1-CD1 4.01Å; L1055-F1072 HydrophobicContact CD1-CE1 3.42Å; L1055-F1072 VanDerWaalsContact CD1-CE1 3.42Å; L1055-F1072 HydrophobicContact CD1-CZ 3.88Å; L1055-L1086 HydrophobicContact CD1-CD2 4.17Å; L1055-L1086 HydrophobicContact CD2-CD2 3.73Å; L1055-L1090 HydrophobicContact CB-CD2 4.46Å; L1055-L1090 HydrophobicContact CD2-CD1 4.04Å; L1055-L1090 HydrophobicContact CD2-CD2 4.05Å; L1055-L1090 HydrophobicContact CD2-CG 4.48Å; L1055-L1101 HydrophobicContact CD2-CD1 3.89Å; L1055-A1104 HydrophobicContact CB-CB 4Å; L1055-A1104 HydrophobicContact CD2-CB 3.69Å; L1055-A1104 HydrophobicContact CG-CB 3.77Å |
| 1056 | A | 84 | Confident | 81.5 | Confident | 37 Ų | 37 | 38.2 Ų | 38.2 | 31% | 0.306 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -58.5 | -39.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | A1052 Q1053 A1060 A1104 | A1052-A1056 WeakPolarHBondContact O-CB 3.47Å; A1052-A1056 PolarHBondContact O-N 3.04Å; Q1053-A1056 PolarHBondContact O-N 3.2Å; A1056-A1060 WeakPolarHBondContact O-CB 3.41Å; A1056-A1060 PolarHBondContact O-N 2.96Å; A1056-A1104 HydrophobicContact CB-CB 4.17Å |
| 1057 | S | 80.8 | Confident | 81.3 | Confident | 32 Ų | 32 | 44.5 Ų | 44.5 | 22% | 0.224 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -68.6 | -40.7 | 176.8 | -63.8 | 0 | 0 | 0 | 0 | 112.6 | N1009 Q1053 A1054 L1055 A1060 S1061 | N1009-S1057 WeakPolarHBondContact ND2-CB 3.25Å; N1009-S1057 PolarHBondContact ND2-OG 3.41Å; N1009-S1057 WeakPolarHBondContact OD1-CB 3.39Å; Q1053-S1057 WeakPolarHBondContact O-CB 3.39Å; Q1053-S1057 PolarHBondContact O-N 3.19Å; Q1053-S1057 PolarHBondContact O-OG 2.87Å; A1054-S1057 WeakPolarHBondContact O-CB 3.16Å; A1054-S1057 PolarHBondContact O-N 2.94Å; L1055-S1057 VanDerWaalsContact C-N 3.25Å; L1055-S1057 PolarHBondContact O-N 2.66Å; S1057-A1060 PolarHBondContact O-N 3.41Å; S1057-S1061 PolarHBondContact O-N 3.01Å |
| 1058 | L | 83.7 | Confident | 81.3 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -57.4 | -52.8 | 170.7 | -87.8 | 153.4 | 0 | 0 | 0 | 111.5 | L1012 L1043 L1044 L1047 A1054 L1055 A1060 S1061 V1062 F1072 | L1012-L1058 HydrophobicContact CD2-CD2 3.59Å; L1012-L1058 HydrophobicContact CD2-CG 4.14Å; L1043-L1058 HydrophobicContact CD1-CD2 4.13Å; L1043-L1058 HydrophobicContact CD2-CD1 4.45Å; L1043-L1058 HydrophobicContact CD2-CD2 3.49Å; L1043-L1058 VanDerWaalsContact CD2-CD2 3.49Å; L1043-L1058 HydrophobicContact CG-CD1 4.23Å; L1043-L1058 HydrophobicContact CG-CD2 3.77Å; L1044-L1058 HydrophobicContact CD2-CD1 3.65Å; L1044-L1058 HydrophobicContact CG-CD1 4.41Å; L1047-L1058 HydrophobicContact CD1-CD1 3.56Å; L1047-L1058 HydrophobicContact CD1-CD2 4.08Å; L1047-L1058 HydrophobicContact CD1-CG 3.56Å; A1054-L1058 WeakPolarHBondContact O-CB 3.47Å; A1054-L1058 WeakPolarHBondContact O-CD1 3.31Å; A1054-L1058 WeakPolarHBondContact O-CG 3.46Å; A1054-L1058 PolarHBondContact O-N 2.84Å; L1055-L1058 WeakPolarHBondContact O-CB 3.36Å; L1055-L1058 PolarHBondContact O-N 3.26Å; L1058-A1060 VanDerWaalsContact C-N 3.28Å; L1058-A1060 PolarHBondContact O-N 3.49Å; L1058-S1061 WeakPolarHBondContact O-CB 3.49Å; L1058-S1061 PolarHBondContact O-N 2.95Å; L1058-S1061 PolarHBondContact O-OG 3.37Å; L1058-V1062 PolarHBondContact O-N 2.96Å; L1058-F1072 HydrophobicContact CB-CE2 3.66Å; L1058-F1072 HydrophobicContact CB-CZ 3.9Å; L1058-F1072 HydrophobicContact CD1-CE2 4.47Å; L1058-F1072 HydrophobicContact CD1-CZ 4Å; L1058-F1072 HydrophobicContact CD2-CE2 3.69Å; L1058-F1072 HydrophobicContact CD2-CZ 3.97Å; L1058-F1072 HydrophobicContact CG-CE2 4.15Å; L1058-F1072 HydrophobicContact CG-CZ 4.19Å |
| 1059 | I | 83.6 | Confident | 81.8 | Confident | 7 Ų | 7 | 41.4 Ų | 41.4 | 4% | 0.036 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -56.8 | -43.1 | 178.8 | -65.9 | 159 | 0 | 0 | 0 | 110.7 | L1055 S1061 V1062 G1064 L1069 A1104 | L1055-I1059 HydrophobicContact CD1-CD1 4.17Å; L1055-I1059 HydrophobicContact CD1-CG1 4.29Å; L1055-I1059 HydrophobicContact CD2-CD1 4.48Å; L1055-I1059 HydrophobicContact CG-CD1 3.79Å; L1055-I1059 HydrophobicContact CG-CG1 4.4Å; L1055-I1059 WeakPolarHBondContact O-CD1 3.26Å; L1055-I1059 WeakPolarHBondContact O-CG1 3.48Å; L1055-I1059 PolarHBondContact O-N 3.21Å; I1059-S1061 VanDerWaalsContact C-N 3.34Å; I1059-S1061 PolarHBondContact O-N 3.19Å; I1059-V1062 PolarHBondContact O-N 3.2Å; I1059-G1064 WeakPolarHBondContact O-CA 3.33Å; I1059-G1064 PolarHBondContact O-N 3.44Å; I1059-L1069 HydrophobicContact CD1-CD1 3.29Å; I1059-L1069 HydrophobicContact CG1-CD1 3.74Å; I1059-L1069 HydrophobicContact CG2-CD1 4.11Å; I1059-A1104 HydrophobicContact CD1-CB 3.92Å |
| 1060 | A | 80.1 | Confident | 82.2 | Confident | 60 Ų | 60 | 41.4 Ų | 41.4 | 50% | 0.496 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -61.9 | -38.6 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A1056 S1057 L1058 V1062 G1063 | A1056-A1060 WeakPolarHBondContact O-CB 3.41Å; A1056-A1060 PolarHBondContact O-N 2.96Å; S1057-A1060 PolarHBondContact O-N 3.41Å; L1058-A1060 VanDerWaalsContact C-N 3.28Å; L1058-A1060 PolarHBondContact O-N 3.49Å; A1060-V1062 VanDerWaalsContact C-N 3.32Å; A1060-V1062 PolarHBondContact O-N 3.16Å; A1060-G1063 PolarHBondContact O-N 2.78Å |
| 1061 | S | 78.3 | Confident | 82.3 | Confident | 22 Ų | 22 | 39.2 Ų | 39.2 | 15% | 0.154 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -68.5 | -23.9 | 179.8 | 76 | 0 | 0 | 0 | 0 | 114.6 | L1012 S1057 L1058 I1059 | L1012-S1061 WeakPolarHBondContact CD2-OG 3.38Å; S1057-S1061 PolarHBondContact O-N 3.01Å; L1058-S1061 WeakPolarHBondContact O-CB 3.49Å; L1058-S1061 PolarHBondContact O-N 2.95Å; L1058-S1061 PolarHBondContact O-OG 3.37Å; I1059-S1061 VanDerWaalsContact C-N 3.34Å; I1059-S1061 PolarHBondContact O-N 3.19Å |
| 1062 | V | 78.5 | Confident | 82.6 | Confident | 16 Ų | 16 | 36.7 Ų | 36.7 | 10% | 0.097 | 23% | 0.229 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | 16.5 | 176.5 | -69 | 0 | 0 | 0 | 0 | 114.3 | L1016 L1026 L1058 I1059 A1060 G1068 N1071 F1072 | L1016-V1062 HydrophobicContact CD1-CG1 3.65Å; L1026-V1062 HydrophobicContact CB-CG1 4.37Å; L1026-V1062 HydrophobicContact CD2-CG1 4.15Å; L1058-V1062 PolarHBondContact O-N 2.96Å; I1059-V1062 PolarHBondContact O-N 3.2Å; A1060-V1062 VanDerWaalsContact C-N 3.32Å; A1060-V1062 PolarHBondContact O-N 3.16Å; V1062-G1068 VanDerWaalsContact CG2-O 3.25Å; V1062-G1068 WeakPolarHBondContact CG2-O 3.43Å; V1062-N1071 HydrophobicContact CB-CB 4.29Å; V1062-N1071 HydrophobicContact CG2-CB 4.39Å; V1062-N1071 PolarHBondContact O-ND2 3.46Å; V1062-F1072 HydrophobicContact CG2-CD2 4.03Å |
| 1063 | G | 75.9 | Confident | 83 | Confident | 60 Ų | 60 | 36.4 Ų | 36.4 | 62% | 0.619 | 23% | 0.226 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 128.9 | -22.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | A1060 | A1060-G1063 PolarHBondContact O-N 2.78Š|
| 1064 | G | 75.6 | Confident | 83.2 | Confident | 21 Ų | 21 | 34.7 Ų | 34.7 | 22% | 0.216 | 22% | 0.218 | C | C | . | . | S | Bend | trans | 73.9 | 167.7 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | I1059 G1068 | I1059-G1064 WeakPolarHBondContact O-CA 3.33Å; I1059-G1064 PolarHBondContact O-N 3.44Å; G1064-G1068 PolarHBondContact O-N 2.9Å |
| 1065 | G | 80.3 | Confident | 83.2 | Confident | 44 Ų | 44 | 35 Ų | 35 | 45% | 0.454 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | 56.3 | -145.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | L1069 | G1065-L1069 WeakPolarHBondContact O-CB 3.5Å; G1065-L1069 PolarHBondContact O-N 2.91Å |
| 1066 | E | 82.6 | Confident | 83.2 | Confident | 77 Ų | 77 | 35.1 Ų | 35.1 | 36% | 0.36 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -61.9 | -44 | 177 | -173.4 | -170.1 | 152.6 | 0 | 0 | 112.7 | L1069 R1070 S1117 A1118 | E1066-L1069 WeakPolarHBondContact O-CB 3.4Å; E1066-L1069 PolarHBondContact O-N 2.68Å; E1066-L1069 VanDerWaalsContact O-N 3.16Å; E1066-R1070 WeakPolarHBondContact O-CB 3.33Å; E1066-R1070 PolarHBondContact O-N 3.48Å; E1066-S1117 VanDerWaalsContact OE1-CB 3.26Å; E1066-S1117 WeakPolarHBondContact OE1-CB 3.37Å; E1066-S1117 VanDerWaalsContact OE2-CB 3.25Å; E1066-S1117 WeakPolarHBondContact OE2-CB 3.38Å; E1066-A1118 HydrophobicContact CG-CB 4.14Å |
| 1067 | E | 82.4 | Confident | 83.3 | Confident | 139 Ų | 139 | 35.9 Ų | 35.9 | 65% | 0.65 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -67.3 | -43.3 | -173.8 | -171.6 | 170.9 | -178.5 | 0 | 0 | 111.4 | L1069 R1070 N1071 | E1067-L1069 VanDerWaalsContact C-N 3.32Å; E1067-L1069 PolarHBondContact O-N 2.67Å; E1067-R1070 PolarHBondContact O-N 2.85Å; E1067-N1071 WeakPolarHBondContact O-CB 3.48Å; E1067-N1071 PolarHBondContact O-N 3.41Å; E1067-N1071 PolarHBondContact O-ND2 3.03Å |
| 1068 | G | 84.6 | Confident | 83.5 | Confident | 0 Ų | 0 | 35.4 Ų | 35.4 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -58.8 | -43.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | V1062 G1064 F1072 | V1062-G1068 VanDerWaalsContact CG2-O 3.25Å; V1062-G1068 WeakPolarHBondContact CG2-O 3.43Å; G1064-G1068 PolarHBondContact O-N 2.9Å; G1068-F1072 WeakPolarHBondContact O-CB 3.45Å; G1068-F1072 PolarHBondContact O-N 3.4Å |
| 1069 | L | 88.5 | Confident | 83.7 | Confident | 2 Ų | 2 | 36.6 Ų | 36.6 | 1% | 0.01 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -66.7 | -38.4 | 179 | -150.2 | 84.3 | 0 | 0 | 0 | 112.5 | I1059 G1065 E1066 E1067 F1072 I1073 S1105 L1115 A1118 | I1059-L1069 HydrophobicContact CD1-CD1 3.29Å; I1059-L1069 HydrophobicContact CG1-CD1 3.74Å; I1059-L1069 HydrophobicContact CG2-CD1 4.11Å; G1065-L1069 WeakPolarHBondContact O-CB 3.5Å; G1065-L1069 PolarHBondContact O-N 2.91Å; E1066-L1069 WeakPolarHBondContact O-CB 3.4Å; E1066-L1069 PolarHBondContact O-N 2.68Å; E1066-L1069 VanDerWaalsContact O-N 3.16Å; E1067-L1069 VanDerWaalsContact C-N 3.32Å; E1067-L1069 PolarHBondContact O-N 2.67Å; L1069-F1072 WeakPolarHBondContact O-CB 3.33Å; L1069-F1072 PolarHBondContact O-N 3.12Å; L1069-I1073 HydrophobicContact CD2-CD1 4.38Å; L1069-I1073 HydrophobicContact CG-CD1 4.35Å; L1069-I1073 WeakPolarHBondContact O-CG1 3.44Å; L1069-I1073 PolarHBondContact O-N 3.36Å; L1069-S1105 WeakPolarHBondContact CD1-OG 3.41Å; L1069-L1115 VanDerWaalsContact CD2-CA 3.49Å; L1069-L1115 HydrophobicContact CD2-CB 4.16Å; L1069-L1115 HydrophobicContact CD2-CD1 3.78Å; L1069-A1118 HydrophobicContact CB-CB 3.84Å; L1069-A1118 HydrophobicContact CD2-CB 3.86Å; L1069-A1118 HydrophobicContact CG-CB 4.22Å |
| 1070 | R | 89 | Confident | 83.9 | Confident | 82 Ų | 82 | 37.1 Ų | 37.1 | 31% | 0.309 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -64.9 | -50.6 | 176.1 | 173.9 | 178 | -74.3 | -82.2 | -0.8 | 111 | E1066 E1067 F1072 I1073 E1074 S1117 A1118 | E1066-R1070 WeakPolarHBondContact O-CB 3.33Å; E1066-R1070 PolarHBondContact O-N 3.48Å; E1067-R1070 PolarHBondContact O-N 2.85Å; R1070-F1072 PolarHBondContact O-N 3.16Å; R1070-I1073 PolarHBondContact O-N 3.39Å; R1070-E1074 IonicContact NH1-OE1 3.28Å; R1070-E1074 WeakPolarHBondContact O-CG 3.33Å; R1070-E1074 PolarHBondContact O-N 2.89Å; R1070-S1117 PolarHBondContact NH2-O 3.19Å; R1070-A1118 HydrophobicContact CB-CB 4.02Å |
| 1071 | N | 84.8 | Confident | 84.3 | Confident | 26 Ų | 26 | 37.5 Ų | 37.5 | 14% | 0.139 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -54.9 | -37.1 | 175.1 | -71.6 | -24.2 | 0 | 0 | 0 | 111.2 | S1023 V1062 E1067 A1075 | S1023-N1071 WeakPolarHBondContact CB-O 3.44Å; V1062-N1071 HydrophobicContact CB-CB 4.29Å; V1062-N1071 HydrophobicContact CG2-CB 4.39Å; V1062-N1071 PolarHBondContact O-ND2 3.46Å; E1067-N1071 WeakPolarHBondContact O-CB 3.48Å; E1067-N1071 PolarHBondContact O-N 3.41Å; E1067-N1071 PolarHBondContact O-ND2 3.03Å; N1071-A1075 WeakPolarHBondContact O-CB 3.34Å; N1071-A1075 PolarHBondContact O-N 2.76Å |
| 1072 | F | 86.1 | Confident | 84.8 | Confident | 1 Ų | 1 | 36.5 Ų | 36.5 | 0% | 0.004 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -68.7 | -52 | 176.5 | -143.7 | -100.2 | 0 | 0 | 0 | 112.9 | L1026 L1040 L1055 L1058 V1062 G1068 L1069 R1070 E1074 A1075 V1076 L1086 | L1026-F1072 HydrophobicContact CD1-CE2 4.17Å; L1026-F1072 HydrophobicContact CD2-CB 4.41Å; L1026-F1072 HydrophobicContact CD2-CD2 3.27Å; L1026-F1072 HydrophobicContact CD2-CE2 3.6Å; L1026-F1072 HydrophobicContact CD2-CG 4Å; L1040-F1072 HydrophobicContact CD1-CD1 4.27Å; L1040-F1072 HydrophobicContact CD1-CE1 3.33Å; L1040-F1072 HydrophobicContact CD1-CE2 4.43Å; L1040-F1072 HydrophobicContact CD1-CZ 3.43Å; L1040-F1072 VanDerWaalsContact CD1-CZ 3.43Å; L1040-F1072 HydrophobicContact CD2-CE1 3.79Å; L1040-F1072 HydrophobicContact CD2-CZ 4.15Å; L1040-F1072 HydrophobicContact CG-CE1 4.11Å; L1040-F1072 HydrophobicContact CG-CZ 4.15Å; L1055-F1072 HydrophobicContact CD1-CD1 4.01Å; L1055-F1072 HydrophobicContact CD1-CE1 3.42Å; L1055-F1072 VanDerWaalsContact CD1-CE1 3.42Å; L1055-F1072 HydrophobicContact CD1-CZ 3.88Å; L1058-F1072 HydrophobicContact CB-CE2 3.66Å; L1058-F1072 HydrophobicContact CB-CZ 3.9Å; L1058-F1072 HydrophobicContact CD1-CE2 4.47Å; L1058-F1072 HydrophobicContact CD1-CZ 4Å; L1058-F1072 HydrophobicContact CD2-CE2 3.69Å; L1058-F1072 HydrophobicContact CD2-CZ 3.97Å; L1058-F1072 HydrophobicContact CG-CE2 4.15Å; L1058-F1072 HydrophobicContact CG-CZ 4.19Å; V1062-F1072 HydrophobicContact CG2-CD2 4.03Å; G1068-F1072 WeakPolarHBondContact O-CB 3.45Å; G1068-F1072 PolarHBondContact O-N 3.4Å; L1069-F1072 WeakPolarHBondContact O-CB 3.33Å; L1069-F1072 PolarHBondContact O-N 3.12Å; R1070-F1072 PolarHBondContact O-N 3.16Å; F1072-E1074 VanDerWaalsContact C-N 3.32Å; F1072-E1074 PolarHBondContact O-N 3.37Å; F1072-A1075 PolarHBondContact O-N 3.44Å; F1072-V1076 WeakPolarHBondContact O-CG2 3.42Å; F1072-V1076 PolarHBondContact O-N 3.2Å; F1072-L1086 HydrophobicContact CD1-CD1 3.97Å; F1072-L1086 HydrophobicContact CD1-CG 4.41Å; F1072-L1086 HydrophobicContact CE1-CD1 4.47Å; F1072-L1086 HydrophobicContact CE1-CG 4.45Å |
| 1073 | I | 88.7 | Confident | 85.5 | Confident | 4 Ų | 4 | 35.9 Ų | 35.9 | 2% | 0.021 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -61.9 | -39.2 | -179.3 | -70.8 | 166.8 | 0 | 0 | 0 | 111.2 | L1069 R1070 G1077 G1078 L1083 L1086 L1115 A1118 | L1069-I1073 HydrophobicContact CD2-CD1 4.38Å; L1069-I1073 HydrophobicContact CG-CD1 4.35Å; L1069-I1073 WeakPolarHBondContact O-CG1 3.44Å; L1069-I1073 PolarHBondContact O-N 3.36Å; R1070-I1073 PolarHBondContact O-N 3.39Å; I1073-G1077 PolarHBondContact O-N 3.2Å; I1073-G1078 WeakPolarHBondContact O-CA 3.49Å; I1073-G1078 PolarHBondContact O-N 3.39Å; I1073-L1083 HydrophobicContact CD1-CD2 3.99Å; I1073-L1083 HydrophobicContact CD1-CG 4.39Å; I1073-L1083 HydrophobicContact CG1-CD2 4.38Å; I1073-L1086 HydrophobicContact CG1-CD1 4.28Å; I1073-L1115 HydrophobicContact CD1-CD1 4.39Å; I1073-A1118 HydrophobicContact CD1-CB 4.07Å |
| 1074 | E | 87.1 | Confident | 86.2 | Confident | 92 Ų | 92 | 34.9 Ų | 34.9 | 43% | 0.43 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -62.6 | -46.1 | 173.9 | -73.8 | 176.7 | -171.1 | 0 | 0 | 111.5 | R1070 F1072 V1076 G1077 | R1070-E1074 IonicContact NH1-OE1 3.28Å; R1070-E1074 WeakPolarHBondContact O-CG 3.33Å; R1070-E1074 PolarHBondContact O-N 2.89Å; F1072-E1074 VanDerWaalsContact C-N 3.32Å; F1072-E1074 PolarHBondContact O-N 3.37Å; E1074-V1076 VanDerWaalsContact C-N 3.28Å; E1074-V1076 PolarHBondContact O-N 3.07Å; E1074-G1077 PolarHBondContact O-N 3.5Å |
| 1075 | A | 85.7 | Confident | 86.9 | Confident | 12 Ų | 12 | 35.5 Ų | 35.5 | 10% | 0.099 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.6 | -24.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | L1026 K1027 L1030 N1071 F1072 | L1026-A1075 HydrophobicContact CB-CB 3.97Å; L1026-A1075 HydrophobicContact CD2-CB 3.58Å; L1026-A1075 HydrophobicContact CG-CB 3.67Å; K1027-A1075 HydrophobicContact CB-CB 4.1Å; L1030-A1075 HydrophobicContact CD1-CB 4.09Å; N1071-A1075 WeakPolarHBondContact O-CB 3.34Å; N1071-A1075 PolarHBondContact O-N 2.76Å; F1072-A1075 PolarHBondContact O-N 3.44Å |
| 1076 | V | 87.2 | Confident | 87.4 | Confident | 4 Ų | 4 | 33.5 Ų | 33.5 | 2% | 0.024 | 20% | 0.198 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -93.3 | 8.8 | 170.8 | -71.7 | 0 | 0 | 0 | 0 | 114.6 | L1030 L1040 F1072 E1074 G1082 N1085 | L1030-V1076 HydrophobicContact CD1-CG1 3.8Å; L1040-V1076 HydrophobicContact CB-CG1 4.36Å; L1040-V1076 HydrophobicContact CD1-CG1 3.36Å; L1040-V1076 HydrophobicContact CG-CG1 4.4Å; F1072-V1076 WeakPolarHBondContact O-CG2 3.42Å; F1072-V1076 PolarHBondContact O-N 3.2Å; E1074-V1076 VanDerWaalsContact C-N 3.28Å; E1074-V1076 PolarHBondContact O-N 3.07Å; V1076-G1082 VanDerWaalsContact CG2-O 3.28Å; V1076-G1082 WeakPolarHBondContact CG2-O 3.28Å; V1076-N1085 HydrophobicContact CB-CB 4.19Å; V1076-N1085 PolarHBondContact O-ND2 2.86Å |
| 1077 | G | 85.3 | Confident | 87.8 | Confident | 53 Ų | 53 | 30.4 Ų | 30.4 | 55% | 0.546 | 18% | 0.183 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 118.6 | 0.8 | 169.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | I1073 E1074 | I1073-G1077 PolarHBondContact O-N 3.2Å; E1074-G1077 PolarHBondContact O-N 3.5Å |
| 1078 | G | 85.1 | Confident | 88.2 | Confident | 22 Ų | 22 | 30 Ų | 30 | 23% | 0.227 | 18% | 0.18 | C | C | . | . | S | Bend | trans | 77.1 | 152.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | I1073 S1081 G1082 | I1073-G1078 WeakPolarHBondContact O-CA 3.49Å; I1073-G1078 PolarHBondContact O-N 3.39Å; G1078-S1081 PolarHBondContact O-N 2.93Å; G1078-G1082 PolarHBondContact O-N 2.81Å |
| 1079 | G | 88.2 | Confident | 88.4 | Confident | 24 Ų | 24 | 30.3 Ų | 30.3 | 25% | 0.247 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | 50.6 | -140.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | S1081 G1082 L1083 | G1079-S1081 VanDerWaalsContact C-N 3.26Å; G1079-S1081 PolarHBondContact O-N 3.32Å; G1079-G1082 PolarHBondContact O-N 3.44Å; G1079-L1083 PolarHBondContact O-N 3.16Å |
| 1080 | A | 88.5 | Confident | 88.4 | Confident | 19 Ų | 19 | 31.2 Ų | 31.2 | 16% | 0.157 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -59.2 | -32.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | T1084 N1128 E1131 | A1080-T1084 VanDerWaalsContact O-CB 3.25Å; A1080-T1084 WeakPolarHBondContact O-CB 3.13Å; A1080-T1084 PolarHBondContact O-N 3.18Å; A1080-T1084 PolarHBondContact O-OG1 3.05Å; A1080-N1128 HydrophobicContact CB-CB 4.32Å; A1080-N1128 WeakPolarHBondContact CB-OD1 3.37Å; A1080-N1128 VanDerWaalsContact N-CG 3.33Å; A1080-N1128 PolarHBondContact N-OD1 3Å; A1080-E1131 HydrophobicContact CB-CB 4.01Å |
| 1081 | S | 87.8 | Confident | 88.2 | Confident | 68 Ų | 68 | 28.7 Ų | 28.7 | 48% | 0.476 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -70.7 | -47 | 179.7 | -168.5 | 0 | 0 | 0 | 0 | 111.3 | G1078 G1079 T1084 N1085 | G1078-S1081 PolarHBondContact O-N 2.93Å; G1079-S1081 VanDerWaalsContact C-N 3.26Å; G1079-S1081 PolarHBondContact O-N 3.32Å; S1081-T1084 PolarHBondContact O-N 3.33Å; S1081-N1085 PolarHBondContact O-N 2.93Å |
| 1082 | G | 89.9 | Confident | 88.3 | Confident | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -57.7 | -49.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112 | V1076 G1078 G1079 T1084 N1085 L1086 | V1076-G1082 VanDerWaalsContact CG2-O 3.28Å; V1076-G1082 WeakPolarHBondContact CG2-O 3.28Å; G1078-G1082 PolarHBondContact O-N 2.81Å; G1079-G1082 PolarHBondContact O-N 3.44Å; G1082-T1084 VanDerWaalsContact C-N 3.34Å; G1082-T1084 PolarHBondContact O-N 2.86Å; G1082-N1085 PolarHBondContact O-N 3.48Å; G1082-L1086 WeakPolarHBondContact O-CB 3.2Å; G1082-L1086 PolarHBondContact O-N 3.02Å |
| 1083 | L | 92.4 | Very high | 88.5 | Confident | 3 Ų | 3 | 33.1 Ų | 33.1 | 2% | 0.016 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59.2 | -42.5 | 174.5 | -76.7 | 165 | 0 | 0 | 0 | 112.5 | I1073 G1079 N1085 L1086 L1087 L1101 L1115 A1119 N1128 I1129 A1132 | I1073-L1083 HydrophobicContact CD1-CD2 3.99Å; I1073-L1083 HydrophobicContact CD1-CG 4.39Å; I1073-L1083 HydrophobicContact CG1-CD2 4.38Å; G1079-L1083 PolarHBondContact O-N 3.16Å; L1083-N1085 VanDerWaalsContact C-N 3.34Å; L1083-N1085 PolarHBondContact O-N 3.33Å; L1083-L1086 PolarHBondContact O-N 3.41Å; L1083-L1087 VanDerWaalsContact O-CG 3.29Å; L1083-L1087 WeakPolarHBondContact O-CG 3.3Å; L1083-L1087 PolarHBondContact O-N 2.98Å; L1083-L1101 HydrophobicContact CD2-CD2 3.93Å; L1083-L1115 HydrophobicContact CD2-CD1 3.76Å; L1083-A1119 HydrophobicContact CD1-CB 3.84Å; L1083-N1128 HydrophobicContact CD1-CB 3.92Å; L1083-I1129 HydrophobicContact CD1-CG1 3.86Å; L1083-A1132 HydrophobicContact CB-CB 3.48Å; L1083-A1132 VanDerWaalsContact CB-CB 3.48Å |
| 1084 | T | 91.2 | Very high | 88.6 | Confident | 40 Ų | 40 | 35.7 Ų | 35.7 | 25% | 0.245 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.1 | -41.1 | 177.9 | -61.9 | 0 | 0 | 0 | 0 | 111.6 | A1080 S1081 G1082 K1088 A1132 | A1080-T1084 VanDerWaalsContact O-CB 3.25Å; A1080-T1084 WeakPolarHBondContact O-CB 3.13Å; A1080-T1084 PolarHBondContact O-N 3.18Å; A1080-T1084 PolarHBondContact O-OG1 3.05Å; S1081-T1084 PolarHBondContact O-N 3.33Å; G1082-T1084 VanDerWaalsContact C-N 3.34Å; G1082-T1084 PolarHBondContact O-N 2.86Å; T1084-K1088 HydrophobicContact CG2-CD 4.15Å; T1084-K1088 WeakPolarHBondContact O-CB 3.25Å; T1084-K1088 VanDerWaalsContact O-CG 3.25Å; T1084-K1088 WeakPolarHBondContact O-CG 3.36Å; T1084-K1088 PolarHBondContact O-N 3.4Å; T1084-A1132 WeakPolarHBondContact OG1-CA 3.27Å |
| 1085 | N | 89.9 | Confident | 88.7 | Confident | 34 Ų | 34 | 33.6 Ų | 33.6 | 18% | 0.182 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -66.8 | -41.1 | 176.1 | -73 | -23.8 | 0 | 0 | 0 | 111.6 | A1037 V1076 S1081 G1082 L1083 K1088 S1089 | A1037-N1085 HydrophobicContact CB-CB 4.19Å; A1037-N1085 WeakPolarHBondContact CB-O 3.43Å; V1076-N1085 HydrophobicContact CB-CB 4.19Å; V1076-N1085 PolarHBondContact O-ND2 2.86Å; S1081-N1085 PolarHBondContact O-N 2.93Å; G1082-N1085 PolarHBondContact O-N 3.48Å; L1083-N1085 VanDerWaalsContact C-N 3.34Å; L1083-N1085 PolarHBondContact O-N 3.33Å; N1085-K1088 PolarHBondContact O-N 2.91Å; N1085-S1089 WeakPolarHBondContact O-CB 3.43Å; N1085-S1089 PolarHBondContact O-N 3.22Å |
| 1086 | L | 90.7 | Very high | 88.9 | Confident | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.005 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62 | -50.5 | 177.2 | -149.8 | 174.1 | 0 | 0 | 0 | 110.9 | L1055 F1072 I1073 G1082 L1083 K1088 S1089 L1090 L1101 | L1055-L1086 HydrophobicContact CD1-CD2 4.17Å; L1055-L1086 HydrophobicContact CD2-CD2 3.73Å; F1072-L1086 HydrophobicContact CD1-CD1 3.97Å; F1072-L1086 HydrophobicContact CD1-CG 4.41Å; F1072-L1086 HydrophobicContact CE1-CD1 4.47Å; F1072-L1086 HydrophobicContact CE1-CG 4.45Å; I1073-L1086 HydrophobicContact CG1-CD1 4.28Å; G1082-L1086 WeakPolarHBondContact O-CB 3.2Å; G1082-L1086 PolarHBondContact O-N 3.02Å; L1083-L1086 PolarHBondContact O-N 3.41Å; L1086-K1088 PolarHBondContact O-N 2.88Å; L1086-S1089 PolarHBondContact O-N 2.89Å; L1086-S1089 VanDerWaalsContact O-N 3.15Å; L1086-S1089 PolarHBondContact O-OG 3.05Å; L1086-L1090 HydrophobicContact CD2-CD1 3.81Å; L1086-L1090 HydrophobicContact CD2-CG 4.21Å; L1086-L1090 PolarHBondContact O-N 3.47Å; L1086-L1101 HydrophobicContact CD1-CD1 3.95Å; L1086-L1101 HydrophobicContact CD2-CD1 3.94Å; L1086-L1101 HydrophobicContact CD2-CD2 4.46Å |
| 1087 | L | 91.6 | Very high | 89.2 | Confident | 12 Ų | 12 | 38 Ų | 38 | 6% | 0.063 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62 | -41.3 | 177.9 | -65 | 173.5 | 0 | 0 | 0 | 112.6 | L1083 S1089 L1090 G1091 A1097 L1098 L1101 A1132 | L1083-L1087 VanDerWaalsContact O-CG 3.29Å; L1083-L1087 WeakPolarHBondContact O-CG 3.3Å; L1083-L1087 PolarHBondContact O-N 2.98Å; L1087-S1089 VanDerWaalsContact C-N 3.32Å; L1087-S1089 PolarHBondContact O-N 3.39Å; L1087-L1090 PolarHBondContact O-N 3.44Å; L1087-G1091 PolarHBondContact O-N 3.14Å; L1087-A1097 HydrophobicContact CB-CB 4.08Å; L1087-A1097 VanDerWaalsContact CD2-C 3.49Å; L1087-A1097 HydrophobicContact CD2-CB 3.71Å; L1087-A1097 WeakPolarHBondContact CD2-O 3.35Å; L1087-A1097 HydrophobicContact CG-CB 4.49Å; L1087-L1098 HydrophobicContact CD1-CD1 3.59Å; L1087-L1098 HydrophobicContact CD2-CD1 3.75Å; L1087-L1098 HydrophobicContact CG-CD1 4.33Å; L1087-L1101 HydrophobicContact CD2-CB 4.37Å; L1087-L1101 HydrophobicContact CD2-CD2 3.82Å; L1087-L1101 HydrophobicContact CG-CD2 4.49Å; L1087-A1132 HydrophobicContact CD1-CB 4.02Å |
| 1088 | K | 89.9 | Confident | 89.5 | Confident | 132 Ų | 132 | 35.5 Ų | 35.5 | 57% | 0.574 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -61.7 | -38 | 174.1 | -76.3 | 171.6 | -178.9 | 174.1 | 0 | 112.8 | A1037 T1084 N1085 L1086 G1091 | A1037-K1088 HydrophobicContact CB-CB 4.08Å; T1084-K1088 HydrophobicContact CG2-CD 4.15Å; T1084-K1088 WeakPolarHBondContact O-CB 3.25Å; T1084-K1088 VanDerWaalsContact O-CG 3.25Å; T1084-K1088 WeakPolarHBondContact O-CG 3.36Å; T1084-K1088 PolarHBondContact O-N 3.4Å; N1085-K1088 PolarHBondContact O-N 2.91Å; L1086-K1088 PolarHBondContact O-N 2.88Å; K1088-G1091 PolarHBondContact O-N 3.31Å |
| 1089 | S | 88.7 | Confident | 89.8 | Confident | 5 Ų | 5 | 37.6 Ų | 37.6 | 4% | 0.035 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -70.2 | -33.4 | -178.1 | 72.4 | 0 | 0 | 0 | 0 | 113.4 | L1040 Q1041 N1085 L1086 L1087 | L1040-S1089 WeakPolarHBondContact CD2-OG 3.25Å; Q1041-S1089 PolarHBondContact NE2-O 3.32Å; N1085-S1089 WeakPolarHBondContact O-CB 3.43Å; N1085-S1089 PolarHBondContact O-N 3.22Å; L1086-S1089 PolarHBondContact O-N 2.89Å; L1086-S1089 VanDerWaalsContact O-N 3.15Å; L1086-S1089 PolarHBondContact O-OG 3.05Å; L1087-S1089 VanDerWaalsContact C-N 3.32Å; L1087-S1089 PolarHBondContact O-N 3.39Å |
| 1090 | L | 88.4 | Confident | 89.9 | Confident | 21 Ų | 21 | 37.5 Ų | 37.5 | 11% | 0.11 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -68.6 | -33.4 | 174.8 | -71.5 | 169.9 | 0 | 0 | 0 | 112.4 | L1044 P1051 L1055 L1086 L1087 A1097 A1100 L1101 | L1044-L1090 HydrophobicContact CD1-CD2 4.24Å; P1051-L1090 HydrophobicContact CB-CD2 3.78Å; L1055-L1090 HydrophobicContact CB-CD2 4.46Å; L1055-L1090 HydrophobicContact CD2-CD1 4.04Å; L1055-L1090 HydrophobicContact CD2-CD2 4.05Å; L1055-L1090 HydrophobicContact CD2-CG 4.48Å; L1086-L1090 HydrophobicContact CD2-CD1 3.81Å; L1086-L1090 HydrophobicContact CD2-CG 4.21Å; L1086-L1090 PolarHBondContact O-N 3.47Å; L1087-L1090 PolarHBondContact O-N 3.44Å; L1090-A1097 HydrophobicContact CB-CB 4.36Å; L1090-A1097 WeakPolarHBondContact CD1-O 3.18Å; L1090-A1100 HydrophobicContact CD1-CB 4.19Å; L1090-L1101 HydrophobicContact CD1-CB 4.1Å |
| 1091 | G | 84.8 | Confident | 90 | Very high | 29 Ų | 29 | 36.6 Ų | 36.6 | 30% | 0.299 | 22% | 0.221 | S | C | . | . | trans | 75.3 | -166.4 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | L1087 K1088 | L1087-G1091 PolarHBondContact O-N 3.14Å; K1088-G1091 PolarHBondContact O-N 3.31Å | ||
| 1092 | G | 87.2 | Confident | 90.1 | Very high | 68 Ų | 68 | 33.5 Ų | 33.5 | 70% | 0.701 | 20% | 0.199 | S | C | * | . | S | Bend | trans | 75.8 | -162 | -171.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | E1096 | G1092-E1096 VanDerWaalsContact CA-OE2 3.24Å; G1092-E1096 WeakPolarHBondContact CA-OE2 3.35Å |
| 1093 | S | 90.5 | Very high | 90.1 | Very high | 52 Ų | 52 | 37.7 Ų | 37.7 | 36% | 0.364 | 23% | 0.225 | S | C | . | . | trans | -75.7 | 162.3 | 166.1 | 77.4 | 0 | 0 | 0 | 0 | 111.7 | K1095 E1096 A1097 | S1093-K1095 PolarHBondContact O-N 3.41Å; S1093-E1096 WeakPolarHBondContact CB-OE1 3.09Å; S1093-E1096 VanDerWaalsContact N-CD 3.34Å; S1093-E1096 PolarHBondContact N-OE2 2.92Å; S1093-E1096 PolarHBondContact O-N 2.87Å; S1093-E1096 VanDerWaalsContact O-N 3.08Å; S1093-E1096 PolarHBondContact OG-N 3.22Å; S1093-E1096 PolarHBondContact OG-OE1 3.19Å; S1093-A1097 PolarHBondContact O-N 3.24Å | ||
| 1094 | T | 90.3 | Very high | 89.9 | Confident | 59 Ų | 59 | 38 Ų | 38 | 36% | 0.362 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -59.2 | -30.6 | 177.5 | -42.7 | 0 | 0 | 0 | 0 | 112.8 | L1098 A1133 | T1094-L1098 PolarHBondContact O-N 3.41Å; T1094-L1098 VanDerWaalsContact O-N 3.11Å; T1094-A1133 HydrophobicContact CG2-CB 4.32Å; T1094-A1133 WeakPolarHBondContact CG2-O 3.36Å |
| 1095 | K | 89.7 | Confident | 89.7 | Confident | 47 Ų | 47 | 36.6 Ų | 36.6 | 20% | 0.204 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65 | -53.7 | 171.3 | 173.5 | 178.4 | 166.1 | 159.8 | 0 | 110.6 | S1093 A1097 L1098 E1099 S1145 D1149 | S1093-K1095 PolarHBondContact O-N 3.41Å; K1095-A1097 VanDerWaalsContact C-N 3.29Å; K1095-A1097 PolarHBondContact O-N 2.95Å; K1095-L1098 PolarHBondContact O-N 2.93Å; K1095-E1099 WeakPolarHBondContact CE-OE1 3.49Å; K1095-E1099 WeakPolarHBondContact CE-OE2 3.35Å; K1095-E1099 HydrophobicContact CG-CG 4.31Å; K1095-E1099 IonicContact NZ-OE1 3.28Å; K1095-E1099 PolarHBondContact NZ-OE1 3.49Å; K1095-E1099 WeakPolarHBondContact O-CG 3.44Å; K1095-E1099 PolarHBondContact O-N 3.19Å; K1095-S1145 WeakPolarHBondContact CE-O 3.48Å; K1095-S1145 PolarHBondContact NZ-O 2.98Å; K1095-D1149 IonicContact NZ-OD1 3.69Å |
| 1096 | E | 90.2 | Very high | 89.4 | Confident | 106 Ų | 106 | 37.7 Ų | 37.7 | 50% | 0.495 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -58.1 | -41.7 | -179.1 | -70.3 | 141.2 | -128.2 | 0 | 0 | 111.7 | G1092 S1093 E1099 A1100 | G1092-E1096 VanDerWaalsContact CA-OE2 3.24Å; G1092-E1096 WeakPolarHBondContact CA-OE2 3.35Å; S1093-E1096 WeakPolarHBondContact CB-OE1 3.09Å; S1093-E1096 VanDerWaalsContact N-CD 3.34Å; S1093-E1096 PolarHBondContact N-OE2 2.92Å; S1093-E1096 PolarHBondContact O-N 2.87Å; S1093-E1096 VanDerWaalsContact O-N 3.08Å; S1093-E1096 PolarHBondContact OG-N 3.22Å; S1093-E1096 PolarHBondContact OG-OE1 3.19Å; E1096-E1099 PolarHBondContact O-N 2.86Å; E1096-A1100 WeakPolarHBondContact O-CB 3.28Å; E1096-A1100 PolarHBondContact O-N 2.91Å |
| 1097 | A | 92.2 | Very high | 89.1 | Confident | 2 Ų | 2 | 39 Ų | 39 | 2% | 0.017 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.9 | -39.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L1087 L1090 S1093 K1095 L1101 | L1087-A1097 HydrophobicContact CB-CB 4.08Å; L1087-A1097 VanDerWaalsContact CD2-C 3.49Å; L1087-A1097 HydrophobicContact CD2-CB 3.71Å; L1087-A1097 WeakPolarHBondContact CD2-O 3.35Å; L1087-A1097 HydrophobicContact CG-CB 4.49Å; L1090-A1097 HydrophobicContact CB-CB 4.36Å; L1090-A1097 WeakPolarHBondContact CD1-O 3.18Å; S1093-A1097 PolarHBondContact O-N 3.24Å; K1095-A1097 VanDerWaalsContact C-N 3.29Å; K1095-A1097 PolarHBondContact O-N 2.95Å; A1097-L1101 VanDerWaalsContact O-CB 3.29Å; A1097-L1101 WeakPolarHBondContact O-CB 3.4Å; A1097-L1101 PolarHBondContact O-N 3.37Å |
| 1098 | L | 92.2 | Very high | 88.7 | Confident | 2 Ų | 2 | 40.2 Ų | 40.2 | 1% | 0.01 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -67.9 | -41.6 | 174.1 | -124.4 | 86.9 | 0 | 0 | 0 | 111.5 | L1087 T1094 K1095 L1101 L1102 I1129 A1133 L1143 S1146 | L1087-L1098 HydrophobicContact CD1-CD1 3.59Å; L1087-L1098 HydrophobicContact CD2-CD1 3.75Å; L1087-L1098 HydrophobicContact CG-CD1 4.33Å; T1094-L1098 PolarHBondContact O-N 3.41Å; T1094-L1098 VanDerWaalsContact O-N 3.11Å; K1095-L1098 PolarHBondContact O-N 2.93Å; L1098-L1101 PolarHBondContact O-N 2.91Å; L1098-L1102 VanDerWaalsContact O-CB 3.31Å; L1098-L1102 WeakPolarHBondContact O-CB 3.16Å; L1098-L1102 WeakPolarHBondContact O-CG 3.34Å; L1098-L1102 PolarHBondContact O-N 2.89Å; L1098-I1129 HydrophobicContact CD2-CG2 4.31Å; L1098-A1133 HydrophobicContact CD1-CB 3.95Å; L1098-L1143 HydrophobicContact CD2-CB 4.24Å; L1098-L1143 HydrophobicContact CD2-CD1 3.79Å; L1098-S1146 WeakPolarHBondContact CD2-OG 3.37Å |
| 1099 | E | 90.8 | Very high | 88.3 | Confident | 66 Ų | 66 | 36.2 Ų | 36.2 | 31% | 0.308 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -62.6 | -43.1 | 177 | -72.4 | 179.8 | 145.3 | 0 | 0 | 111.6 | K1095 E1096 T1103 | K1095-E1099 WeakPolarHBondContact CE-OE1 3.49Å; K1095-E1099 WeakPolarHBondContact CE-OE2 3.35Å; K1095-E1099 HydrophobicContact CG-CG 4.31Å; K1095-E1099 IonicContact NZ-OE1 3.28Å; K1095-E1099 PolarHBondContact NZ-OE1 3.49Å; K1095-E1099 WeakPolarHBondContact O-CG 3.44Å; K1095-E1099 PolarHBondContact O-N 3.19Å; E1096-E1099 PolarHBondContact O-N 2.86Å; E1099-T1103 VanDerWaalsContact O-CB 3.24Å; E1099-T1103 WeakPolarHBondContact O-CB 3.36Å; E1099-T1103 PolarHBondContact O-N 3.26Å; E1099-T1103 PolarHBondContact O-OG1 3.25Å |
| 1100 | A | 90.2 | Very high | 88.1 | Confident | 22 Ų | 22 | 40.6 Ų | 40.6 | 18% | 0.182 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -62.6 | -44.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | A1052 L1090 E1096 T1103 A1104 | A1052-A1100 HydrophobicContact CB-CB 4.06Å; L1090-A1100 HydrophobicContact CD1-CB 4.19Å; E1096-A1100 WeakPolarHBondContact O-CB 3.28Å; E1096-A1100 PolarHBondContact O-N 2.91Å; A1100-T1103 PolarHBondContact O-N 3.48Å; A1100-A1104 WeakPolarHBondContact O-CB 3.26Å; A1100-A1104 PolarHBondContact O-N 3.42Å |
| 1101 | L | 91.6 | Very high | 88.1 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -66 | -44.2 | 176.9 | 177.2 | 55.1 | 0 | 0 | 0 | 112.4 | L1055 L1083 L1086 L1087 L1090 A1097 L1098 T1103 A1104 S1105 L1115 | L1055-L1101 HydrophobicContact CD2-CD1 3.89Å; L1083-L1101 HydrophobicContact CD2-CD2 3.93Å; L1086-L1101 HydrophobicContact CD1-CD1 3.95Å; L1086-L1101 HydrophobicContact CD2-CD1 3.94Å; L1086-L1101 HydrophobicContact CD2-CD2 4.46Å; L1087-L1101 HydrophobicContact CD2-CB 4.37Å; L1087-L1101 HydrophobicContact CD2-CD2 3.82Å; L1087-L1101 HydrophobicContact CG-CD2 4.49Å; L1090-L1101 HydrophobicContact CD1-CB 4.1Å; A1097-L1101 VanDerWaalsContact O-CB 3.29Å; A1097-L1101 WeakPolarHBondContact O-CB 3.4Å; A1097-L1101 PolarHBondContact O-N 3.37Å; L1098-L1101 PolarHBondContact O-N 2.91Å; L1101-T1103 VanDerWaalsContact C-N 3.33Å; L1101-T1103 PolarHBondContact O-N 3.44Å; L1101-A1104 PolarHBondContact O-N 2.95Å; L1101-S1105 VanDerWaalsContact O-CB 3.3Å; L1101-S1105 WeakPolarHBondContact O-CB 3.25Å; L1101-S1105 PolarHBondContact O-N 2.93Å; L1101-S1105 PolarHBondContact O-OG 3.34Å; L1101-L1115 HydrophobicContact CD1-CD1 4.12Å; L1101-L1115 HydrophobicContact CD2-CD1 3.72Å; L1101-L1115 HydrophobicContact CD2-CD2 4.22Å; L1101-L1115 HydrophobicContact CG-CD1 3.83Å; L1101-L1115 HydrophobicContact CG-CD2 4.27Å |
| 1102 | L | 90.3 | Very high | 88.3 | Confident | 2 Ų | 2 | 38.2 Ų | 38.2 | 1% | 0.01 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.9 | -40.5 | 175 | -73.5 | 169.6 | 0 | 0 | 0 | 111.3 | L1098 S1105 G1106 G1107 L1112 L1115 S1146 L1147 | L1098-L1102 VanDerWaalsContact O-CB 3.31Å; L1098-L1102 WeakPolarHBondContact O-CB 3.16Å; L1098-L1102 WeakPolarHBondContact O-CG 3.34Å; L1098-L1102 PolarHBondContact O-N 2.89Å; L1102-S1105 PolarHBondContact O-N 3.42Å; L1102-G1106 PolarHBondContact O-N 2.99Å; L1102-G1107 WeakPolarHBondContact O-CA 3.25Å; L1102-G1107 PolarHBondContact O-N 2.95Å; L1102-L1112 VanDerWaalsContact CD2-CA 3.48Å; L1102-L1112 HydrophobicContact CD2-CB 3.82Å; L1102-L1112 HydrophobicContact CD2-CD1 4.04Å; L1102-L1115 HydrophobicContact CD2-CD2 3.8Å; L1102-L1115 HydrophobicContact CG-CD2 4.37Å; L1102-S1146 WeakPolarHBondContact CD1-OG 3.17Å; L1102-L1147 HydrophobicContact CD1-CD2 3.89Å; L1102-L1147 HydrophobicContact CD1-CG 4.49Å |
| 1103 | T | 89.1 | Confident | 88.4 | Confident | 88 Ų | 88 | 38.2 Ų | 38.2 | 54% | 0.54 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -61.8 | -50.1 | 174.5 | -60.8 | 0 | 0 | 0 | 0 | 111 | E1099 A1100 L1101 S1105 G1106 G1107 | E1099-T1103 VanDerWaalsContact O-CB 3.24Å; E1099-T1103 WeakPolarHBondContact O-CB 3.36Å; E1099-T1103 PolarHBondContact O-N 3.26Å; E1099-T1103 PolarHBondContact O-OG1 3.25Å; A1100-T1103 PolarHBondContact O-N 3.48Å; L1101-T1103 VanDerWaalsContact C-N 3.33Å; L1101-T1103 PolarHBondContact O-N 3.44Å; T1103-S1105 PolarHBondContact O-N 3Å; T1103-G1106 PolarHBondContact O-N 3.03Å; T1103-G1106 VanDerWaalsContact O-N 3.1Å; T1103-G1107 PolarHBondContact O-N 2.91Å |
| 1104 | A | 87.5 | Confident | 88.4 | Confident | 11 Ų | 11 | 37.5 Ų | 37.5 | 9% | 0.091 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -62.2 | -29.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | A1052 L1055 A1056 I1059 A1100 L1101 G1106 | A1052-A1104 WeakPolarHBondContact O-CB 3.49Å; L1055-A1104 HydrophobicContact CB-CB 4Å; L1055-A1104 HydrophobicContact CD2-CB 3.69Å; L1055-A1104 HydrophobicContact CG-CB 3.77Å; A1056-A1104 HydrophobicContact CB-CB 4.17Å; I1059-A1104 HydrophobicContact CD1-CB 3.92Å; A1100-A1104 WeakPolarHBondContact O-CB 3.26Å; A1100-A1104 PolarHBondContact O-N 3.42Å; L1101-A1104 PolarHBondContact O-N 2.95Å; A1104-G1106 VanDerWaalsContact C-N 3.3Å; A1104-G1106 PolarHBondContact O-N 3.49Å |
| 1105 | S | 87.9 | Confident | 88.4 | Confident | 9 Ų | 9 | 34.7 Ų | 34.7 | 6% | 0.063 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | -5.4 | 177.2 | -55.5 | 0 | 0 | 0 | 0 | 114.1 | L1069 L1101 L1102 T1103 G1111 N1114 | L1069-S1105 WeakPolarHBondContact CD1-OG 3.41Å; L1101-S1105 VanDerWaalsContact O-CB 3.3Å; L1101-S1105 WeakPolarHBondContact O-CB 3.25Å; L1101-S1105 PolarHBondContact O-N 2.93Å; L1101-S1105 PolarHBondContact O-OG 3.34Å; L1102-S1105 PolarHBondContact O-N 3.42Å; T1103-S1105 PolarHBondContact O-N 3Å; S1105-G1111 WeakPolarHBondContact CB-O 3.41Å; S1105-N1114 PolarHBondContact O-ND2 3.45Å |
| 1106 | G | 84.2 | Confident | 88.4 | Confident | 57 Ų | 57 | 32.7 Ų | 32.7 | 59% | 0.588 | 20% | 0.201 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 127 | -4.3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | L1102 T1103 A1104 | L1102-G1106 PolarHBondContact O-N 2.99Å; T1103-G1106 PolarHBondContact O-N 3.03Å; T1103-G1106 VanDerWaalsContact O-N 3.1Å; A1104-G1106 VanDerWaalsContact C-N 3.3Å; A1104-G1106 PolarHBondContact O-N 3.49Å |
| 1107 | G | 82.9 | Confident | 88.4 | Confident | 29 Ų | 29 | 29.5 Ų | 29.5 | 30% | 0.299 | 19% | 0.19 | S | C | . | . | S | Bend | trans | 89.5 | 135.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | L1102 T1103 I1109 E1110 G1111 | L1102-G1107 WeakPolarHBondContact O-CA 3.25Å; L1102-G1107 PolarHBondContact O-N 2.95Å; T1103-G1107 PolarHBondContact O-N 2.91Å; G1107-I1109 PolarHBondContact O-N 3.42Å; G1107-E1110 PolarHBondContact O-N 3.37Å; G1107-G1111 PolarHBondContact O-N 3.46Å |
| 1108 | G | 83.6 | Confident | 88.3 | Confident | 38 Ų | 38 | 29.7 Ų | 29.7 | 39% | 0.392 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | 48.6 | -128.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | E1110 G1111 L1112 | G1108-E1110 PolarHBondContact O-N 3.42Å; G1108-G1111 PolarHBondContact O-N 3.26Å; G1108-L1112 PolarHBondContact O-N 2.95Å |
| 1109 | I | 81.4 | Confident | 88.2 | Confident | 47 Ų | 47 | 29.8 Ų | 29.8 | 24% | 0.241 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65.1 | -35.1 | -177 | -75.4 | -65.4 | 0 | 0 | 0 | 114 | G1107 L1112 K1113 S1161 | G1107-I1109 PolarHBondContact O-N 3.42Å; I1109-L1112 HydrophobicContact CD1-CD2 4.21Å; I1109-L1112 WeakPolarHBondContact O-CB 3.45Å; I1109-L1112 PolarHBondContact O-N 3.42Å; I1109-K1113 WeakPolarHBondContact O-CG 3.21Å; I1109-K1113 PolarHBondContact O-N 3.44Å; I1109-S1161 VanDerWaalsContact CG2-OG 3.24Å; I1109-S1161 WeakPolarHBondContact CG2-OG 3.44Å |
| 1110 | E | 84.8 | Confident | 88.1 | Confident | 97 Ų | 97 | 28.7 Ų | 28.7 | 45% | 0.453 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -75.9 | -37.1 | 179.1 | -145.7 | 65.8 | -162.6 | 0 | 0 | 110.7 | G1107 G1108 L1112 K1113 N1114 | G1107-E1110 PolarHBondContact O-N 3.37Å; G1108-E1110 PolarHBondContact O-N 3.42Å; E1110-L1112 VanDerWaalsContact C-N 3.28Å; E1110-L1112 PolarHBondContact O-N 2.82Å; E1110-K1113 VanDerWaalsContact CD-NZ 3.32Å; E1110-K1113 PolarHBondContact O-N 2.92Å; E1110-K1113 IonicContact OE1-NZ 3.14Å; E1110-K1113 PolarHBondContact OE1-NZ 2.83Å; E1110-K1113 WeakPolarHBondContact OE2-CE 3.4Å; E1110-K1113 IonicContact OE2-NZ 2.73Å; E1110-K1113 PolarHBondContact OE2-NZ 3.3Å; E1110-N1114 PolarHBondContact O-N 3Å; E1110-N1114 PolarHBondContact O-ND2 2.89Å |
| 1111 | G | 88.6 | Confident | 87.9 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -55.8 | -42.4 | 166 | 0 | 0 | 0 | 0 | 0 | 112.4 | S1105 G1107 G1108 N1114 L1115 | S1105-G1111 WeakPolarHBondContact CB-O 3.41Å; G1107-G1111 PolarHBondContact O-N 3.46Å; G1108-G1111 PolarHBondContact O-N 3.26Å; G1111-N1114 PolarHBondContact O-N 2.9Å; G1111-L1115 VanDerWaalsContact O-CB 3.24Å; G1111-L1115 WeakPolarHBondContact O-CB 3.29Å; G1111-L1115 PolarHBondContact O-N 2.86Å |
| 1112 | L | 89.6 | Confident | 87.7 | Confident | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.005 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -64.7 | -42.1 | 176.8 | -177.5 | 65.6 | 0 | 0 | 0 | 112.8 | L1102 G1108 I1109 E1110 L1115 V1116 L1143 L1147 L1158 I1162 | L1102-L1112 VanDerWaalsContact CD2-CA 3.48Å; L1102-L1112 HydrophobicContact CD2-CB 3.82Å; L1102-L1112 HydrophobicContact CD2-CD1 4.04Å; G1108-L1112 PolarHBondContact O-N 2.95Å; I1109-L1112 HydrophobicContact CD1-CD2 4.21Å; I1109-L1112 WeakPolarHBondContact O-CB 3.45Å; I1109-L1112 PolarHBondContact O-N 3.42Å; E1110-L1112 VanDerWaalsContact C-N 3.28Å; E1110-L1112 PolarHBondContact O-N 2.82Å; L1112-L1115 PolarHBondContact O-N 2.91Å; L1112-V1116 HydrophobicContact CD1-CG2 4.02Å; L1112-V1116 HydrophobicContact CG-CG2 4.24Å; L1112-V1116 WeakPolarHBondContact O-CB 3.49Å; L1112-V1116 WeakPolarHBondContact O-CG2 3.49Å; L1112-V1116 PolarHBondContact O-N 2.86Å; L1112-L1143 HydrophobicContact CD1-CD1 3.81Å; L1112-L1147 HydrophobicContact CB-CD2 4.12Å; L1112-L1147 HydrophobicContact CD2-CD1 3.72Å; L1112-L1147 HydrophobicContact CD2-CD2 3.87Å; L1112-L1147 HydrophobicContact CD2-CG 4.46Å; L1112-L1147 HydrophobicContact CG-CD2 4.4Å; L1112-L1158 HydrophobicContact CD2-CB 4.44Å; L1112-L1158 HydrophobicContact CD2-CD1 4.16Å; L1112-L1158 HydrophobicContact CD2-CG 4.01Å; L1112-I1162 HydrophobicContact CD2-CD1 3.92Å; L1112-I1162 HydrophobicContact CD2-CG1 4.48Å; L1112-I1162 HydrophobicContact CG-CD1 4.19Å |
| 1113 | K | 88.9 | Confident | 87.6 | Confident | 67 Ų | 67 | 31 Ų | 31 | 29% | 0.291 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.1 | -48.5 | 175.7 | -70.9 | 174.9 | -167.5 | 160 | 0 | 111.4 | I1109 E1110 L1115 V1116 S1117 | I1109-K1113 WeakPolarHBondContact O-CG 3.21Å; I1109-K1113 PolarHBondContact O-N 3.44Å; E1110-K1113 VanDerWaalsContact CD-NZ 3.32Å; E1110-K1113 PolarHBondContact O-N 2.92Å; E1110-K1113 IonicContact OE1-NZ 3.14Å; E1110-K1113 PolarHBondContact OE1-NZ 2.83Å; E1110-K1113 WeakPolarHBondContact OE2-CE 3.4Å; E1110-K1113 IonicContact OE2-NZ 2.73Å; E1110-K1113 PolarHBondContact OE2-NZ 3.3Å; K1113-L1115 VanDerWaalsContact C-N 3.29Å; K1113-L1115 PolarHBondContact O-N 2.71Å; K1113-V1116 PolarHBondContact O-N 3.33Å; K1113-S1117 WeakPolarHBondContact O-CB 3.43Å; K1113-S1117 PolarHBondContact O-N 3.02Å; K1113-S1117 PolarHBondContact O-OG 3.15Å |
| 1114 | N | 89.5 | Confident | 87.6 | Confident | 37 Ų | 37 | 31.2 Ų | 31.2 | 20% | 0.198 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.6 | -43.7 | 178.1 | -67.8 | -20.5 | 0 | 0 | 0 | 110.6 | S1105 E1110 G1111 A1118 | S1105-N1114 PolarHBondContact O-ND2 3.45Å; E1110-N1114 PolarHBondContact O-N 3Å; E1110-N1114 PolarHBondContact O-ND2 2.89Å; G1111-N1114 PolarHBondContact O-N 2.9Å; N1114-A1118 WeakPolarHBondContact O-CB 3.24Å; N1114-A1118 PolarHBondContact O-N 3.33Å |
| 1115 | L | 91.4 | Very high | 87.7 | Confident | 1 Ų | 1 | 30.7 Ų | 30.7 | 1% | 0.005 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.9 | -48.5 | 177 | -171.7 | 64 | 0 | 0 | 0 | 112.8 | L1069 I1073 L1083 L1101 L1102 G1111 L1112 K1113 A1119 I1129 | L1069-L1115 VanDerWaalsContact CD2-CA 3.49Å; L1069-L1115 HydrophobicContact CD2-CB 4.16Å; L1069-L1115 HydrophobicContact CD2-CD1 3.78Å; I1073-L1115 HydrophobicContact CD1-CD1 4.39Å; L1083-L1115 HydrophobicContact CD2-CD1 3.76Å; L1101-L1115 HydrophobicContact CD1-CD1 4.12Å; L1101-L1115 HydrophobicContact CD2-CD1 3.72Å; L1101-L1115 HydrophobicContact CD2-CD2 4.22Å; L1101-L1115 HydrophobicContact CG-CD1 3.83Å; L1101-L1115 HydrophobicContact CG-CD2 4.27Å; L1102-L1115 HydrophobicContact CD2-CD2 3.8Å; L1102-L1115 HydrophobicContact CG-CD2 4.37Å; G1111-L1115 VanDerWaalsContact O-CB 3.24Å; G1111-L1115 WeakPolarHBondContact O-CB 3.29Å; G1111-L1115 PolarHBondContact O-N 2.86Å; L1112-L1115 PolarHBondContact O-N 2.91Å; K1113-L1115 VanDerWaalsContact C-N 3.29Å; K1113-L1115 PolarHBondContact O-N 2.71Å; L1115-A1119 WeakPolarHBondContact O-CB 3.22Å; L1115-A1119 PolarHBondContact O-N 3.09Å; L1115-I1129 HydrophobicContact CB-CD1 4.38Å; L1115-I1129 HydrophobicContact CD2-CD1 3.98Å; L1115-I1129 HydrophobicContact CD2-CG1 4.21Å; L1115-I1129 HydrophobicContact CG-CD1 3.73Å; L1115-I1129 HydrophobicContact CG-CG1 4.1Å |
| 1116 | V | 90.2 | Very high | 87.9 | Confident | 4 Ų | 4 | 30.3 Ų | 30.3 | 2% | 0.024 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -64 | -44.4 | 179.4 | 169.8 | 0 | 0 | 0 | 0 | 111.3 | L1112 K1113 A1119 G1120 G1121 G1125 L1126 I1129 I1162 | L1112-V1116 HydrophobicContact CD1-CG2 4.02Å; L1112-V1116 HydrophobicContact CG-CG2 4.24Å; L1112-V1116 WeakPolarHBondContact O-CB 3.49Å; L1112-V1116 WeakPolarHBondContact O-CG2 3.49Å; L1112-V1116 PolarHBondContact O-N 2.86Å; K1113-V1116 PolarHBondContact O-N 3.33Å; V1116-A1119 PolarHBondContact O-N 3.35Å; V1116-G1120 PolarHBondContact O-N 2.89Å; V1116-G1121 VanDerWaalsContact O-CA 3.27Å; V1116-G1121 WeakPolarHBondContact O-CA 3.26Å; V1116-G1121 PolarHBondContact O-N 3.43Å; V1116-G1125 WeakPolarHBondContact O-CA 3.3Å; V1116-L1126 HydrophobicContact CG1-CG 4.39Å; V1116-L1126 HydrophobicContact CG2-CD2 4.13Å; V1116-L1126 HydrophobicContact CG2-CG 4.22Å; V1116-I1129 HydrophobicContact CB-CD1 4.28Å; V1116-I1129 HydrophobicContact CG2-CD1 3.5Å; V1116-I1129 VanDerWaalsContact CG2-CD1 3.5Å; V1116-I1162 HydrophobicContact CG1-CG2 4.15Å; V1116-I1162 HydrophobicContact CG2-CD1 3.87Å |
| 1117 | S | 89.2 | Confident | 88.3 | Confident | 40 Ų | 40 | 30.3 Ų | 30.3 | 28% | 0.28 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -69.1 | -42.3 | -178.2 | -57.1 | 0 | 0 | 0 | 0 | 112 | E1066 R1070 K1113 G1120 G1121 | E1066-S1117 VanDerWaalsContact OE1-CB 3.26Å; E1066-S1117 WeakPolarHBondContact OE1-CB 3.37Å; E1066-S1117 VanDerWaalsContact OE2-CB 3.25Å; E1066-S1117 WeakPolarHBondContact OE2-CB 3.38Å; R1070-S1117 PolarHBondContact NH2-O 3.19Å; K1113-S1117 WeakPolarHBondContact O-CB 3.43Å; K1113-S1117 PolarHBondContact O-N 3.02Å; K1113-S1117 PolarHBondContact O-OG 3.15Å; S1117-G1120 PolarHBondContact O-N 3.48Å; S1117-G1121 PolarHBondContact O-N 2.87Å |
| 1118 | A | 90.1 | Very high | 88.9 | Confident | 5 Ų | 5 | 29.6 Ų | 29.6 | 4% | 0.041 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.8 | -38.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | E1066 L1069 R1070 I1073 N1114 G1120 | E1066-A1118 HydrophobicContact CG-CB 4.14Å; L1069-A1118 HydrophobicContact CB-CB 3.84Å; L1069-A1118 HydrophobicContact CD2-CB 3.86Å; L1069-A1118 HydrophobicContact CG-CB 4.22Å; R1070-A1118 HydrophobicContact CB-CB 4.02Å; I1073-A1118 HydrophobicContact CD1-CB 4.07Å; N1114-A1118 WeakPolarHBondContact O-CB 3.24Å; N1114-A1118 PolarHBondContact O-N 3.33Å; A1118-G1120 PolarHBondContact O-N 3.25Å; A1118-G1120 VanDerWaalsContact O-N 3.14Å |
| 1119 | A | 90.7 | Very high | 89.4 | Confident | 5 Ų | 5 | 27.9 Ų | 27.9 | 4% | 0.041 | 17% | 0.167 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.2 | 0.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | L1083 L1115 V1116 N1128 I1129 | L1083-A1119 HydrophobicContact CD1-CB 3.84Å; L1115-A1119 WeakPolarHBondContact O-CB 3.22Å; L1115-A1119 PolarHBondContact O-N 3.09Å; V1116-A1119 PolarHBondContact O-N 3.35Å; A1119-N1128 HydrophobicContact CB-CB 4.38Å; A1119-N1128 PolarHBondContact O-ND2 2.67Å; A1119-I1129 HydrophobicContact CB-CD1 4.45Å; A1119-I1129 HydrophobicContact CB-CG1 4.28Å |
| 1120 | G | 88.6 | Confident | 89.9 | Confident | 43 Ų | 43 | 25.7 Ų | 25.7 | 44% | 0.443 | 16% | 0.155 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 129.6 | -14.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | V1116 S1117 A1118 | V1116-G1120 PolarHBondContact O-N 2.89Å; S1117-G1120 PolarHBondContact O-N 3.48Å; A1118-G1120 PolarHBondContact O-N 3.25Å; A1118-G1120 VanDerWaalsContact O-N 3.14Å |
| 1121 | G | 86.7 | Confident | 90.3 | Very high | 24 Ų | 24 | 25.3 Ų | 25.3 | 25% | 0.247 | 15% | 0.154 | C | C | . | . | S | Bend | trans | 80.2 | 156.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | V1116 S1117 A1123 E1124 G1125 | V1116-G1121 VanDerWaalsContact O-CA 3.27Å; V1116-G1121 WeakPolarHBondContact O-CA 3.26Å; V1116-G1121 PolarHBondContact O-N 3.43Å; S1117-G1121 PolarHBondContact O-N 2.87Å; G1121-A1123 PolarHBondContact O-N 3.07Å; G1121-E1124 PolarHBondContact O-N 3.15Å; G1121-G1125 PolarHBondContact O-N 3.43Å |
| 1122 | G | 86.7 | Confident | 90.5 | Very high | 26 Ų | 26 | 26 Ų | 26 | 27% | 0.268 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | 52.8 | -131.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | L1126 N1168 | G1122-L1126 PolarHBondContact O-N 3.21Å; G1122-N1168 WeakPolarHBondContact CA-ND2 3.26Å |
| 1123 | A | 87.2 | Confident | 90.7 | Very high | 23 Ų | 23 | 26 Ų | 26 | 19% | 0.19 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -65 | -40.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | G1121 L1126 K1127 N1168 T1171 | G1121-A1123 PolarHBondContact O-N 3.07Å; A1123-L1126 PolarHBondContact O-N 2.87Å; A1123-K1127 VanDerWaalsContact O-CB 3.26Å; A1123-K1127 WeakPolarHBondContact O-CB 3.39Å; A1123-K1127 PolarHBondContact O-N 2.66Å; A1123-N1168 HydrophobicContact CB-CB 4.07Å; A1123-N1168 PolarHBondContact N-ND2 3.03Å; A1123-T1171 HydrophobicContact CB-CG2 4.11Å |
| 1124 | E | 89.5 | Confident | 90.7 | Very high | 92 Ų | 92 | 25.4 Ų | 25.4 | 43% | 0.43 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -74.1 | -37.1 | -174.7 | -167.3 | 60.6 | -157.4 | 0 | 0 | 111.4 | G1121 K1127 N1128 | G1121-E1124 PolarHBondContact O-N 3.15Å; E1124-K1127 PolarHBondContact O-N 3Å; E1124-K1127 IonicContact OE1-NZ 2.65Å; E1124-K1127 PolarHBondContact OE1-NZ 3.43Å; E1124-K1127 IonicContact OE2-NZ 2.68Å; E1124-N1128 WeakPolarHBondContact O-CB 3.46Å; E1124-N1128 VanDerWaalsContact O-CG 3.29Å; E1124-N1128 PolarHBondContact O-N 2.81Å; E1124-N1128 PolarHBondContact O-ND2 3.35Å |
| 1125 | G | 91.1 | Very high | 90.6 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.4 | -47.1 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | V1116 G1121 N1128 I1129 | V1116-G1125 WeakPolarHBondContact O-CA 3.3Å; G1121-G1125 PolarHBondContact O-N 3.43Å; G1125-N1128 PolarHBondContact O-N 3.45Å; G1125-I1129 WeakPolarHBondContact O-CD1 3.17Å; G1125-I1129 VanDerWaalsContact O-CG1 3.28Å; G1125-I1129 WeakPolarHBondContact O-CG1 3.36Å; G1125-I1129 PolarHBondContact O-N 3.46Å; G1125-I1129 VanDerWaalsContact O-N 3.15Å |
| 1126 | L | 92 | Very high | 90.5 | Very high | 1 Ų | 1 | 26 Ų | 26 | 1% | 0.005 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -62.5 | -41.2 | 173.9 | -87.9 | 170.8 | 0 | 0 | 0 | 112.6 | V1116 G1122 A1123 I1129 I1130 L1143 I1162 N1168 L1169 A1172 | V1116-L1126 HydrophobicContact CG1-CG 4.39Å; V1116-L1126 HydrophobicContact CG2-CD2 4.13Å; V1116-L1126 HydrophobicContact CG2-CG 4.22Å; G1122-L1126 PolarHBondContact O-N 3.21Å; A1123-L1126 PolarHBondContact O-N 2.87Å; L1126-I1129 PolarHBondContact O-N 3.45Å; L1126-I1130 WeakPolarHBondContact O-CG1 3.46Å; L1126-I1130 PolarHBondContact O-N 2.96Å; L1126-L1143 HydrophobicContact CD2-CD2 4.06Å; L1126-I1162 HydrophobicContact CD1-CD1 3.99Å; L1126-I1162 HydrophobicContact CD1-CG2 4.13Å; L1126-I1162 HydrophobicContact CD2-CD1 3.71Å; L1126-I1162 HydrophobicContact CG-CD1 4.02Å; L1126-N1168 HydrophobicContact CD1-CB 4.24Å; L1126-L1169 HydrophobicContact CD1-CD1 4.25Å; L1126-L1169 HydrophobicContact CD2-CD1 4.35Å; L1126-A1172 HydrophobicContact CB-CB 3.56Å |
| 1127 | K | 92.7 | Very high | 90.7 | Very high | 56 Ų | 56 | 28 Ų | 28 | 24% | 0.243 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -61.6 | -49 | 177.6 | 175.1 | 175.5 | 147.7 | -65.8 | 0 | 110.8 | A1123 E1124 I1129 I1130 E1131 A1172 | A1123-K1127 VanDerWaalsContact O-CB 3.26Å; A1123-K1127 WeakPolarHBondContact O-CB 3.39Å; A1123-K1127 PolarHBondContact O-N 2.66Å; E1124-K1127 PolarHBondContact O-N 3Å; E1124-K1127 IonicContact OE1-NZ 2.65Å; E1124-K1127 PolarHBondContact OE1-NZ 3.43Å; E1124-K1127 IonicContact OE2-NZ 2.68Å; K1127-I1129 VanDerWaalsContact C-N 3.26Å; K1127-I1129 PolarHBondContact O-N 3.28Å; K1127-I1130 PolarHBondContact O-N 3.18Å; K1127-E1131 WeakPolarHBondContact CE-OE1 3.47Å; K1127-E1131 HydrophobicContact CG-CG 4.23Å; K1127-E1131 IonicContact NZ-OE1 2.61Å; K1127-E1131 IonicContact NZ-OE2 2.88Å; K1127-E1131 PolarHBondContact NZ-OE2 3.42Å; K1127-E1131 WeakPolarHBondContact O-CB 3.43Å; K1127-E1131 WeakPolarHBondContact O-CG 3.49Å; K1127-E1131 PolarHBondContact O-N 2.7Å; K1127-A1172 HydrophobicContact CB-CB 4.05Å |
| 1128 | N | 93.7 | Very high | 90.8 | Very high | 14 Ų | 14 | 31.1 Ų | 31.1 | 8% | 0.075 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.7 | -36.6 | 178.6 | -77.1 | -36.4 | 0 | 0 | 0 | 112.3 | A1080 L1083 A1119 E1124 G1125 A1132 | A1080-N1128 HydrophobicContact CB-CB 4.32Å; A1080-N1128 WeakPolarHBondContact CB-OD1 3.37Å; A1080-N1128 VanDerWaalsContact N-CG 3.33Å; A1080-N1128 PolarHBondContact N-OD1 3Å; L1083-N1128 HydrophobicContact CD1-CB 3.92Å; A1119-N1128 HydrophobicContact CB-CB 4.38Å; A1119-N1128 PolarHBondContact O-ND2 2.67Å; E1124-N1128 WeakPolarHBondContact O-CB 3.46Å; E1124-N1128 VanDerWaalsContact O-CG 3.29Å; E1124-N1128 PolarHBondContact O-N 2.81Å; E1124-N1128 PolarHBondContact O-ND2 3.35Å; G1125-N1128 PolarHBondContact O-N 3.45Å; N1128-A1132 VanDerWaalsContact O-CB 3.26Å; N1128-A1132 WeakPolarHBondContact O-CB 3.37Å; N1128-A1132 PolarHBondContact O-N 3.46Å; N1128-A1132 VanDerWaalsContact O-N 3.09Å |
| 1129 | I | 93.9 | Very high | 90.9 | Very high | 3 Ų | 3 | 30.9 Ų | 30.9 | 2% | 0.015 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -69.3 | -47.6 | 173.8 | -65 | 161.6 | 0 | 0 | 0 | 111.2 | L1083 L1098 L1115 V1116 A1119 G1125 L1126 K1127 A1132 A1133 L1143 | L1083-I1129 HydrophobicContact CD1-CG1 3.86Å; L1098-I1129 HydrophobicContact CD2-CG2 4.31Å; L1115-I1129 HydrophobicContact CB-CD1 4.38Å; L1115-I1129 HydrophobicContact CD2-CD1 3.98Å; L1115-I1129 HydrophobicContact CD2-CG1 4.21Å; L1115-I1129 HydrophobicContact CG-CD1 3.73Å; L1115-I1129 HydrophobicContact CG-CG1 4.1Å; V1116-I1129 HydrophobicContact CB-CD1 4.28Å; V1116-I1129 HydrophobicContact CG2-CD1 3.5Å; V1116-I1129 VanDerWaalsContact CG2-CD1 3.5Å; A1119-I1129 HydrophobicContact CB-CD1 4.45Å; A1119-I1129 HydrophobicContact CB-CG1 4.28Å; G1125-I1129 WeakPolarHBondContact O-CD1 3.17Å; G1125-I1129 VanDerWaalsContact O-CG1 3.28Å; G1125-I1129 WeakPolarHBondContact O-CG1 3.36Å; G1125-I1129 PolarHBondContact O-N 3.46Å; G1125-I1129 VanDerWaalsContact O-N 3.15Å; L1126-I1129 PolarHBondContact O-N 3.45Å; K1127-I1129 VanDerWaalsContact C-N 3.26Å; K1127-I1129 PolarHBondContact O-N 3.28Å; I1129-A1132 PolarHBondContact O-N 3.29Å; I1129-A1133 WeakPolarHBondContact O-CB 3.39Å; I1129-A1133 PolarHBondContact O-N 2.86Å; I1129-L1143 HydrophobicContact CG2-CD1 4.02Å; I1129-L1143 HydrophobicContact CG2-CD2 4.34Å |
| 1130 | I | 93.3 | Very high | 91.1 | Very high | 1 Ų | 1 | 30.7 Ų | 30.7 | 1% | 0.005 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -64 | -42.8 | 179.7 | -72 | 173.8 | 0 | 0 | 0 | 111 | L1126 K1127 A1133 G1134 G1135 G1139 L1140 L1143 L1169 A1172 | L1126-I1130 WeakPolarHBondContact O-CG1 3.46Å; L1126-I1130 PolarHBondContact O-N 2.96Å; K1127-I1130 PolarHBondContact O-N 3.18Å; I1130-A1133 PolarHBondContact O-N 3.42Å; I1130-G1134 PolarHBondContact O-N 2.91Å; I1130-G1135 VanDerWaalsContact O-CA 3.32Å; I1130-G1135 WeakPolarHBondContact O-CA 3.29Å; I1130-G1135 PolarHBondContact O-N 3.45Å; I1130-G1139 WeakPolarHBondContact O-CA 3.46Å; I1130-L1140 HydrophobicContact CD1-CB 4.49Å; I1130-L1140 HydrophobicContact CD1-CD1 3.92Å; I1130-L1143 HydrophobicContact CD1-CD2 4.37Å; I1130-L1143 HydrophobicContact CG1-CD2 3.95Å; I1130-L1169 HydrophobicContact CD1-CD1 4.4Å; I1130-A1172 HydrophobicContact CD1-CB 3.99Å |
| 1131 | E | 93.8 | Very high | 91.3 | Very high | 89 Ų | 89 | 32.3 Ų | 32.3 | 42% | 0.416 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -61.4 | -48.9 | 175.8 | -73.8 | 176.4 | 169 | 0 | 0 | 111.4 | A1080 K1127 A1133 G1134 G1135 | A1080-E1131 HydrophobicContact CB-CB 4.01Å; K1127-E1131 WeakPolarHBondContact CE-OE1 3.47Å; K1127-E1131 HydrophobicContact CG-CG 4.23Å; K1127-E1131 IonicContact NZ-OE1 2.61Å; K1127-E1131 IonicContact NZ-OE2 2.88Å; K1127-E1131 PolarHBondContact NZ-OE2 3.42Å; K1127-E1131 WeakPolarHBondContact O-CB 3.43Å; K1127-E1131 WeakPolarHBondContact O-CG 3.49Å; K1127-E1131 PolarHBondContact O-N 2.7Å; E1131-A1133 VanDerWaalsContact C-N 3.27Å; E1131-A1133 PolarHBondContact O-N 3.32Å; E1131-G1134 PolarHBondContact O-N 3.41Å; E1131-G1134 VanDerWaalsContact O-N 3.15Å; E1131-G1135 PolarHBondContact O-N 3.06Å |
| 1132 | A | 92.6 | Very high | 91.6 | Very high | 13 Ų | 13 | 32.4 Ų | 32.4 | 11% | 0.107 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.8 | -29.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | L1083 T1084 L1087 N1128 I1129 G1134 | L1083-A1132 HydrophobicContact CB-CB 3.48Å; L1083-A1132 VanDerWaalsContact CB-CB 3.48Å; T1084-A1132 WeakPolarHBondContact OG1-CA 3.27Å; L1087-A1132 HydrophobicContact CD1-CB 4.02Å; N1128-A1132 VanDerWaalsContact O-CB 3.26Å; N1128-A1132 WeakPolarHBondContact O-CB 3.37Å; N1128-A1132 PolarHBondContact O-N 3.46Å; N1128-A1132 VanDerWaalsContact O-N 3.09Å; I1129-A1132 PolarHBondContact O-N 3.29Å; A1132-G1134 VanDerWaalsContact C-N 3.25Å; A1132-G1134 PolarHBondContact O-N 3.04Å |
| 1133 | A | 92.4 | Very high | 91.9 | Very high | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.008 | 18% | 0.181 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.9 | 2.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | T1094 L1098 I1129 I1130 E1131 G1139 N1142 | T1094-A1133 HydrophobicContact CG2-CB 4.32Å; T1094-A1133 WeakPolarHBondContact CG2-O 3.36Å; L1098-A1133 HydrophobicContact CD1-CB 3.95Å; I1129-A1133 WeakPolarHBondContact O-CB 3.39Å; I1129-A1133 PolarHBondContact O-N 2.86Å; I1130-A1133 PolarHBondContact O-N 3.42Å; E1131-A1133 VanDerWaalsContact C-N 3.27Å; E1131-A1133 PolarHBondContact O-N 3.32Å; A1133-G1139 WeakPolarHBondContact O-CA 3.12Å; A1133-N1142 HydrophobicContact CB-CB 4.17Å; A1133-N1142 PolarHBondContact O-ND2 3.25Å |
| 1134 | G | 90.4 | Very high | 92.2 | Very high | 56 Ų | 56 | 30.1 Ų | 30.1 | 58% | 0.577 | 17% | 0.173 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 123.4 | -7.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | I1130 E1131 A1132 | I1130-G1134 PolarHBondContact O-N 2.91Å; E1131-G1134 PolarHBondContact O-N 3.41Å; E1131-G1134 VanDerWaalsContact O-N 3.15Å; A1132-G1134 VanDerWaalsContact C-N 3.25Å; A1132-G1134 PolarHBondContact O-N 3.04Å |
| 1135 | G | 87.4 | Confident | 92.3 | Very high | 24 Ų | 24 | 27.6 Ų | 27.6 | 25% | 0.247 | 17% | 0.165 | C | C | . | . | S | Bend | trans | 80.5 | 151.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | I1130 E1131 L1137 E1138 G1139 | I1130-G1135 VanDerWaalsContact O-CA 3.32Å; I1130-G1135 WeakPolarHBondContact O-CA 3.29Å; I1130-G1135 PolarHBondContact O-N 3.45Å; E1131-G1135 PolarHBondContact O-N 3.06Å; G1135-L1137 PolarHBondContact O-N 2.83Å; G1135-E1138 PolarHBondContact O-N 3.4Å; G1135-E1138 VanDerWaalsContact O-N 3.16Å; G1135-G1139 PolarHBondContact O-N 2.74Å |
| 1136 | G | 89 | Confident | 92.2 | Very high | 27 Ų | 27 | 28.1 Ų | 28.1 | 28% | 0.278 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | 49 | -127.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | L1140 | G1136-L1140 WeakPolarHBondContact O-CB 3.36Å; G1136-L1140 PolarHBondContact O-N 2.92Å; G1136-L1140 VanDerWaalsContact O-N 3.12Å |
| 1137 | L | 92.8 | Very high | 92.1 | Very high | 46 Ų | 46 | 29.8 Ų | 29.8 | 24% | 0.241 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -60.1 | -43 | 178.9 | 177.5 | 57.5 | 0 | 0 | 0 | 113.5 | G1135 L1140 K1141 N1182 D1185 A1186 | G1135-L1137 PolarHBondContact O-N 2.83Å; L1137-L1140 PolarHBondContact O-N 2.82Å; L1137-K1141 HydrophobicContact CD1-CD 4.2Å; L1137-K1141 HydrophobicContact CD1-CG 4.24Å; L1137-K1141 HydrophobicContact CG-CD 4.28Å; L1137-K1141 WeakPolarHBondContact O-CB 3.35Å; L1137-K1141 WeakPolarHBondContact O-CG 3.32Å; L1137-K1141 PolarHBondContact O-N 3.1Å; L1137-N1182 HydrophobicContact CB-CB 4.45Å; L1137-N1182 WeakPolarHBondContact CD1-O 3.41Å; L1137-D1185 VanDerWaalsContact CD1-C 3.48Å; L1137-D1185 HydrophobicContact CD1-CB 3.61Å; L1137-D1185 HydrophobicContact CD2-CB 3.86Å; L1137-D1185 HydrophobicContact CG-CB 4.41Å; L1137-A1186 HydrophobicContact CD1-CB 3.95Å |
| 1138 | E | 92.6 | Very high | 91.9 | Very high | 105 Ų | 105 | 28.4 Ų | 28.4 | 49% | 0.491 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -74.9 | -41.6 | -172.6 | -163.8 | 61.8 | -165.2 | 0 | 0 | 111.1 | G1135 L1140 K1141 N1142 | G1135-E1138 PolarHBondContact O-N 3.4Å; G1135-E1138 VanDerWaalsContact O-N 3.16Å; E1138-L1140 VanDerWaalsContact C-N 3.32Å; E1138-L1140 PolarHBondContact O-N 3.43Å; E1138-K1141 PolarHBondContact O-N 3.32Å; E1138-N1142 WeakPolarHBondContact O-CB 3.22Å; E1138-N1142 PolarHBondContact O-N 3.29Å; E1138-N1142 PolarHBondContact O-ND2 2.67Å |
| 1139 | G | 92.8 | Very high | 91.5 | Very high | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -59.2 | -41.2 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | I1130 A1133 G1135 L1143 | I1130-G1139 WeakPolarHBondContact O-CA 3.46Å; A1133-G1139 WeakPolarHBondContact O-CA 3.12Å; G1135-G1139 PolarHBondContact O-N 2.74Å; G1139-L1143 WeakPolarHBondContact O-CB 3.24Å; G1139-L1143 PolarHBondContact O-N 3.31Å |
| 1140 | L | 93.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -68.1 | -39 | 176.3 | -176.3 | 66.5 | 0 | 0 | 0 | 112.3 | I1130 G1136 L1137 E1138 L1143 L1144 L1169 L1183 A1186 | I1130-L1140 HydrophobicContact CD1-CB 4.49Å; I1130-L1140 HydrophobicContact CD1-CD1 3.92Å; G1136-L1140 WeakPolarHBondContact O-CB 3.36Å; G1136-L1140 PolarHBondContact O-N 2.92Å; G1136-L1140 VanDerWaalsContact O-N 3.12Å; L1137-L1140 PolarHBondContact O-N 2.82Å; E1138-L1140 VanDerWaalsContact C-N 3.32Å; E1138-L1140 PolarHBondContact O-N 3.43Å; L1140-L1143 PolarHBondContact O-N 2.9Å; L1140-L1144 HydrophobicContact CD1-CG 4.46Å; L1140-L1144 HydrophobicContact CG-CD1 4.31Å; L1140-L1144 WeakPolarHBondContact O-CG 3.15Å; L1140-L1144 PolarHBondContact O-N 3.41Å; L1140-L1169 HydrophobicContact CD1-CD1 3.97Å; L1140-L1183 HydrophobicContact CD1-CD1 4.48Å; L1140-L1183 HydrophobicContact CD2-CD1 3.66Å; L1140-L1183 HydrophobicContact CD2-CG 4.41Å; L1140-A1186 HydrophobicContact CB-CB 4.48Å; L1140-A1186 HydrophobicContact CD2-CB 3.58Å; L1140-A1186 HydrophobicContact CG-CB 3.89Å |
| 1141 | K | 93.7 | Very high | 91.2 | Very high | 77 Ų | 77 | 42.6 Ų | 42.6 | 34% | 0.335 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64 | -45.7 | 174.3 | -81.5 | 177.7 | 173.3 | 175.8 | 0 | 112.1 | L1137 E1138 L1143 L1144 S1145 D1185 A1186 | L1137-K1141 HydrophobicContact CD1-CD 4.2Å; L1137-K1141 HydrophobicContact CD1-CG 4.24Å; L1137-K1141 HydrophobicContact CG-CD 4.28Å; L1137-K1141 WeakPolarHBondContact O-CB 3.35Å; L1137-K1141 WeakPolarHBondContact O-CG 3.32Å; L1137-K1141 PolarHBondContact O-N 3.1Å; E1138-K1141 PolarHBondContact O-N 3.32Å; K1141-L1143 VanDerWaalsContact C-N 3.33Å; K1141-L1143 PolarHBondContact O-N 3.37Å; K1141-L1144 PolarHBondContact O-N 2.89Å; K1141-S1145 WeakPolarHBondContact O-CB 3.49Å; K1141-S1145 PolarHBondContact O-N 2.8Å; K1141-S1145 PolarHBondContact O-OG 3.36Å; K1141-D1185 WeakPolarHBondContact CE-O 3.39Å; K1141-A1186 HydrophobicContact CG-CB 4.1Å |
| 1142 | N | 93.6 | Very high | 91 | Very high | 26 Ų | 26 | 39.9 Ų | 39.9 | 14% | 0.139 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60.9 | -43.5 | 175.9 | -75.2 | -36.5 | 0 | 0 | 0 | 110.9 | A1133 E1138 S1145 S1146 | A1133-N1142 HydrophobicContact CB-CB 4.17Å; A1133-N1142 PolarHBondContact O-ND2 3.25Å; E1138-N1142 WeakPolarHBondContact O-CB 3.22Å; E1138-N1142 PolarHBondContact O-N 3.29Å; E1138-N1142 PolarHBondContact O-ND2 2.67Å; N1142-S1145 PolarHBondContact O-N 3.02Å; N1142-S1146 WeakPolarHBondContact O-CB 3.48Å; N1142-S1146 PolarHBondContact O-N 2.88Å; N1142-S1146 PolarHBondContact O-OG 3.44Å |
| 1143 | L | 92.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.2 | -54.8 | 174.3 | 178.5 | 57.1 | 0 | 0 | 0 | 112.4 | L1098 L1112 L1126 I1129 I1130 G1139 L1140 K1141 S1145 S1146 L1147 L1158 | L1098-L1143 HydrophobicContact CD2-CB 4.24Å; L1098-L1143 HydrophobicContact CD2-CD1 3.79Å; L1112-L1143 HydrophobicContact CD1-CD1 3.81Å; L1126-L1143 HydrophobicContact CD2-CD2 4.06Å; I1129-L1143 HydrophobicContact CG2-CD1 4.02Å; I1129-L1143 HydrophobicContact CG2-CD2 4.34Å; I1130-L1143 HydrophobicContact CD1-CD2 4.37Å; I1130-L1143 HydrophobicContact CG1-CD2 3.95Å; G1139-L1143 WeakPolarHBondContact O-CB 3.24Å; G1139-L1143 PolarHBondContact O-N 3.31Å; L1140-L1143 PolarHBondContact O-N 2.9Å; K1141-L1143 VanDerWaalsContact C-N 3.33Å; K1141-L1143 PolarHBondContact O-N 3.37Å; L1143-S1145 VanDerWaalsContact C-N 3.31Å; L1143-S1145 PolarHBondContact O-N 2.89Å; L1143-S1146 PolarHBondContact O-N 3.49Å; L1143-S1146 PolarHBondContact O-OG 3.34Å; L1143-L1147 HydrophobicContact CD1-CD1 4.21Å; L1143-L1147 HydrophobicContact CG-CD1 4.45Å; L1143-L1147 WeakPolarHBondContact O-CG 3.39Å; L1143-L1147 PolarHBondContact O-N 3.15Å; L1143-L1158 HydrophobicContact CD2-CD1 3.99Å; L1143-L1158 HydrophobicContact CG-CD1 4.22Å |
| 1144 | L | 92.3 | Very high | 90.8 | Very high | 2 Ų | 2 | 44.1 Ų | 44.1 | 1% | 0.01 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.5 | -39.1 | -179.9 | -69.5 | 176.6 | 0 | 0 | 0 | 112.4 | L1140 K1141 S1146 L1147 S1154 L1155 L1158 A1186 V1187 | L1140-L1144 HydrophobicContact CD1-CG 4.46Å; L1140-L1144 HydrophobicContact CG-CD1 4.31Å; L1140-L1144 WeakPolarHBondContact O-CG 3.15Å; L1140-L1144 PolarHBondContact O-N 3.41Å; K1141-L1144 PolarHBondContact O-N 2.89Å; L1144-S1146 VanDerWaalsContact C-N 3.32Å; L1144-S1146 PolarHBondContact O-N 3.43Å; L1144-L1147 PolarHBondContact O-N 3.31Å; L1144-S1154 VanDerWaalsContact O-CB 3.3Å; L1144-S1154 WeakPolarHBondContact O-CB 3.2Å; L1144-S1154 PolarHBondContact O-OG 3Å; L1144-L1155 HydrophobicContact CD2-CB 3.93Å; L1144-L1158 HydrophobicContact CD2-CD1 4.4Å; L1144-A1186 HydrophobicContact CD1-CB 4.04Å; L1144-V1187 HydrophobicContact CD1-CG1 3.71Å |
| 1145 | S | 91.5 | Very high | 90.9 | Very high | 38 Ų | 38 | 41.5 Ų | 41.5 | 27% | 0.266 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -71.4 | -25.1 | -179.4 | -52.9 | 0 | 0 | 0 | 0 | 113.2 | K1095 K1141 N1142 L1143 L1147 | K1095-S1145 WeakPolarHBondContact CE-O 3.48Å; K1095-S1145 PolarHBondContact NZ-O 2.98Å; K1141-S1145 WeakPolarHBondContact O-CB 3.49Å; K1141-S1145 PolarHBondContact O-N 2.8Å; K1141-S1145 PolarHBondContact O-OG 3.36Å; N1142-S1145 PolarHBondContact O-N 3.02Å; L1143-S1145 VanDerWaalsContact C-N 3.31Å; L1143-S1145 PolarHBondContact O-N 2.89Å; S1145-L1147 VanDerWaalsContact C-N 3.31Å |
| 1146 | S | 90.9 | Very high | 91 | Very high | 11 Ų | 11 | 44 Ų | 44 | 8% | 0.077 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -80.3 | -10.1 | 174.8 | 71.7 | 0 | 0 | 0 | 0 | 114.2 | L1098 L1102 N1142 L1143 L1144 | L1098-S1146 WeakPolarHBondContact CD2-OG 3.37Å; L1102-S1146 WeakPolarHBondContact CD1-OG 3.17Å; N1142-S1146 WeakPolarHBondContact O-CB 3.48Å; N1142-S1146 PolarHBondContact O-N 2.88Å; N1142-S1146 PolarHBondContact O-OG 3.44Å; L1143-S1146 PolarHBondContact O-N 3.49Å; L1143-S1146 PolarHBondContact O-OG 3.34Å; L1144-S1146 VanDerWaalsContact C-N 3.32Å; L1144-S1146 PolarHBondContact O-N 3.43Å |
| 1147 | L | 89.1 | Confident | 90.9 | Very high | 36 Ų | 36 | 44.7 Ų | 44.7 | 19% | 0.188 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -98.4 | -15.5 | 177.4 | -64.2 | 167.1 | 0 | 0 | 0 | 112.5 | L1102 L1112 L1143 L1144 S1145 L1158 | L1102-L1147 HydrophobicContact CD1-CD2 3.89Å; L1102-L1147 HydrophobicContact CD1-CG 4.49Å; L1112-L1147 HydrophobicContact CB-CD2 4.12Å; L1112-L1147 HydrophobicContact CD2-CD1 3.72Å; L1112-L1147 HydrophobicContact CD2-CD2 3.87Å; L1112-L1147 HydrophobicContact CD2-CG 4.46Å; L1112-L1147 HydrophobicContact CG-CD2 4.4Å; L1143-L1147 HydrophobicContact CD1-CD1 4.21Å; L1143-L1147 HydrophobicContact CG-CD1 4.45Å; L1143-L1147 WeakPolarHBondContact O-CG 3.39Å; L1143-L1147 PolarHBondContact O-N 3.15Å; L1144-L1147 PolarHBondContact O-N 3.31Å; S1145-L1147 VanDerWaalsContact C-N 3.31Å; L1147-L1158 HydrophobicContact CD1-CB 4.47Å; L1147-L1158 HydrophobicContact CD1-CD1 3.94Å |
| 1148 | G | 87.8 | Confident | 90.7 | Very high | 27 Ų | 27 | 42.6 Ų | 42.6 | 28% | 0.278 | 23% | 0.227 | S | C | . | . | trans | 159.2 | 160 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112 | E1150 S1154 | G1148-E1150 PolarHBondContact O-N 3.17Å; G1148-S1154 PolarHBondContact N-OG 2.8Å; G1148-S1154 PolarHBondContact O-OG 3.32Å | ||
| 1149 | D | 85.8 | Confident | 90.5 | Very high | 143 Ų | 143 | 38.5 Ų | 38.5 | 77% | 0.765 | 21% | 0.208 | S | C | * | . | S | Bend | trans | -75.4 | -7.7 | -175.3 | -56.1 | -55.5 | 0 | 0 | 0 | 114.4 | K1095 P1151 | K1095-D1149 IonicContact NZ-OD1 3.69Å; D1149-P1151 WeakPolarHBondContact O-CD 3.39Å |
| 1150 | E | 91.1 | Very high | 89.9 | Confident | 133 Ų | 133 | 43.8 Ų | 43.8 | 62% | 0.621 | 24% | 0.24 | S | C | * | . | trans | -110.1 | 97.3 | 179.3 | -82.9 | -71.2 | 179.7 | 0 | 0 | 110.6 | G1148 V1152 E1153 S1154 | G1148-E1150 PolarHBondContact O-N 3.17Å; E1150-V1152 PolarHBondContact O-N 2.91Å; E1150-E1153 PolarHBondContact O-N 2.88Å; E1150-E1153 VanDerWaalsContact O-N 3.14Å; E1150-S1154 PolarHBondContact O-N 3.42Å; E1150-S1154 PolarHBondContact O-OG 3.31Å | ||
| 1151 | P | 89.8 | Confident | 89 | Confident | 41 Ų | 41 | 45.4 Ų | 45.4 | 27% | 0.266 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -58.2 | -27 | -169.4 | -27.7 | 35.6 | 0 | 0 | 0 | 114.9 | D1149 L1155 V1187 | D1149-P1151 WeakPolarHBondContact O-CD 3.39Å; P1151-L1155 WeakPolarHBondContact O-CB 3.46Å; P1151-L1155 PolarHBondContact O-N 3.03Å; P1151-V1187 HydrophobicContact CB-CG1 4.08Å |
| 1152 | V | 90.4 | Very high | 87.9 | Confident | 32 Ų | 32 | 42.6 Ų | 42.6 | 19% | 0.194 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -75.8 | -41.4 | -178.9 | -170.6 | 0 | 0 | 0 | 0 | 111.7 | E1150 L1155 K1156 N1196 | E1150-V1152 PolarHBondContact O-N 2.91Å; V1152-L1155 PolarHBondContact O-N 3.35Å; V1152-K1156 VanDerWaalsContact O-CB 3.24Å; V1152-K1156 WeakPolarHBondContact O-CB 3.33Å; V1152-K1156 PolarHBondContact O-N 3.41Å; V1152-N1196 HydrophobicContact CG1-CB 4.24Å; V1152-N1196 HydrophobicContact CG2-CB 3.9Å |
| 1153 | E | 90.3 | Very high | 86.3 | Confident | 97 Ų | 97 | 44.2 Ų | 44.2 | 45% | 0.453 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -75.8 | -32 | 174.8 | -70.9 | -65.4 | 142.5 | 0 | 0 | 111.3 | E1150 K1156 S1157 | E1150-E1153 PolarHBondContact O-N 2.88Å; E1150-E1153 VanDerWaalsContact O-N 3.14Å; E1153-K1156 IonicContact OE1-NZ 3.56Å; E1153-K1156 PolarHBondContact OE1-NZ 3.17Å; E1153-K1156 IonicContact OE2-NZ 2.71Å; E1153-K1156 PolarHBondContact OE2-NZ 2.97Å; E1153-S1157 VanDerWaalsContact O-CB 3.26Å; E1153-S1157 WeakPolarHBondContact O-CB 3.37Å; E1153-S1157 PolarHBondContact O-N 2.87Å; E1153-S1157 PolarHBondContact O-OG 3.4Å |
| 1154 | S | 90.6 | Very high | 84.9 | Confident | 6 Ų | 6 | 46.8 Ų | 46.8 | 4% | 0.042 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -59.4 | -48.2 | 166.6 | -67 | 0 | 0 | 0 | 0 | 111.6 | L1144 G1148 E1150 S1157 L1158 | L1144-S1154 VanDerWaalsContact O-CB 3.3Å; L1144-S1154 WeakPolarHBondContact O-CB 3.2Å; L1144-S1154 PolarHBondContact O-OG 3Å; G1148-S1154 PolarHBondContact N-OG 2.8Å; G1148-S1154 PolarHBondContact O-OG 3.32Å; E1150-S1154 PolarHBondContact O-N 3.42Å; E1150-S1154 PolarHBondContact O-OG 3.31Å; S1154-S1157 PolarHBondContact O-N 2.7Å; S1154-L1158 WeakPolarHBondContact O-CB 3.29Å; S1154-L1158 PolarHBondContact O-N 3.15Å |
| 1155 | L | 91.7 | Very high | 84.2 | Confident | 1 Ų | 1 | 47.9 Ų | 47.9 | 1% | 0.005 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -61.3 | -47.4 | 177.7 | 172.8 | 63.3 | 0 | 0 | 0 | 111.7 | L1144 P1151 V1152 S1157 L1158 L1159 L1169 V1187 L1197 A1200 | L1144-L1155 HydrophobicContact CD2-CB 3.93Å; P1151-L1155 WeakPolarHBondContact O-CB 3.46Å; P1151-L1155 PolarHBondContact O-N 3.03Å; V1152-L1155 PolarHBondContact O-N 3.35Å; L1155-S1157 VanDerWaalsContact C-N 3.34Å; L1155-S1157 PolarHBondContact O-N 3.12Å; L1155-L1158 WeakPolarHBondContact O-CB 3.24Å; L1155-L1158 PolarHBondContact O-N 3.26Å; L1155-L1159 HydrophobicContact CD1-CD1 3.82Å; L1155-L1159 HydrophobicContact CD1-CG 3.95Å; L1155-L1159 HydrophobicContact CD2-CD1 4.49Å; L1155-L1159 HydrophobicContact CG-CD1 3.8Å; L1155-L1159 HydrophobicContact CG-CG 4.34Å; L1155-L1159 WeakPolarHBondContact O-CB 3.5Å; L1155-L1159 VanDerWaalsContact O-CG 3.25Å; L1155-L1159 WeakPolarHBondContact O-CG 3.36Å; L1155-L1159 PolarHBondContact O-N 3.35Å; L1155-L1169 HydrophobicContact CD1-CD2 3.47Å; L1155-L1169 VanDerWaalsContact CD1-CD2 3.47Å; L1155-V1187 HydrophobicContact CB-CG1 4.28Å; L1155-V1187 HydrophobicContact CD2-CB 4.49Å; L1155-V1187 HydrophobicContact CD2-CG1 3.83Å; L1155-V1187 HydrophobicContact CD2-CG2 4.07Å; L1155-L1197 HydrophobicContact CD2-CD1 4.03Å; L1155-A1200 HydrophobicContact CD2-CB 4.1Å; L1155-A1200 HydrophobicContact CG-CB 4.17Å |
| 1156 | K | 89.4 | Confident | 84 | Confident | 75 Ų | 75 | 46.7 Ų | 46.7 | 33% | 0.326 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -61.7 | -39.9 | 177.4 | 178.8 | 173.9 | 157.4 | -137.9 | 0 | 112.4 | V1152 E1153 T1160 A1200 | V1152-K1156 VanDerWaalsContact O-CB 3.24Å; V1152-K1156 WeakPolarHBondContact O-CB 3.33Å; V1152-K1156 PolarHBondContact O-N 3.41Å; E1153-K1156 IonicContact OE1-NZ 3.56Å; E1153-K1156 PolarHBondContact OE1-NZ 3.17Å; E1153-K1156 IonicContact OE2-NZ 2.71Å; E1153-K1156 PolarHBondContact OE2-NZ 2.97Å; K1156-T1160 WeakPolarHBondContact O-CB 3.22Å; K1156-T1160 WeakPolarHBondContact O-CG2 3.31Å; K1156-T1160 PolarHBondContact O-N 3.3Å; K1156-T1160 VanDerWaalsContact O-N 3.08Å; K1156-T1160 PolarHBondContact O-OG1 3.41Å; K1156-A1200 HydrophobicContact CB-CB 3.91Å |
| 1157 | S | 86.2 | Confident | 83.9 | Confident | 42 Ų | 42 | 47.4 Ų | 47.4 | 29% | 0.294 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -67.3 | -39.6 | 175.2 | -57.6 | 0 | 0 | 0 | 0 | 111.7 | E1153 S1154 L1155 T1160 S1161 | E1153-S1157 VanDerWaalsContact O-CB 3.26Å; E1153-S1157 WeakPolarHBondContact O-CB 3.37Å; E1153-S1157 PolarHBondContact O-N 2.87Å; E1153-S1157 PolarHBondContact O-OG 3.4Å; S1154-S1157 PolarHBondContact O-N 2.7Å; L1155-S1157 VanDerWaalsContact C-N 3.34Å; L1155-S1157 PolarHBondContact O-N 3.12Å; S1157-T1160 PolarHBondContact O-OG1 2.8Å; S1157-T1160 VanDerWaalsContact O-OG1 3.14Å; S1157-S1161 WeakPolarHBondContact O-CB 3.24Å; S1157-S1161 PolarHBondContact O-N 3.36Å; S1157-S1161 PolarHBondContact O-OG 3.09Å |
| 1158 | L | 88.8 | Confident | 83.9 | Confident | 2 Ų | 2 | 47.3 Ų | 47.3 | 1% | 0.01 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -64.5 | -49.4 | 175 | -172.4 | 158.8 | 0 | 0 | 0 | 111.4 | L1112 L1143 L1144 L1147 S1154 L1155 T1160 S1161 I1162 L1169 | L1112-L1158 HydrophobicContact CD2-CB 4.44Å; L1112-L1158 HydrophobicContact CD2-CD1 4.16Å; L1112-L1158 HydrophobicContact CD2-CG 4.01Å; L1143-L1158 HydrophobicContact CD2-CD1 3.99Å; L1143-L1158 HydrophobicContact CG-CD1 4.22Å; L1144-L1158 HydrophobicContact CD2-CD1 4.4Å; L1147-L1158 HydrophobicContact CD1-CB 4.47Å; L1147-L1158 HydrophobicContact CD1-CD1 3.94Å; S1154-L1158 WeakPolarHBondContact O-CB 3.29Å; S1154-L1158 PolarHBondContact O-N 3.15Å; L1155-L1158 WeakPolarHBondContact O-CB 3.24Å; L1155-L1158 PolarHBondContact O-N 3.26Å; L1158-T1160 VanDerWaalsContact C-N 3.3Å; L1158-T1160 PolarHBondContact O-N 3.33Å; L1158-S1161 PolarHBondContact O-N 3.41Å; L1158-I1162 HydrophobicContact CD2-CD1 3.81Å; L1158-I1162 HydrophobicContact CG-CD1 3.74Å; L1158-I1162 PolarHBondContact O-N 3.28Å; L1158-I1162 VanDerWaalsContact O-N 3.1Å; L1158-L1169 HydrophobicContact CD1-CD1 4.49Å; L1158-L1169 HydrophobicContact CD2-CD1 3.86Å; L1158-L1169 HydrophobicContact CD2-CD2 3.88Å; L1158-L1169 HydrophobicContact CD2-CG 4.36Å |
| 1159 | L | 87.8 | Confident | 84 | Confident | 20 Ų | 20 | 46 Ų | 46 | 11% | 0.105 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.4 | -32.3 | 179.8 | -73.2 | 171.3 | 0 | 0 | 0 | 113.6 | L1155 V1166 L1169 L1197 A1200 L1201 | L1155-L1159 HydrophobicContact CD1-CD1 3.82Å; L1155-L1159 HydrophobicContact CD1-CG 3.95Å; L1155-L1159 HydrophobicContact CD2-CD1 4.49Å; L1155-L1159 HydrophobicContact CG-CD1 3.8Å; L1155-L1159 HydrophobicContact CG-CG 4.34Å; L1155-L1159 WeakPolarHBondContact O-CB 3.5Å; L1155-L1159 VanDerWaalsContact O-CG 3.25Å; L1155-L1159 WeakPolarHBondContact O-CG 3.36Å; L1155-L1159 PolarHBondContact O-N 3.35Å; L1159-V1166 HydrophobicContact CD2-CB 3.75Å; L1159-V1166 HydrophobicContact CD2-CG2 3.93Å; L1159-L1169 HydrophobicContact CD2-CD2 3.95Å; L1159-L1169 HydrophobicContact CG-CD2 4.46Å; L1159-L1197 HydrophobicContact CD1-CD1 4.3Å; L1159-A1200 HydrophobicContact CD1-CB 4.14Å; L1159-L1201 HydrophobicContact CD1-CD2 3.92Å; L1159-L1201 HydrophobicContact CD1-CG 4.38Å; L1159-L1201 HydrophobicContact CD2-CD2 4.49Å |
| 1160 | T | 81.3 | Confident | 84.3 | Confident | 110 Ų | 110 | 39.6 Ų | 39.6 | 68% | 0.675 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -84.3 | -16.6 | 177.7 | 48.5 | 0 | 0 | 0 | 0 | 113.9 | K1156 S1157 L1158 | K1156-T1160 WeakPolarHBondContact O-CB 3.22Å; K1156-T1160 WeakPolarHBondContact O-CG2 3.31Å; K1156-T1160 PolarHBondContact O-N 3.3Å; K1156-T1160 VanDerWaalsContact O-N 3.08Å; K1156-T1160 PolarHBondContact O-OG1 3.41Å; S1157-T1160 PolarHBondContact O-OG1 2.8Å; S1157-T1160 VanDerWaalsContact O-OG1 3.14Å; L1158-T1160 VanDerWaalsContact C-N 3.3Å; L1158-T1160 PolarHBondContact O-N 3.33Å |
| 1161 | S | 74.9 | Confident | 84.2 | Confident | 35 Ų | 35 | 37 Ų | 37 | 25% | 0.245 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -110 | -20.7 | -170.3 | -57.7 | 0 | 0 | 0 | 0 | 115.1 | I1109 S1157 L1158 | I1109-S1161 VanDerWaalsContact CG2-OG 3.24Å; I1109-S1161 WeakPolarHBondContact CG2-OG 3.44Å; S1157-S1161 WeakPolarHBondContact O-CB 3.24Å; S1157-S1161 PolarHBondContact O-N 3.36Å; S1157-S1161 PolarHBondContact O-OG 3.09Å; L1158-S1161 PolarHBondContact O-N 3.41Å |
| 1162 | I | 70.1 | Confident | 84.2 | Confident | 17 Ų | 17 | 35.3 Ų | 35.3 | 9% | 0.087 | 23% | 0.234 | C | C | . | . | S | Bend | trans | -101.9 | 124.8 | 178.5 | -57.6 | 176.1 | 0 | 0 | 0 | 110.1 | L1112 V1116 L1126 L1158 G1164 G1165 | L1112-I1162 HydrophobicContact CD2-CD1 3.92Å; L1112-I1162 HydrophobicContact CD2-CG1 4.48Å; L1112-I1162 HydrophobicContact CG-CD1 4.19Å; V1116-I1162 HydrophobicContact CG1-CG2 4.15Å; V1116-I1162 HydrophobicContact CG2-CD1 3.87Å; L1126-I1162 HydrophobicContact CD1-CD1 3.99Å; L1126-I1162 HydrophobicContact CD1-CG2 4.13Å; L1126-I1162 HydrophobicContact CD2-CD1 3.71Å; L1126-I1162 HydrophobicContact CG-CD1 4.02Å; L1158-I1162 HydrophobicContact CD2-CD1 3.81Å; L1158-I1162 HydrophobicContact CG-CD1 3.74Å; L1158-I1162 PolarHBondContact O-N 3.28Å; L1158-I1162 VanDerWaalsContact O-N 3.1Å; I1162-G1164 PolarHBondContact O-N 3.49Å; I1162-G1165 PolarHBondContact O-N 3.33Å |
| 1163 | G | 60.1 | Low | 84.2 | Confident | 61 Ų | 61 | 33.9 Ų | 33.9 | 63% | 0.629 | 23% | 0.225 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -57.9 | 134.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | N1168 | G1163-N1168 PolarHBondContact O-ND2 3.48Š|
| 1164 | G | 63.5 | Low | 84.2 | Confident | 54 Ų | 54 | 32 Ų | 32 | 56% | 0.557 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 91.6 | -4.5 | -177 | 0 | 0 | 0 | 0 | 0 | 115.4 | I1162 | I1162-G1164 PolarHBondContact O-N 3.49Š|
| 1165 | G | 77.7 | Confident | 84.1 | Confident | 24 Ų | 24 | 32.9 Ų | 32.9 | 25% | 0.247 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | 56.8 | -144.6 | 163.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | I1162 A1167 N1168 L1169 | I1162-G1165 PolarHBondContact O-N 3.33Å; G1165-A1167 PolarHBondContact O-N 3.02Å; G1165-N1168 PolarHBondContact O-N 3.19Å; G1165-L1169 PolarHBondContact O-N 3.2Å |
| 1166 | V | 87.7 | Confident | 84.1 | Confident | 14 Ų | 14 | 34.2 Ų | 34.2 | 9% | 0.085 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63.8 | -27.4 | -171.8 | 80.7 | 0 | 0 | 0 | 0 | 113.5 | L1159 L1169 I1170 L1183 L1197 L1201 V1215 | L1159-V1166 HydrophobicContact CD2-CB 3.75Å; L1159-V1166 HydrophobicContact CD2-CG2 3.93Å; V1166-L1169 PolarHBondContact O-N 2.76Å; V1166-I1170 HydrophobicContact CG1-CD1 4.31Å; V1166-I1170 HydrophobicContact CG2-CD1 3.89Å; V1166-I1170 HydrophobicContact CG2-CG1 4.22Å; V1166-I1170 WeakPolarHBondContact O-CB 3.34Å; V1166-I1170 VanDerWaalsContact O-CG1 3.29Å; V1166-I1170 WeakPolarHBondContact O-CG1 3.24Å; V1166-I1170 PolarHBondContact O-N 3.45Å; V1166-L1183 HydrophobicContact CG2-CD2 4.28Å; V1166-L1197 HydrophobicContact CG2-CD1 4.11Å; V1166-L1201 HydrophobicContact CB-CD2 3.83Å; V1166-L1201 HydrophobicContact CG1-CD2 4.2Å; V1166-L1201 HydrophobicContact CG2-CD2 4.08Å; V1166-V1215 HydrophobicContact CG1-CG2 3.62Å |
| 1167 | A | 87.9 | Confident | 84.3 | Confident | 25 Ų | 25 | 31.3 Ų | 31.3 | 21% | 0.207 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.8 | -44.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | G1165 L1169 T1171 V1215 | G1165-A1167 PolarHBondContact O-N 3.02Å; A1167-L1169 VanDerWaalsContact C-N 3.31Å; A1167-L1169 PolarHBondContact O-N 2.71Å; A1167-T1171 WeakPolarHBondContact O-CB 3.49Å; A1167-T1171 PolarHBondContact O-N 2.68Å; A1167-T1171 VanDerWaalsContact O-N 3.08Å; A1167-T1171 PolarHBondContact O-OG1 3.35Å; A1167-V1215 HydrophobicContact CB-CB 4.47Å; A1167-V1215 HydrophobicContact CB-CG1 3.83Å |
| 1168 | N | 88.8 | Confident | 84.6 | Confident | 35 Ų | 35 | 33 Ų | 33 | 19% | 0.187 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63.2 | -39.5 | 174.9 | -78.3 | -6.4 | 0 | 0 | 0 | 111.4 | G1122 A1123 L1126 G1163 G1165 A1172 | G1122-N1168 WeakPolarHBondContact CA-ND2 3.26Å; A1123-N1168 HydrophobicContact CB-CB 4.07Å; A1123-N1168 PolarHBondContact N-ND2 3.03Å; L1126-N1168 HydrophobicContact CD1-CB 4.24Å; G1163-N1168 PolarHBondContact O-ND2 3.48Å; G1165-N1168 PolarHBondContact O-N 3.19Å; N1168-A1172 VanDerWaalsContact O-CB 3.26Å; N1168-A1172 WeakPolarHBondContact O-CB 3.48Å; N1168-A1172 PolarHBondContact O-N 3.35Å |
| 1169 | L | 90.5 | Very high | 84.8 | Confident | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -72.2 | -40.9 | -178.4 | -169.9 | 63.3 | 0 | 0 | 0 | 113.5 | L1126 I1130 L1140 L1155 L1158 L1159 G1165 V1166 A1167 T1171 A1172 S1173 L1183 | L1126-L1169 HydrophobicContact CD1-CD1 4.25Å; L1126-L1169 HydrophobicContact CD2-CD1 4.35Å; I1130-L1169 HydrophobicContact CD1-CD1 4.4Å; L1140-L1169 HydrophobicContact CD1-CD1 3.97Å; L1155-L1169 HydrophobicContact CD1-CD2 3.47Å; L1155-L1169 VanDerWaalsContact CD1-CD2 3.47Å; L1158-L1169 HydrophobicContact CD1-CD1 4.49Å; L1158-L1169 HydrophobicContact CD2-CD1 3.86Å; L1158-L1169 HydrophobicContact CD2-CD2 3.88Å; L1158-L1169 HydrophobicContact CD2-CG 4.36Å; L1159-L1169 HydrophobicContact CD2-CD2 3.95Å; L1159-L1169 HydrophobicContact CG-CD2 4.46Å; G1165-L1169 PolarHBondContact O-N 3.2Å; V1166-L1169 PolarHBondContact O-N 2.76Å; A1167-L1169 VanDerWaalsContact C-N 3.31Å; A1167-L1169 PolarHBondContact O-N 2.71Å; L1169-T1171 VanDerWaalsContact C-N 3.34Å; L1169-A1172 PolarHBondContact O-N 3.47Å; L1169-S1173 VanDerWaalsContact O-CB 3.29Å; L1169-S1173 WeakPolarHBondContact O-CB 3.23Å; L1169-S1173 PolarHBondContact O-N 3.37Å; L1169-S1173 PolarHBondContact O-OG 2.86Å; L1169-L1183 HydrophobicContact CD2-CD1 3.64Å; L1169-L1183 HydrophobicContact CD2-CD2 4.48Å; L1169-L1183 HydrophobicContact CG-CD1 3.62Å |
| 1170 | I | 91.2 | Very high | 85.1 | Confident | 8 Ų | 8 | 32.3 Ų | 32.3 | 4% | 0.041 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62 | -44.8 | 173 | -69.6 | 161.4 | 0 | 0 | 0 | 109.9 | V1166 S1173 G1174 G1175 L1180 L1183 L1212 V1215 | V1166-I1170 HydrophobicContact CG1-CD1 4.31Å; V1166-I1170 HydrophobicContact CG2-CD1 3.89Å; V1166-I1170 HydrophobicContact CG2-CG1 4.22Å; V1166-I1170 WeakPolarHBondContact O-CB 3.34Å; V1166-I1170 VanDerWaalsContact O-CG1 3.29Å; V1166-I1170 WeakPolarHBondContact O-CG1 3.24Å; V1166-I1170 PolarHBondContact O-N 3.45Å; I1170-S1173 PolarHBondContact O-N 2.95Å; I1170-G1174 PolarHBondContact O-N 3.28Å; I1170-G1175 WeakPolarHBondContact O-CA 3.38Å; I1170-G1175 PolarHBondContact O-N 3.39Å; I1170-L1180 HydrophobicContact CD1-CD2 3.55Å; I1170-L1180 HydrophobicContact CD1-CG 4.22Å; I1170-L1180 HydrophobicContact CG1-CD2 3.84Å; I1170-L1180 HydrophobicContact CG1-CG 4.3Å; I1170-L1180 HydrophobicContact CG2-CG 4.22Å; I1170-L1183 HydrophobicContact CG1-CD2 4.4Å; I1170-L1212 HydrophobicContact CD1-CD1 4.16Å; I1170-V1215 HydrophobicContact CD1-CG1 4.12Å; I1170-V1215 HydrophobicContact CD1-CG2 3.97Å |
| 1171 | T | 89.4 | Confident | 85.7 | Confident | 78 Ų | 78 | 31.9 Ų | 31.9 | 48% | 0.479 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -59.4 | -50 | 176.6 | -55.8 | 0 | 0 | 0 | 0 | 111 | A1123 A1167 L1169 S1173 G1174 G1175 | A1123-T1171 HydrophobicContact CB-CG2 4.11Å; A1167-T1171 WeakPolarHBondContact O-CB 3.49Å; A1167-T1171 PolarHBondContact O-N 2.68Å; A1167-T1171 VanDerWaalsContact O-N 3.08Å; A1167-T1171 PolarHBondContact O-OG1 3.35Å; L1169-T1171 VanDerWaalsContact C-N 3.34Å; T1171-S1173 VanDerWaalsContact C-N 3.28Å; T1171-S1173 PolarHBondContact O-N 3.23Å; T1171-G1174 PolarHBondContact O-N 3.28Å; T1171-G1174 VanDerWaalsContact O-N 3.15Å; T1171-G1175 PolarHBondContact O-N 3.1Å |
| 1172 | A | 90 | Very high | 86.7 | Confident | 6 Ų | 6 | 31.9 Ų | 31.9 | 5% | 0.05 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -65.1 | -27.8 | 179 | 0 | 0 | 0 | 0 | 0 | 114.2 | L1126 K1127 I1130 N1168 L1169 G1174 | L1126-A1172 HydrophobicContact CB-CB 3.56Å; K1127-A1172 HydrophobicContact CB-CB 4.05Å; I1130-A1172 HydrophobicContact CD1-CB 3.99Å; N1168-A1172 VanDerWaalsContact O-CB 3.26Å; N1168-A1172 WeakPolarHBondContact O-CB 3.48Å; N1168-A1172 PolarHBondContact O-N 3.35Å; L1169-A1172 PolarHBondContact O-N 3.47Å; A1172-G1174 VanDerWaalsContact C-N 3.25Å; A1172-G1174 PolarHBondContact O-N 3.28Å |
| 1173 | S | 91 | Very high | 87.8 | Confident | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.007 | 24% | 0.236 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -82 | 1.3 | 177.1 | -55.1 | 0 | 0 | 0 | 0 | 113.6 | L1169 I1170 T1171 N1182 | L1169-S1173 VanDerWaalsContact O-CB 3.29Å; L1169-S1173 WeakPolarHBondContact O-CB 3.23Å; L1169-S1173 PolarHBondContact O-N 3.37Å; L1169-S1173 PolarHBondContact O-OG 2.86Å; I1170-S1173 PolarHBondContact O-N 2.95Å; T1171-S1173 VanDerWaalsContact C-N 3.28Å; T1171-S1173 PolarHBondContact O-N 3.23Å; S1173-N1182 PolarHBondContact O-ND2 3.04Å |
| 1174 | G | 89.8 | Confident | 89.4 | Confident | 57 Ų | 57 | 28.2 Ų | 28.2 | 59% | 0.588 | 21% | 0.206 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 125.5 | -7.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | I1170 T1171 A1172 | I1170-G1174 PolarHBondContact O-N 3.28Å; T1171-G1174 PolarHBondContact O-N 3.28Å; T1171-G1174 VanDerWaalsContact O-N 3.15Å; A1172-G1174 VanDerWaalsContact C-N 3.25Å; A1172-G1174 PolarHBondContact O-N 3.28Å |
| 1175 | G | 89 | Confident | 90.9 | Very high | 26 Ų | 26 | 27.7 Ų | 27.7 | 27% | 0.268 | 19% | 0.191 | S | C | . | . | S | Bend | trans | 76.6 | 154.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | I1170 T1171 S1178 G1179 | I1170-G1175 WeakPolarHBondContact O-CA 3.38Å; I1170-G1175 PolarHBondContact O-N 3.39Å; T1171-G1175 PolarHBondContact O-N 3.1Å; G1175-S1178 PolarHBondContact O-N 2.95Å; G1175-G1179 PolarHBondContact O-N 3.12Å |
| 1176 | G | 91.4 | Very high | 91.6 | Very high | 28 Ų | 28 | 27 Ų | 27 | 29% | 0.289 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | 50.8 | -141.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | S1178 G1179 L1180 N1225 | G1176-S1178 VanDerWaalsContact C-N 3.3Å; G1176-S1178 PolarHBondContact O-N 3.41Å; G1176-G1179 PolarHBondContact O-N 2.97Å; G1176-L1180 PolarHBondContact O-N 3.5Å; G1176-N1225 VanDerWaalsContact CA-CG 3.48Å; G1176-N1225 VanDerWaalsContact CA-OD1 3.23Å; G1176-N1225 WeakPolarHBondContact CA-OD1 3.29Å |
| 1177 | A | 92.8 | Very high | 91.9 | Very high | 15 Ų | 15 | 26.7 Ų | 26.7 | 12% | 0.124 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -60.7 | -37 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | K1181 N1225 E1228 A1229 | A1177-K1181 VanDerWaalsContact O-CB 3.24Å; A1177-K1181 WeakPolarHBondContact O-CB 3.22Å; A1177-K1181 PolarHBondContact O-N 3.5Å; A1177-N1225 WeakPolarHBondContact CA-O 3.21Å; A1177-N1225 HydrophobicContact CB-CB 4.35Å; A1177-N1225 PolarHBondContact N-OD1 2.85Å; A1177-E1228 HydrophobicContact CB-CB 3.61Å; A1177-A1229 WeakPolarHBondContact O-CB 3.35Å |
| 1178 | S | 92.6 | Very high | 92.1 | Very high | 77 Ų | 77 | 28.1 Ų | 28.1 | 54% | 0.538 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -67.3 | -42.6 | 177.3 | -58.6 | 0 | 0 | 0 | 0 | 111.8 | G1175 G1176 K1181 N1182 | G1175-S1178 PolarHBondContact O-N 2.95Å; G1176-S1178 VanDerWaalsContact C-N 3.3Å; G1176-S1178 PolarHBondContact O-N 3.41Å; S1178-K1181 PolarHBondContact O-N 3.18Å; S1178-N1182 WeakPolarHBondContact O-CB 3.38Å; S1178-N1182 VanDerWaalsContact O-CG 3.24Å; S1178-N1182 PolarHBondContact O-N 3.26Å; S1178-N1182 PolarHBondContact O-ND2 2.62Å |
| 1179 | G | 92.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -61.7 | -47 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G1175 G1176 N1182 L1183 | G1175-G1179 PolarHBondContact O-N 3.12Å; G1176-G1179 PolarHBondContact O-N 2.97Å; G1179-N1182 PolarHBondContact O-N 2.89Å; G1179-L1183 WeakPolarHBondContact O-CB 3.48Å; G1179-L1183 PolarHBondContact O-N 3.15Å |
| 1180 | L | 94.6 | Very high | 92.1 | Very high | 7 Ų | 7 | 28.9 Ų | 28.9 | 4% | 0.037 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -62.6 | -43.7 | 175.5 | -78 | 170 | 0 | 0 | 0 | 112.6 | I1170 G1176 L1183 F1184 L1212 N1225 L1226 A1229 | I1170-L1180 HydrophobicContact CD1-CD2 3.55Å; I1170-L1180 HydrophobicContact CD1-CG 4.22Å; I1170-L1180 HydrophobicContact CG1-CD2 3.84Å; I1170-L1180 HydrophobicContact CG1-CG 4.3Å; I1170-L1180 HydrophobicContact CG2-CG 4.22Å; G1176-L1180 PolarHBondContact O-N 3.5Å; L1180-L1183 WeakPolarHBondContact O-CA 3.49Å; L1180-L1183 VanDerWaalsContact O-CB 3.25Å; L1180-L1183 WeakPolarHBondContact O-CB 3.24Å; L1180-L1183 PolarHBondContact O-N 3.08Å; L1180-L1183 VanDerWaalsContact O-N 3.16Å; L1180-F1184 HydrophobicContact CB-CE2 4.37Å; L1180-F1184 HydrophobicContact CB-CZ 4.29Å; L1180-F1184 HydrophobicContact CD2-CZ 4.35Å; L1180-F1184 WeakPolarHBondContact O-CD2 3.45Å; L1180-F1184 VanDerWaalsContact O-CG 3.25Å; L1180-F1184 WeakPolarHBondContact O-CG 3.38Å; L1180-F1184 PolarHBondContact O-N 3.13Å; L1180-L1212 HydrophobicContact CD2-CD1 3.83Å; L1180-N1225 HydrophobicContact CD1-CB 3.98Å; L1180-L1226 HydrophobicContact CD1-CB 4.42Å; L1180-A1229 HydrophobicContact CB-CB 3.67Å |
| 1181 | K | 94.7 | Very high | 92.2 | Very high | 101 Ų | 101 | 30.6 Ų | 30.6 | 44% | 0.439 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -64 | -44.6 | 177.9 | -173.9 | -177.8 | -177.9 | -60.9 | 0 | 111.8 | A1177 S1178 L1183 F1184 D1185 A1229 | A1177-K1181 VanDerWaalsContact O-CB 3.24Å; A1177-K1181 WeakPolarHBondContact O-CB 3.22Å; A1177-K1181 PolarHBondContact O-N 3.5Å; S1178-K1181 PolarHBondContact O-N 3.18Å; K1181-L1183 PolarHBondContact O-N 3.46Å; K1181-F1184 PolarHBondContact O-N 2.71Å; K1181-D1185 IonicContact NZ-OD2 2.73Å; K1181-D1185 PolarHBondContact NZ-OD2 2.87Å; K1181-D1185 WeakPolarHBondContact O-CB 3.45Å; K1181-D1185 PolarHBondContact O-N 2.9Å; K1181-A1229 HydrophobicContact CB-CB 4.15Å |
| 1182 | N | 94.6 | Very high | 92.5 | Very high | 35 Ų | 35 | 31.8 Ų | 31.8 | 19% | 0.187 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.6 | -38.3 | 173.2 | -72.8 | -18.9 | 0 | 0 | 0 | 111.1 | L1137 S1173 S1178 G1179 A1186 | L1137-N1182 HydrophobicContact CB-CB 4.45Å; L1137-N1182 WeakPolarHBondContact CD1-O 3.41Å; S1173-N1182 PolarHBondContact O-ND2 3.04Å; S1178-N1182 WeakPolarHBondContact O-CB 3.38Å; S1178-N1182 VanDerWaalsContact O-CG 3.24Å; S1178-N1182 PolarHBondContact O-N 3.26Å; S1178-N1182 PolarHBondContact O-ND2 2.62Å; G1179-N1182 PolarHBondContact O-N 2.89Å; N1182-A1186 WeakPolarHBondContact O-CB 3.46Å; N1182-A1186 PolarHBondContact O-N 3.37Å; N1182-A1186 VanDerWaalsContact O-N 3.08Å |
| 1183 | L | 93.8 | Very high | 92.7 | Very high | 1 Ų | 1 | 31.5 Ų | 31.5 | 1% | 0.005 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.4 | -50.2 | 173.8 | -140.8 | 79.2 | 0 | 0 | 0 | 112.1 | L1140 V1166 L1169 I1170 G1179 L1180 K1181 A1186 V1187 L1197 | L1140-L1183 HydrophobicContact CD1-CD1 4.48Å; L1140-L1183 HydrophobicContact CD2-CD1 3.66Å; L1140-L1183 HydrophobicContact CD2-CG 4.41Å; V1166-L1183 HydrophobicContact CG2-CD2 4.28Å; L1169-L1183 HydrophobicContact CD2-CD1 3.64Å; L1169-L1183 HydrophobicContact CD2-CD2 4.48Å; L1169-L1183 HydrophobicContact CG-CD1 3.62Å; I1170-L1183 HydrophobicContact CG1-CD2 4.4Å; G1179-L1183 WeakPolarHBondContact O-CB 3.48Å; G1179-L1183 PolarHBondContact O-N 3.15Å; L1180-L1183 WeakPolarHBondContact O-CA 3.49Å; L1180-L1183 VanDerWaalsContact O-CB 3.25Å; L1180-L1183 WeakPolarHBondContact O-CB 3.24Å; L1180-L1183 PolarHBondContact O-N 3.08Å; L1180-L1183 VanDerWaalsContact O-N 3.16Å; K1181-L1183 PolarHBondContact O-N 3.46Å; L1183-A1186 PolarHBondContact O-N 2.87Å; L1183-V1187 PolarHBondContact O-N 3.24Å; L1183-L1197 HydrophobicContact CD2-CD1 3.56Å; L1183-L1197 HydrophobicContact CD2-CD2 3.8Å; L1183-L1197 HydrophobicContact CD2-CG 4.26Å |
| 1184 | F | 94.4 | Very high | 92.8 | Very high | 0 Ų | 0 | 31.4 Ų | 31.4 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -60.8 | -48.6 | 178.7 | -59.5 | -26.4 | 0 | 0 | 0 | 111.4 | L1180 K1181 A1186 V1187 G1188 G1189 G1193 L1194 L1197 L1226 A1229 L1230 | L1180-F1184 HydrophobicContact CB-CE2 4.37Å; L1180-F1184 HydrophobicContact CB-CZ 4.29Å; L1180-F1184 HydrophobicContact CD2-CZ 4.35Å; L1180-F1184 WeakPolarHBondContact O-CD2 3.45Å; L1180-F1184 VanDerWaalsContact O-CG 3.25Å; L1180-F1184 WeakPolarHBondContact O-CG 3.38Å; L1180-F1184 PolarHBondContact O-N 3.13Å; K1181-F1184 PolarHBondContact O-N 2.71Å; F1184-A1186 PolarHBondContact O-N 3.27Å; F1184-V1187 CarbonylContact O-C 3.6Å; F1184-V1187 PolarHBondContact O-N 2.78Å; F1184-V1187 VanDerWaalsContact O-N 3.08Å; F1184-G1188 PolarHBondContact O-N 2.77Å; F1184-G1189 WeakPolarHBondContact O-CA 3.46Å; F1184-G1189 PolarHBondContact O-N 3.34Å; F1184-G1193 WeakPolarHBondContact O-CA 3.29Å; F1184-L1194 HydrophobicContact CD1-CB 4.2Å; F1184-L1194 HydrophobicContact CE1-CB 3.88Å; F1184-L1194 HydrophobicContact CE1-CD1 3.76Å; F1184-L1194 HydrophobicContact CE1-CG 4.43Å; F1184-L1194 HydrophobicContact CZ-CB 4.12Å; F1184-L1194 HydrophobicContact CZ-CD1 3.88Å; F1184-L1197 HydrophobicContact CD1-CD2 4.36Å; F1184-L1197 HydrophobicContact CE1-CD2 3.73Å; F1184-L1226 HydrophobicContact CE2-CD1 4.33Å; F1184-L1226 HydrophobicContact CZ-CD1 3.71Å; F1184-A1229 HydrophobicContact CD2-CB 4.17Å; F1184-A1229 HydrophobicContact CE2-CB 3.64Å; F1184-L1230 HydrophobicContact CD2-CD2 4.36Å; F1184-L1230 HydrophobicContact CE2-CD2 3.92Å; F1184-L1230 HydrophobicContact CE2-CG 4.13Å |
| 1185 | D | 94.5 | Very high | 93 | Very high | 43 Ų | 43 | 30.3 Ų | 30.3 | 23% | 0.23 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -68.2 | -19.2 | -177.8 | -68.4 | -13.7 | 0 | 0 | 0 | 113.3 | L1137 K1141 K1181 G1189 | L1137-D1185 VanDerWaalsContact CD1-C 3.48Å; L1137-D1185 HydrophobicContact CD1-CB 3.61Å; L1137-D1185 HydrophobicContact CD2-CB 3.86Å; L1137-D1185 HydrophobicContact CG-CB 4.41Å; K1141-D1185 WeakPolarHBondContact CE-O 3.39Å; K1181-D1185 IonicContact NZ-OD2 2.73Å; K1181-D1185 PolarHBondContact NZ-OD2 2.87Å; K1181-D1185 WeakPolarHBondContact O-CB 3.45Å; K1181-D1185 PolarHBondContact O-N 2.9Å; D1185-G1189 WeakPolarHBondContact OD1-CA 3.45Å |
| 1186 | A | 93 | Very high | 93.2 | Very high | 11 Ų | 11 | 30.6 Ų | 30.6 | 9% | 0.091 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -79.8 | -25.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | L1137 L1140 K1141 L1144 N1182 L1183 F1184 | L1137-A1186 HydrophobicContact CD1-CB 3.95Å; L1140-A1186 HydrophobicContact CB-CB 4.48Å; L1140-A1186 HydrophobicContact CD2-CB 3.58Å; L1140-A1186 HydrophobicContact CG-CB 3.89Å; K1141-A1186 HydrophobicContact CG-CB 4.1Å; L1144-A1186 HydrophobicContact CD1-CB 4.04Å; N1182-A1186 WeakPolarHBondContact O-CB 3.46Å; N1182-A1186 PolarHBondContact O-N 3.37Å; N1182-A1186 VanDerWaalsContact O-N 3.08Å; L1183-A1186 PolarHBondContact O-N 2.87Å; F1184-A1186 PolarHBondContact O-N 3.27Å |
| 1187 | V | 93.4 | Very high | 93.3 | Very high | 7 Ų | 7 | 29.2 Ų | 29.2 | 4% | 0.042 | 19% | 0.186 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -120.5 | 22.9 | -179.1 | -56.1 | 0 | 0 | 0 | 0 | 114.9 | L1144 P1151 L1155 L1183 F1184 N1196 | L1144-V1187 HydrophobicContact CD1-CG1 3.71Å; P1151-V1187 HydrophobicContact CB-CG1 4.08Å; L1155-V1187 HydrophobicContact CB-CG1 4.28Å; L1155-V1187 HydrophobicContact CD2-CB 4.49Å; L1155-V1187 HydrophobicContact CD2-CG1 3.83Å; L1155-V1187 HydrophobicContact CD2-CG2 4.07Å; L1183-V1187 PolarHBondContact O-N 3.24Å; F1184-V1187 CarbonylContact O-C 3.6Å; F1184-V1187 PolarHBondContact O-N 2.78Å; F1184-V1187 VanDerWaalsContact O-N 3.08Å; V1187-N1196 HydrophobicContact CB-CB 4.37Å; V1187-N1196 HydrophobicContact CG2-CB 3.98Å; V1187-N1196 PolarHBondContact O-ND2 2.72Å |
| 1188 | G | 91.9 | Very high | 93.3 | Very high | 54 Ų | 54 | 28.6 Ų | 28.6 | 56% | 0.557 | 18% | 0.18 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 137.7 | -9.8 | 166.3 | 0 | 0 | 0 | 0 | 0 | 116.8 | F1184 | F1184-G1188 PolarHBondContact O-N 2.77Š|
| 1189 | G | 89.7 | Confident | 93.2 | Very high | 24 Ų | 24 | 28 Ų | 28 | 25% | 0.247 | 18% | 0.176 | C | C | . | . | S | Bend | trans | 82.6 | 137.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | F1184 D1185 V1191 Q1192 G1193 | F1184-G1189 WeakPolarHBondContact O-CA 3.46Å; F1184-G1189 PolarHBondContact O-N 3.34Å; D1185-G1189 WeakPolarHBondContact OD1-CA 3.45Å; G1189-V1191 PolarHBondContact O-N 3.27Å; G1189-Q1192 PolarHBondContact O-N 2.88Å; G1189-Q1192 VanDerWaalsContact O-N 3.08Å; G1189-G1193 PolarHBondContact O-N 2.71Å |
| 1190 | G | 90.3 | Very high | 93.1 | Very high | 27 Ų | 27 | 28.4 Ų | 28.4 | 28% | 0.278 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | 43.2 | -121.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 115 | Q1192 G1193 L1194 | G1190-Q1192 VanDerWaalsContact C-N 3.35Å; G1190-Q1192 PolarHBondContact O-N 2.75Å; G1190-G1193 PolarHBondContact O-N 2.97Å; G1190-L1194 PolarHBondContact O-N 3.38Å |
| 1191 | V | 93.2 | Very high | 92.9 | Very high | 45 Ų | 45 | 30 Ų | 30 | 27% | 0.273 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -56.9 | -41.7 | -179.1 | 178.4 | 0 | 0 | 0 | 0 | 112.6 | G1189 T1195 N1239 K1242 V1243 | G1189-V1191 PolarHBondContact O-N 3.27Å; V1191-T1195 WeakPolarHBondContact O-CB 3.49Å; V1191-T1195 PolarHBondContact O-N 2.93Å; V1191-T1195 PolarHBondContact O-OG1 3.43Å; V1191-N1239 HydrophobicContact CG2-CB 3.75Å; V1191-K1242 HydrophobicContact CG1-CB 3.98Å; V1191-K1242 HydrophobicContact CG2-CD 4.48Å; V1191-V1243 HydrophobicContact CB-CG2 4.44Å; V1191-V1243 HydrophobicContact CG1-CG2 3.63Å; V1191-V1243 WeakPolarHBondContact O-CG2 3.49Å |
| 1192 | Q | 94 | Very high | 92.6 | Very high | 102 Ų | 102 | 26.2 Ų | 26.2 | 48% | 0.477 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -73.2 | -39 | 178.5 | -170.9 | 62.5 | 56.6 | 0 | 0 | 111.1 | G1189 G1190 L1194 T1195 N1196 | G1189-Q1192 PolarHBondContact O-N 2.88Å; G1189-Q1192 VanDerWaalsContact O-N 3.08Å; G1190-Q1192 VanDerWaalsContact C-N 3.35Å; G1190-Q1192 PolarHBondContact O-N 2.75Å; Q1192-L1194 PolarHBondContact O-N 3.31Å; Q1192-T1195 WeakPolarHBondContact O-CB 3.49Å; Q1192-T1195 PolarHBondContact O-N 3.44Å; Q1192-N1196 PolarHBondContact NE2-OD1 2.89Å; Q1192-N1196 WeakPolarHBondContact O-CB 3.46Å; Q1192-N1196 VanDerWaalsContact O-CG 3.27Å; Q1192-N1196 PolarHBondContact O-N 3.48Å |
| 1193 | G | 94.1 | Very high | 92.2 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.8 | -44.9 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | F1184 G1189 G1190 N1196 L1197 | F1184-G1193 WeakPolarHBondContact O-CA 3.29Å; G1189-G1193 PolarHBondContact O-N 2.71Å; G1190-G1193 PolarHBondContact O-N 2.97Å; G1193-N1196 PolarHBondContact O-N 2.98Å; G1193-L1197 WeakPolarHBondContact O-CB 3.47Å; G1193-L1197 PolarHBondContact O-N 3.33Å |
| 1194 | L | 95 | Very high | 92 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64.8 | -42.7 | 173.1 | 175.9 | 62.5 | 0 | 0 | 0 | 112.2 | F1184 G1190 Q1192 N1196 L1197 L1198 L1212 L1226 L1230 L1240 V1243 | F1184-L1194 HydrophobicContact CD1-CB 4.2Å; F1184-L1194 HydrophobicContact CE1-CB 3.88Å; F1184-L1194 HydrophobicContact CE1-CD1 3.76Å; F1184-L1194 HydrophobicContact CE1-CG 4.43Å; F1184-L1194 HydrophobicContact CZ-CB 4.12Å; F1184-L1194 HydrophobicContact CZ-CD1 3.88Å; G1190-L1194 PolarHBondContact O-N 3.38Å; Q1192-L1194 PolarHBondContact O-N 3.31Å; L1194-N1196 VanDerWaalsContact C-N 3.28Å; L1194-N1196 PolarHBondContact O-N 3.36Å; L1194-L1197 PolarHBondContact O-N 2.86Å; L1194-L1198 HydrophobicContact CD1-CD1 3.93Å; L1194-L1198 HydrophobicContact CD1-CD2 4.38Å; L1194-L1198 HydrophobicContact CD1-CG 3.86Å; L1194-L1198 HydrophobicContact CG-CD1 4Å; L1194-L1198 HydrophobicContact CG-CG 4.33Å; L1194-L1198 WeakPolarHBondContact O-CG 3.42Å; L1194-L1198 PolarHBondContact O-N 3.06Å; L1194-L1212 HydrophobicContact CD1-CD2 3.75Å; L1194-L1226 HydrophobicContact CD1-CD1 3.93Å; L1194-L1226 HydrophobicContact CD2-CD1 4.22Å; L1194-L1230 HydrophobicContact CB-CD2 4.19Å; L1194-L1230 HydrophobicContact CD2-CD1 3.89Å; L1194-L1230 HydrophobicContact CD2-CD2 3.96Å; L1194-L1230 HydrophobicContact CD2-CG 4.49Å; L1194-L1240 HydrophobicContact CD2-CD1 3.95Å; L1194-V1243 HydrophobicContact CB-CG2 4.32Å; L1194-V1243 HydrophobicContact CD2-CB 4.23Å; L1194-V1243 HydrophobicContact CD2-CG1 4.5Å; L1194-V1243 HydrophobicContact CD2-CG2 3.94Å; L1194-V1243 HydrophobicContact CG-CG1 4.36Å; L1194-V1243 HydrophobicContact CG-CG2 4.21Å |
| 1195 | T | 93.3 | Very high | 91.7 | Very high | 33 Ų | 33 | 35.7 Ų | 35.7 | 20% | 0.202 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.2 | -43.2 | 177.1 | -58.7 | 0 | 0 | 0 | 0 | 111.2 | V1191 Q1192 S1199 V1243 | V1191-T1195 WeakPolarHBondContact O-CB 3.49Å; V1191-T1195 PolarHBondContact O-N 2.93Å; V1191-T1195 PolarHBondContact O-OG1 3.43Å; Q1192-T1195 WeakPolarHBondContact O-CB 3.49Å; Q1192-T1195 PolarHBondContact O-N 3.44Å; T1195-S1199 WeakPolarHBondContact O-CB 3.36Å; T1195-S1199 PolarHBondContact O-N 3.11Å; T1195-S1199 VanDerWaalsContact O-N 3.1Å; T1195-S1199 PolarHBondContact O-OG 2.85Å; T1195-V1243 WeakPolarHBondContact OG1-CG1 3.35Å; T1195-V1243 WeakPolarHBondContact OG1-CG2 3.38Å |
| 1196 | N | 93.3 | Very high | 91.4 | Very high | 32 Ų | 32 | 35.9 Ų | 35.9 | 17% | 0.171 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -72.2 | -39.1 | 179.7 | -70.9 | -3.4 | 0 | 0 | 0 | 111.8 | V1152 V1187 Q1192 G1193 L1194 S1199 A1200 | V1152-N1196 HydrophobicContact CG1-CB 4.24Å; V1152-N1196 HydrophobicContact CG2-CB 3.9Å; V1187-N1196 HydrophobicContact CB-CB 4.37Å; V1187-N1196 HydrophobicContact CG2-CB 3.98Å; V1187-N1196 PolarHBondContact O-ND2 2.72Å; Q1192-N1196 PolarHBondContact NE2-OD1 2.89Å; Q1192-N1196 WeakPolarHBondContact O-CB 3.46Å; Q1192-N1196 VanDerWaalsContact O-CG 3.27Å; Q1192-N1196 PolarHBondContact O-N 3.48Å; G1193-N1196 PolarHBondContact O-N 2.98Å; L1194-N1196 VanDerWaalsContact C-N 3.28Å; L1194-N1196 PolarHBondContact O-N 3.36Å; N1196-S1199 PolarHBondContact O-N 3.35Å; N1196-A1200 WeakPolarHBondContact O-CB 3.4Å; N1196-A1200 PolarHBondContact O-N 3.39Å |
| 1197 | L | 93.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.2 | -51.4 | 172.1 | 176.2 | 61.5 | 0 | 0 | 0 | 111.9 | L1155 L1159 V1166 L1183 F1184 G1193 L1194 S1199 A1200 L1201 L1212 | L1155-L1197 HydrophobicContact CD2-CD1 4.03Å; L1159-L1197 HydrophobicContact CD1-CD1 4.3Å; V1166-L1197 HydrophobicContact CG2-CD1 4.11Å; L1183-L1197 HydrophobicContact CD2-CD1 3.56Å; L1183-L1197 HydrophobicContact CD2-CD2 3.8Å; L1183-L1197 HydrophobicContact CD2-CG 4.26Å; F1184-L1197 HydrophobicContact CD1-CD2 4.36Å; F1184-L1197 HydrophobicContact CE1-CD2 3.73Å; G1193-L1197 WeakPolarHBondContact O-CB 3.47Å; G1193-L1197 PolarHBondContact O-N 3.33Å; L1194-L1197 PolarHBondContact O-N 2.86Å; L1197-S1199 VanDerWaalsContact C-N 3.26Å; L1197-S1199 PolarHBondContact O-N 2.77Å; L1197-A1200 WeakPolarHBondContact O-CB 3.32Å; L1197-A1200 PolarHBondContact O-N 2.83Å; L1197-L1201 HydrophobicContact CD1-CD1 4.03Å; L1197-L1201 HydrophobicContact CD1-CG 4.14Å; L1197-L1201 HydrophobicContact CD2-CD1 4.49Å; L1197-L1201 HydrophobicContact CG-CD1 3.88Å; L1197-L1201 HydrophobicContact CG-CG 4.43Å; L1197-L1201 WeakPolarHBondContact O-CG 3.25Å; L1197-L1201 PolarHBondContact O-N 3.12Å; L1197-L1212 HydrophobicContact CD2-CD1 3.74Å; L1197-L1212 HydrophobicContact CD2-CD2 4.12Å |
| 1198 | L | 92.4 | Very high | 91 | Very high | 1 Ų | 1 | 40 Ų | 40 | 1% | 0.005 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.3 | -40.4 | -179.3 | -68.7 | 173.5 | 0 | 0 | 0 | 111 | L1194 A1200 L1201 S1202 M1205 A1208 L1209 L1212 V1243 I1244 | L1194-L1198 HydrophobicContact CD1-CD1 3.93Å; L1194-L1198 HydrophobicContact CD1-CD2 4.38Å; L1194-L1198 HydrophobicContact CD1-CG 3.86Å; L1194-L1198 HydrophobicContact CG-CD1 4Å; L1194-L1198 HydrophobicContact CG-CG 4.33Å; L1194-L1198 WeakPolarHBondContact O-CG 3.42Å; L1194-L1198 PolarHBondContact O-N 3.06Å; L1198-A1200 VanDerWaalsContact C-N 3.27Å; L1198-A1200 PolarHBondContact O-N 3.38Å; L1198-L1201 PolarHBondContact O-N 3.44Å; L1198-L1201 VanDerWaalsContact O-N 3.12Å; L1198-S1202 PolarHBondContact O-N 3.43Å; L1198-S1202 VanDerWaalsContact O-N 3.1Å; L1198-S1202 VanDerWaalsContact O-O 3.07Å; L1198-M1205 HydrophobicContact CB-CE 4.4Å; L1198-M1205 HydrophobicContact CD1-CE 4.35Å; L1198-M1205 HydrophobicContact CD1-CG 4.26Å; L1198-A1208 HydrophobicContact CB-CB 3.98Å; L1198-A1208 HydrophobicContact CD2-CB 3.73Å; L1198-A1208 HydrophobicContact CG-CB 4.46Å; L1198-A1208 VanDerWaalsContact O-CB 3.28Å; L1198-A1208 WeakPolarHBondContact O-CB 3.37Å; L1198-L1209 HydrophobicContact CD2-CB 4.4Å; L1198-L1212 HydrophobicContact CD2-CD2 4.02Å; L1198-V1243 HydrophobicContact CD1-CG1 3.84Å; L1198-I1244 HydrophobicContact CD1-CG2 4.4Å |
| 1199 | S | 91.1 | Very high | 91 | Very high | 66 Ų | 66 | 37.5 Ų | 37.5 | 46% | 0.462 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -67.2 | -24.8 | 176.2 | -54 | 0 | 0 | 0 | 0 | 113.7 | T1195 N1196 L1197 | T1195-S1199 WeakPolarHBondContact O-CB 3.36Å; T1195-S1199 PolarHBondContact O-N 3.11Å; T1195-S1199 VanDerWaalsContact O-N 3.1Å; T1195-S1199 PolarHBondContact O-OG 2.85Å; N1196-S1199 PolarHBondContact O-N 3.35Å; L1197-S1199 VanDerWaalsContact C-N 3.26Å; L1197-S1199 PolarHBondContact O-N 2.77Å |
| 1200 | A | 90.8 | Very high | 91 | Very high | 8 Ų | 8 | 39.9 Ų | 39.9 | 7% | 0.066 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -82.6 | -20.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | L1155 K1156 L1159 N1196 L1197 L1198 | L1155-A1200 HydrophobicContact CD2-CB 4.1Å; L1155-A1200 HydrophobicContact CG-CB 4.17Å; K1156-A1200 HydrophobicContact CB-CB 3.91Å; L1159-A1200 HydrophobicContact CD1-CB 4.14Å; N1196-A1200 WeakPolarHBondContact O-CB 3.4Å; N1196-A1200 PolarHBondContact O-N 3.39Å; L1197-A1200 WeakPolarHBondContact O-CB 3.32Å; L1197-A1200 PolarHBondContact O-N 2.83Å; L1198-A1200 VanDerWaalsContact C-N 3.27Å; L1198-A1200 PolarHBondContact O-N 3.38Å |
| 1201 | L | 90.6 | Very high | 91 | Very high | 40 Ų | 40 | 42.2 Ų | 42.2 | 21% | 0.209 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -87.4 | -46.7 | 179.9 | -71.8 | 169 | 0 | 0 | 0 | 113.5 | L1159 V1166 L1197 L1198 A1208 L1212 | L1159-L1201 HydrophobicContact CD1-CD2 3.92Å; L1159-L1201 HydrophobicContact CD1-CG 4.38Å; L1159-L1201 HydrophobicContact CD2-CD2 4.49Å; V1166-L1201 HydrophobicContact CB-CD2 3.83Å; V1166-L1201 HydrophobicContact CG1-CD2 4.2Å; V1166-L1201 HydrophobicContact CG2-CD2 4.08Å; L1197-L1201 HydrophobicContact CD1-CD1 4.03Å; L1197-L1201 HydrophobicContact CD1-CG 4.14Å; L1197-L1201 HydrophobicContact CD2-CD1 4.49Å; L1197-L1201 HydrophobicContact CG-CD1 3.88Å; L1197-L1201 HydrophobicContact CG-CG 4.43Å; L1197-L1201 WeakPolarHBondContact O-CG 3.25Å; L1197-L1201 PolarHBondContact O-N 3.12Å; L1198-L1201 PolarHBondContact O-N 3.44Å; L1198-L1201 VanDerWaalsContact O-N 3.12Å; L1201-A1208 HydrophobicContact CB-CB 3.98Å; L1201-L1212 HydrophobicContact CD1-CB 4.34Å; L1201-L1212 HydrophobicContact CD1-CD1 4.4Å |
| 1202 | S | 88.3 | Confident | 90.9 | Very high | 22 Ų | 22 | 40.3 Ų | 40.3 | 15% | 0.154 | 23% | 0.227 | C | C | . | . | trans | -156.6 | 159.7 | 172.6 | -175.3 | 0 | 0 | 0 | 0 | 111.1 | L1198 D1204 E1207 | L1198-S1202 PolarHBondContact O-N 3.43Å; L1198-S1202 VanDerWaalsContact O-N 3.1Å; L1198-S1202 VanDerWaalsContact O-O 3.07Å; S1202-D1204 VanDerWaalsContact C-N 3.31Å; S1202-D1204 PolarHBondContact OG-N 3.34Å; S1202-E1207 WeakPolarHBondContact CB-OE2 3.08Å; S1202-E1207 PolarHBondContact OG-OE2 2.57Å | ||
| 1203 | S | 86.2 | Confident | 90.8 | Very high | 135 Ų | 135 | 35.5 Ų | 35.5 | 94% | 0.944 | 21% | 0.205 | S | C | * | . | S | Bend | trans | -75.9 | -18.3 | 169 | 53.8 | 0 | 0 | 0 | 0 | 113 | ||
| 1204 | D | 89.5 | Confident | 90.5 | Very high | 79 Ų | 79 | 40 Ų | 40 | 42% | 0.422 | 23% | 0.229 | S | C | . | . | S | Bend | trans | -93.4 | 121.2 | 167 | -166.6 | -49.1 | 0 | 0 | 0 | 110.2 | S1202 N1206 E1207 A1208 | S1202-D1204 VanDerWaalsContact C-N 3.31Å; S1202-D1204 PolarHBondContact OG-N 3.34Å; D1204-N1206 VanDerWaalsContact C-N 3.29Å; D1204-N1206 PolarHBondContact O-N 2.9Å; D1204-N1206 WeakPolarHBondContact OD1-CA 3.49Å; D1204-N1206 VanDerWaalsContact OD1-CB 3.3Å; D1204-N1206 WeakPolarHBondContact OD1-CB 3.26Å; D1204-N1206 PolarHBondContact OD1-N 3.02Å; D1204-N1206 PolarHBondContact OD1-ND2 3.26Å; D1204-N1206 VanDerWaalsContact OD1-ND2 3.11Å; D1204-E1207 HydrophobicContact CB-CB 4.02Å; D1204-E1207 PolarHBondContact O-N 3.2Å; D1204-A1208 WeakPolarHBondContact O-CB 3.39Å; D1204-A1208 PolarHBondContact O-N 2.87Å |
| 1205 | M | 88.1 | Confident | 90.1 | Very high | 21 Ų | 21 | 41.5 Ų | 41.5 | 10% | 0.103 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -70.4 | -22.9 | -177 | -171.8 | 160.3 | -83.6 | 0 | 0 | 113.4 | L1198 L1209 V1243 K1247 V1248 | L1198-M1205 HydrophobicContact CB-CE 4.4Å; L1198-M1205 HydrophobicContact CD1-CE 4.35Å; L1198-M1205 HydrophobicContact CD1-CG 4.26Å; M1205-L1209 VanDerWaalsContact O-CB 3.25Å; M1205-L1209 WeakPolarHBondContact O-CB 3.3Å; M1205-L1209 PolarHBondContact O-N 3.16Å; M1205-L1209 VanDerWaalsContact O-N 3.13Å; M1205-V1243 HydrophobicContact CE-CG1 4.08Å; M1205-V1243 HydrophobicContact SD-CG1 4.29Å; M1205-K1247 HydrophobicContact CE-CD 4.22Å; M1205-K1247 HydrophobicContact SD-CB 4.19Å; M1205-K1247 HydrophobicContact SD-CD 3.48Å; M1205-K1247 WeakPolarHBondContact SD-CD 3.38Å; M1205-V1248 HydrophobicContact CB-CG2 4.3Å; M1205-V1248 HydrophobicContact CG-CG2 3.96Å |
| 1206 | N | 86.6 | Confident | 89.6 | Confident | 47 Ų | 47 | 44.2 Ų | 44.2 | 25% | 0.251 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -72.8 | -45.2 | 171.8 | -60.1 | -89.5 | 0 | 0 | 0 | 110.2 | D1204 L1209 I1210 K1247 V1248 | D1204-N1206 VanDerWaalsContact C-N 3.29Å; D1204-N1206 PolarHBondContact O-N 2.9Å; D1204-N1206 WeakPolarHBondContact OD1-CA 3.49Å; D1204-N1206 VanDerWaalsContact OD1-CB 3.3Å; D1204-N1206 WeakPolarHBondContact OD1-CB 3.26Å; D1204-N1206 PolarHBondContact OD1-N 3.02Å; D1204-N1206 PolarHBondContact OD1-ND2 3.26Å; D1204-N1206 VanDerWaalsContact OD1-ND2 3.11Å; N1206-L1209 PolarHBondContact O-N 2.9Å; N1206-I1210 WeakPolarHBondContact O-CB 3.41Å; N1206-I1210 WeakPolarHBondContact O-CD1 3.27Å; N1206-I1210 VanDerWaalsContact O-CG1 3.23Å; N1206-I1210 WeakPolarHBondContact O-CG1 3.35Å; N1206-I1210 PolarHBondContact O-N 3.26Å; N1206-K1247 PolarHBondContact ND2-O 2.81Å; N1206-V1248 WeakPolarHBondContact OD1-CG1 3.19Å |
| 1207 | E | 88.7 | Confident | 89.2 | Confident | 105 Ų | 105 | 45.3 Ų | 45.3 | 49% | 0.491 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.4 | -43.2 | 178.5 | -169.9 | -179.4 | -123.2 | 0 | 0 | 111.3 | S1202 D1204 L1209 I1210 N1211 | S1202-E1207 WeakPolarHBondContact CB-OE2 3.08Å; S1202-E1207 PolarHBondContact OG-OE2 2.57Å; D1204-E1207 HydrophobicContact CB-CB 4.02Å; D1204-E1207 PolarHBondContact O-N 3.2Å; E1207-L1209 VanDerWaalsContact C-N 3.31Å; E1207-L1209 PolarHBondContact O-N 2.93Å; E1207-I1210 PolarHBondContact O-N 3.35Å; E1207-N1211 WeakPolarHBondContact O-CB 3.38Å; E1207-N1211 PolarHBondContact O-N 3.08Å; E1207-N1211 PolarHBondContact O-ND2 3.33Å |
| 1208 | A | 90.8 | Very high | 89 | Confident | 0 Ų | 0 | 49.3 Ų | 49.3 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -57.8 | -41.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L1198 L1201 D1204 N1211 L1212 | L1198-A1208 HydrophobicContact CB-CB 3.98Å; L1198-A1208 HydrophobicContact CD2-CB 3.73Å; L1198-A1208 HydrophobicContact CG-CB 4.46Å; L1198-A1208 VanDerWaalsContact O-CB 3.28Å; L1198-A1208 WeakPolarHBondContact O-CB 3.37Å; L1201-A1208 HydrophobicContact CB-CB 3.98Å; D1204-A1208 WeakPolarHBondContact O-CB 3.39Å; D1204-A1208 PolarHBondContact O-N 2.87Å; A1208-N1211 PolarHBondContact O-N 3.44Å; A1208-L1212 WeakPolarHBondContact O-CB 3.34Å; A1208-L1212 PolarHBondContact O-N 3.1Å |
| 1209 | L | 92 | Very high | 88.9 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -71.2 | -37.3 | 177.8 | -174.5 | 65.8 | 0 | 0 | 0 | 112.3 | L1198 M1205 N1206 E1207 L1212 L1213 L1226 I1244 V1248 L1253 | L1198-L1209 HydrophobicContact CD2-CB 4.4Å; M1205-L1209 VanDerWaalsContact O-CB 3.25Å; M1205-L1209 WeakPolarHBondContact O-CB 3.3Å; M1205-L1209 PolarHBondContact O-N 3.16Å; M1205-L1209 VanDerWaalsContact O-N 3.13Å; N1206-L1209 PolarHBondContact O-N 2.9Å; E1207-L1209 VanDerWaalsContact C-N 3.31Å; E1207-L1209 PolarHBondContact O-N 2.93Å; L1209-L1212 PolarHBondContact O-N 3.09Å; L1209-L1213 HydrophobicContact CD1-CD1 3.78Å; L1209-L1213 HydrophobicContact CD1-CG 4.07Å; L1209-L1213 HydrophobicContact CD2-CD1 4.47Å; L1209-L1213 HydrophobicContact CG-CD1 3.84Å; L1209-L1213 HydrophobicContact CG-CG 4.36Å; L1209-L1213 VanDerWaalsContact O-CB 3.32Å; L1209-L1213 WeakPolarHBondContact O-CB 3.38Å; L1209-L1213 VanDerWaalsContact O-CG 3.31Å; L1209-L1213 WeakPolarHBondContact O-CG 3.43Å; L1209-L1213 PolarHBondContact O-N 3.04Å; L1209-L1226 HydrophobicContact CD1-CD2 4.09Å; L1209-I1244 HydrophobicContact CD2-CD1 4.21Å; L1209-I1244 HydrophobicContact CD2-CG2 4.38Å; L1209-V1248 HydrophobicContact CD2-CG1 4.07Å; L1209-L1253 HydrophobicContact CD2-CD1 4.1Å |
| 1210 | I | 89.9 | Confident | 88.8 | Confident | 74 Ų | 74 | 51.6 Ų | 51.6 | 38% | 0.379 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.8 | -44.6 | 172.9 | -71.4 | 160.4 | 0 | 0 | 0 | 110.4 | N1206 E1207 L1212 L1213 N1214 T1256 | N1206-I1210 WeakPolarHBondContact O-CB 3.41Å; N1206-I1210 WeakPolarHBondContact O-CD1 3.27Å; N1206-I1210 VanDerWaalsContact O-CG1 3.23Å; N1206-I1210 WeakPolarHBondContact O-CG1 3.35Å; N1206-I1210 PolarHBondContact O-N 3.26Å; E1207-I1210 PolarHBondContact O-N 3.35Å; I1210-L1212 VanDerWaalsContact C-N 3.28Å; I1210-L1212 PolarHBondContact O-N 2.9Å; I1210-L1213 CarbonylContact O-C 2.75Å; I1210-L1213 PolarHBondContact O-N 3.03Å; I1210-N1214 WeakPolarHBondContact O-CB 3.22Å; I1210-N1214 PolarHBondContact O-N 3.32Å; I1210-T1256 HydrophobicContact CB-CG2 4.41Å; I1210-T1256 HydrophobicContact CG1-CG2 3.7Å; I1210-T1256 WeakPolarHBondContact CG1-OG1 3.46Å |
| 1211 | N | 88.5 | Confident | 88.9 | Confident | 77 Ų | 77 | 54.4 Ų | 54.4 | 41% | 0.412 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -66.4 | -29.7 | 178.2 | -69 | -20.7 | 0 | 0 | 0 | 112.6 | E1207 A1208 | E1207-N1211 WeakPolarHBondContact O-CB 3.38Å; E1207-N1211 PolarHBondContact O-N 3.08Å; E1207-N1211 PolarHBondContact O-ND2 3.33Å; A1208-N1211 PolarHBondContact O-N 3.44Å |
| 1212 | L | 92.5 | Very high | 89 | Confident | 5 Ų | 5 | 52.9 Ų | 52.9 | 3% | 0.026 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -79 | -32.1 | 174.8 | -169 | 62.1 | 0 | 0 | 0 | 112.9 | I1170 L1180 L1194 L1197 L1198 L1201 A1208 L1209 I1210 V1215 L1226 | I1170-L1212 HydrophobicContact CD1-CD1 4.16Å; L1180-L1212 HydrophobicContact CD2-CD1 3.83Å; L1194-L1212 HydrophobicContact CD1-CD2 3.75Å; L1197-L1212 HydrophobicContact CD2-CD1 3.74Å; L1197-L1212 HydrophobicContact CD2-CD2 4.12Å; L1198-L1212 HydrophobicContact CD2-CD2 4.02Å; L1201-L1212 HydrophobicContact CD1-CB 4.34Å; L1201-L1212 HydrophobicContact CD1-CD1 4.4Å; A1208-L1212 WeakPolarHBondContact O-CB 3.34Å; A1208-L1212 PolarHBondContact O-N 3.1Å; L1209-L1212 PolarHBondContact O-N 3.09Å; I1210-L1212 VanDerWaalsContact C-N 3.28Å; I1210-L1212 PolarHBondContact O-N 2.9Å; L1212-V1215 WeakPolarHBondContact O-CG2 3.31Å; L1212-L1226 HydrophobicContact CD2-CD1 4.09Å; L1212-L1226 HydrophobicContact CD2-CD2 4.39Å |
| 1213 | L | 92.1 | Very high | 89.3 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 30% | 0.295 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | 25.7 | -178.8 | -62.2 | -177.9 | 0 | 0 | 0 | 113.7 | L1209 I1210 Q1219 D1222 F1223 L1226 L1253 T1256 L1257 | L1209-L1213 HydrophobicContact CD1-CD1 3.78Å; L1209-L1213 HydrophobicContact CD1-CG 4.07Å; L1209-L1213 HydrophobicContact CD2-CD1 4.47Å; L1209-L1213 HydrophobicContact CG-CD1 3.84Å; L1209-L1213 HydrophobicContact CG-CG 4.36Å; L1209-L1213 VanDerWaalsContact O-CB 3.32Å; L1209-L1213 WeakPolarHBondContact O-CB 3.38Å; L1209-L1213 VanDerWaalsContact O-CG 3.31Å; L1209-L1213 WeakPolarHBondContact O-CG 3.43Å; L1209-L1213 PolarHBondContact O-N 3.04Å; I1210-L1213 CarbonylContact O-C 2.75Å; I1210-L1213 PolarHBondContact O-N 3.03Å; L1213-Q1219 WeakPolarHBondContact O-CG 3.46Å; L1213-Q1219 PolarHBondContact O-NE2 3.01Å; L1213-D1222 HydrophobicContact CD2-CB 4.31Å; L1213-F1223 HydrophobicContact CD1-CD2 3.79Å; L1213-F1223 HydrophobicContact CD2-CB 3.9Å; L1213-F1223 HydrophobicContact CD2-CD2 3.94Å; L1213-F1223 HydrophobicContact CD2-CG 4.44Å; L1213-L1226 HydrophobicContact CD2-CB 4.31Å; L1213-L1226 HydrophobicContact CD2-CD2 3.78Å; L1213-L1226 HydrophobicContact CG-CD2 4.44Å; L1213-L1253 HydrophobicContact CD1-CD1 4.44Å; L1213-T1256 HydrophobicContact CB-CG2 4.17Å; L1213-T1256 HydrophobicContact CD1-CG2 3.92Å; L1213-L1257 HydrophobicContact CD1-CD2 4.12Å |
| 1214 | N | 87.6 | Confident | 89.6 | Confident | 94 Ų | 94 | 47.9 Ų | 47.9 | 50% | 0.503 | 26% | 0.26 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -146.3 | 35.7 | 173.4 | -164.3 | 48.4 | 0 | 0 | 0 | 110.8 | I1210 D1222 | I1210-N1214 WeakPolarHBondContact O-CB 3.22Å; I1210-N1214 PolarHBondContact O-N 3.32Å; N1214-D1222 WeakPolarHBondContact CA-OD2 3.5Å; N1214-D1222 PolarHBondContact N-OD2 3.49Å |
| 1215 | V | 86.8 | Confident | 89.9 | Confident | 32 Ų | 32 | 44.8 Ų | 44.8 | 19% | 0.194 | 24% | 0.244 | C | C | . | . | S | Bend | trans | -78.3 | -45 | -177.2 | 156 | 0 | 0 | 0 | 0 | 111.5 | V1166 A1167 I1170 L1212 D1222 | V1166-V1215 HydrophobicContact CG1-CG2 3.62Å; A1167-V1215 HydrophobicContact CB-CB 4.47Å; A1167-V1215 HydrophobicContact CB-CG1 3.83Å; I1170-V1215 HydrophobicContact CD1-CG1 4.12Å; I1170-V1215 HydrophobicContact CD1-CG2 3.97Å; L1212-V1215 WeakPolarHBondContact O-CG2 3.31Å; V1215-D1222 PolarHBondContact N-OD2 2.9Å |
| 1216 | T | 83 | Confident | 90.2 | Very high | 90 Ų | 90 | 43.8 Ų | 43.8 | 55% | 0.552 | 24% | 0.239 | S | C | * | . | S | Bend | trans | -94 | -7.5 | 173.7 | 60.2 | 0 | 0 | 0 | 0 | 112.6 | N1218 D1222 | T1216-N1218 PolarHBondContact O-N 2.78Å; T1216-N1218 PolarHBondContact OG1-N 2.94Å; T1216-N1218 PolarHBondContact OG1-O 3.5Å; T1216-D1222 WeakPolarHBondContact CB-OD1 3.39Å; T1216-D1222 VanDerWaalsContact CG2-OD1 3.24Å; T1216-D1222 WeakPolarHBondContact CG2-OD1 3.15Å; T1216-D1222 PolarHBondContact N-OD1 3.13Å; T1216-D1222 VanDerWaalsContact N-OD1 3.15Å; T1216-D1222 PolarHBondContact N-OD2 2.9Å; T1216-D1222 VanDerWaalsContact OG1-CG 3.24Å; T1216-D1222 PolarHBondContact OG1-OD1 3.47Å; T1216-D1222 PolarHBondContact OG1-OD2 3.44Å |
| 1217 | G | 84.2 | Confident | 90.6 | Very high | 55 Ų | 55 | 41.8 Ų | 41.8 | 57% | 0.567 | 23% | 0.228 | S | C | * | . | S | Bend | trans | 75.4 | 0.1 | -165.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||
| 1218 | N | 88.9 | Confident | 90.8 | Very high | 84 Ų | 84 | 41.2 Ų | 41.2 | 45% | 0.449 | 23% | 0.226 | S | C | . | . | trans | -112.5 | 94.7 | 171.7 | -178.2 | 9.1 | 0 | 0 | 0 | 110.5 | T1216 E1220 E1221 D1222 | T1216-N1218 PolarHBondContact O-N 2.78Å; T1216-N1218 PolarHBondContact OG1-N 2.94Å; T1216-N1218 PolarHBondContact OG1-O 3.5Å; N1218-E1220 PolarHBondContact O-N 2.98Å; N1218-E1220 VanDerWaalsContact O-N 3.13Å; N1218-E1220 PolarHBondContact OD1-N 3.19Å; N1218-E1221 HydrophobicContact CB-CB 4.3Å; N1218-E1221 WeakPolarHBondContact ND2-CB 3.47Å; N1218-E1221 PolarHBondContact O-N 3.33Å; N1218-E1221 VanDerWaalsContact O-N 3.12Å; N1218-D1222 PolarHBondContact O-N 3.27Å | ||
| 1219 | Q | 89.9 | Confident | 90.9 | Very high | 42 Ų | 42 | 41.6 Ų | 41.6 | 20% | 0.196 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -59.4 | -27 | -177 | -43.2 | -163.7 | -84.6 | 0 | 0 | 113.9 | L1213 F1223 T1256 L1257 T1266 | L1213-Q1219 WeakPolarHBondContact O-CG 3.46Å; L1213-Q1219 PolarHBondContact O-NE2 3.01Å; Q1219-F1223 WeakPolarHBondContact O-CB 3.25Å; Q1219-F1223 PolarHBondContact O-N 3.4Å; Q1219-T1256 PolarHBondContact NE2-O 3.34Å; Q1219-T1256 PolarHBondContact OE1-O 2.85Å; Q1219-L1257 HydrophobicContact CB-CD2 4.34Å; Q1219-T1266 HydrophobicContact CB-CG2 4.41Å |
| 1220 | E | 90.6 | Very high | 91.1 | Very high | 74 Ų | 74 | 42 Ų | 42 | 35% | 0.346 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -70.1 | -44 | 178.1 | -168 | 175.8 | 119.9 | 0 | 0 | 111 | N1218 K1224 T1266 N1269 S1270 | N1218-E1220 PolarHBondContact O-N 2.98Å; N1218-E1220 VanDerWaalsContact O-N 3.13Å; N1218-E1220 PolarHBondContact OD1-N 3.19Å; E1220-K1224 VanDerWaalsContact O-CB 3.27Å; E1220-K1224 WeakPolarHBondContact O-CB 3.21Å; E1220-K1224 PolarHBondContact O-N 3.37Å; E1220-T1266 HydrophobicContact CB-CG2 3.98Å; E1220-T1266 HydrophobicContact CG-CG2 4.44Å; E1220-N1269 HydrophobicContact CG-CB 4.13Å; E1220-N1269 WeakPolarHBondContact OE1-CB 3.43Å; E1220-N1269 WeakPolarHBondContact OE2-CB 3.47Å; E1220-S1270 WeakPolarHBondContact O-CB 3.37Å |
| 1221 | E | 91.5 | Very high | 91.1 | Very high | 67 Ų | 67 | 40.9 Ų | 40.9 | 31% | 0.313 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -76.9 | -37.7 | 178.3 | -177.2 | 57.5 | -154.5 | 0 | 0 | 111.2 | N1218 F1223 K1224 N1225 | N1218-E1221 HydrophobicContact CB-CB 4.3Å; N1218-E1221 WeakPolarHBondContact ND2-CB 3.47Å; N1218-E1221 PolarHBondContact O-N 3.33Å; N1218-E1221 VanDerWaalsContact O-N 3.12Å; E1221-F1223 VanDerWaalsContact C-N 3.35Å; E1221-F1223 PolarHBondContact O-N 2.78Å; E1221-K1224 PolarHBondContact O-N 3.28Å; E1221-K1224 IonicContact OE1-NZ 2.83Å; E1221-K1224 PolarHBondContact OE1-NZ 2.74Å; E1221-K1224 WeakPolarHBondContact OE2-CD 3.34Å; E1221-K1224 IonicContact OE2-NZ 3.99Å; E1221-K1224 PolarHBondContact OE2-NZ 3.13Å; E1221-N1225 VanDerWaalsContact CD-ND2 3.34Å; E1221-N1225 WeakPolarHBondContact CG-ND2 3.25Å; E1221-N1225 WeakPolarHBondContact O-CB 3.48Å; E1221-N1225 PolarHBondContact O-N 3.41Å; E1221-N1225 PolarHBondContact O-ND2 3.08Å; E1221-N1225 PolarHBondContact OE1-ND2 3.14Å |
| 1222 | D | 93.3 | Very high | 91.1 | Very high | 8 Ų | 8 | 38.2 Ų | 38.2 | 4% | 0.043 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.4 | -42.3 | 173.3 | -67.3 | -20.3 | 0 | 0 | 0 | 111.1 | L1213 N1214 V1215 T1216 N1218 N1225 L1226 | L1213-D1222 HydrophobicContact CD2-CB 4.31Å; N1214-D1222 WeakPolarHBondContact CA-OD2 3.5Å; N1214-D1222 PolarHBondContact N-OD2 3.49Å; V1215-D1222 PolarHBondContact N-OD2 2.9Å; T1216-D1222 WeakPolarHBondContact CB-OD1 3.39Å; T1216-D1222 VanDerWaalsContact CG2-OD1 3.24Å; T1216-D1222 WeakPolarHBondContact CG2-OD1 3.15Å; T1216-D1222 PolarHBondContact N-OD1 3.13Å; T1216-D1222 VanDerWaalsContact N-OD1 3.15Å; T1216-D1222 PolarHBondContact N-OD2 2.9Å; T1216-D1222 VanDerWaalsContact OG1-CG 3.24Å; T1216-D1222 PolarHBondContact OG1-OD1 3.47Å; T1216-D1222 PolarHBondContact OG1-OD2 3.44Å; N1218-D1222 PolarHBondContact O-N 3.27Å; D1222-N1225 PolarHBondContact O-N 3.05Å; D1222-L1226 WeakPolarHBondContact O-CB 3.34Å; D1222-L1226 PolarHBondContact O-N 3.25Å |
| 1223 | F | 94.5 | Very high | 91 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -71 | -37.8 | 177.2 | -172.4 | -108.7 | 0 | 0 | 0 | 112.5 | L1213 Q1219 E1221 L1226 I1227 L1237 L1240 L1253 L1257 L1267 S1270 F1271 | L1213-F1223 HydrophobicContact CD1-CD2 3.79Å; L1213-F1223 HydrophobicContact CD2-CB 3.9Å; L1213-F1223 HydrophobicContact CD2-CD2 3.94Å; L1213-F1223 HydrophobicContact CD2-CG 4.44Å; Q1219-F1223 WeakPolarHBondContact O-CB 3.25Å; Q1219-F1223 PolarHBondContact O-N 3.4Å; E1221-F1223 VanDerWaalsContact C-N 3.35Å; E1221-F1223 PolarHBondContact O-N 2.78Å; F1223-L1226 HydrophobicContact CD2-CD2 4.41Å; F1223-L1226 PolarHBondContact O-N 3.47Å; F1223-I1227 HydrophobicContact CD1-CG1 4.27Å; F1223-I1227 HydrophobicContact CE1-CD1 4.34Å; F1223-I1227 HydrophobicContact CE1-CG1 3.83Å; F1223-I1227 HydrophobicContact CE2-CD1 4.24Å; F1223-I1227 HydrophobicContact CE2-CG1 4.19Å; F1223-I1227 HydrophobicContact CZ-CD1 3.85Å; F1223-I1227 HydrophobicContact CZ-CG1 3.79Å; F1223-I1227 WeakPolarHBondContact O-CG1 3.42Å; F1223-I1227 PolarHBondContact O-N 3.25Å; F1223-L1237 HydrophobicContact CZ-CD1 4.38Å; F1223-L1240 HydrophobicContact CE2-CD2 3.53Å; F1223-L1240 HydrophobicContact CZ-CD2 3.94Å; F1223-L1253 HydrophobicContact CD2-CD1 4.41Å; F1223-L1253 HydrophobicContact CE2-CD1 3.76Å; F1223-L1253 HydrophobicContact CE2-CD2 4.39Å; F1223-L1253 HydrophobicContact CZ-CD1 4.39Å; F1223-L1253 HydrophobicContact CZ-CD2 4.28Å; F1223-L1257 HydrophobicContact CB-CD2 3.9Å; F1223-L1257 HydrophobicContact CD1-CD1 4.17Å; F1223-L1257 HydrophobicContact CD2-CD1 4.3Å; F1223-L1257 HydrophobicContact CD2-CD2 4.2Å; F1223-L1257 HydrophobicContact CE1-CD1 4.28Å; F1223-L1257 HydrophobicContact CE2-CD1 4.37Å; F1223-L1257 HydrophobicContact CG-CD1 4.21Å; F1223-L1257 HydrophobicContact CG-CD2 3.98Å; F1223-L1257 HydrophobicContact CZ-CD1 4.37Å; F1223-L1267 HydrophobicContact CE1-CB 4.48Å; F1223-L1267 HydrophobicContact CE1-CD1 4.43Å; F1223-L1267 HydrophobicContact CE1-CG 3.88Å; F1223-L1267 HydrophobicContact CZ-CD1 4.38Å; F1223-L1267 HydrophobicContact CZ-CG 4.32Å; F1223-S1270 VanDerWaalsContact CD1-OG 3.26Å; F1223-S1270 WeakPolarHBondContact CD1-OG 3.24Å; F1223-F1271 HydrophobicContact CE1-CE2 4.46Å |
| 1224 | K | 93.8 | Very high | 90.9 | Very high | 51 Ų | 51 | 41.1 Ų | 41.1 | 22% | 0.222 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -56.6 | -51.6 | 170 | 172.8 | 170.8 | 144.8 | -68.4 | 0 | 111.2 | E1220 E1221 L1226 I1227 E1228 S1270 | E1220-K1224 VanDerWaalsContact O-CB 3.27Å; E1220-K1224 WeakPolarHBondContact O-CB 3.21Å; E1220-K1224 PolarHBondContact O-N 3.37Å; E1221-K1224 PolarHBondContact O-N 3.28Å; E1221-K1224 IonicContact OE1-NZ 2.83Å; E1221-K1224 PolarHBondContact OE1-NZ 2.74Å; E1221-K1224 WeakPolarHBondContact OE2-CD 3.34Å; E1221-K1224 IonicContact OE2-NZ 3.99Å; E1221-K1224 PolarHBondContact OE2-NZ 3.13Å; K1224-L1226 VanDerWaalsContact C-N 3.31Å; K1224-L1226 PolarHBondContact O-N 2.91Å; K1224-I1227 PolarHBondContact O-N 3.34Å; K1224-E1228 WeakPolarHBondContact CE-OE1 3.06Å; K1224-E1228 HydrophobicContact CG-CG 4.42Å; K1224-E1228 WeakPolarHBondContact CG-OE1 3.24Å; K1224-E1228 IonicContact NZ-OE1 2.7Å; K1224-E1228 WeakPolarHBondContact O-CB 2.8Å; K1224-E1228 WeakPolarHBondContact O-CG 3.45Å; K1224-E1228 PolarHBondContact O-N 2.9Å; K1224-S1270 VanDerWaalsContact CB-O 3.31Å; K1224-S1270 WeakPolarHBondContact CB-O 3.46Å; K1224-S1270 WeakPolarHBondContact CD-O 3.47Å; K1224-S1270 WeakPolarHBondContact CG-O 3.43Å |
| 1225 | N | 94.4 | Very high | 91 | Very high | 15 Ų | 15 | 42.5 Ų | 42.5 | 8% | 0.08 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63 | -36.3 | 179.9 | -76.3 | -63.8 | 0 | 0 | 0 | 112.3 | G1176 A1177 L1180 E1221 D1222 A1229 | G1176-N1225 VanDerWaalsContact CA-CG 3.48Å; G1176-N1225 VanDerWaalsContact CA-OD1 3.23Å; G1176-N1225 WeakPolarHBondContact CA-OD1 3.29Å; A1177-N1225 WeakPolarHBondContact CA-O 3.21Å; A1177-N1225 HydrophobicContact CB-CB 4.35Å; A1177-N1225 PolarHBondContact N-OD1 2.85Å; L1180-N1225 HydrophobicContact CD1-CB 3.98Å; E1221-N1225 VanDerWaalsContact CD-ND2 3.34Å; E1221-N1225 WeakPolarHBondContact CG-ND2 3.25Å; E1221-N1225 WeakPolarHBondContact O-CB 3.48Å; E1221-N1225 PolarHBondContact O-N 3.41Å; E1221-N1225 PolarHBondContact O-ND2 3.08Å; E1221-N1225 PolarHBondContact OE1-ND2 3.14Å; D1222-N1225 PolarHBondContact O-N 3.05Å; N1225-A1229 WeakPolarHBondContact O-CB 3.38Å; N1225-A1229 PolarHBondContact O-N 3.31Å |
| 1226 | L | 95.3 | Very high | 91.3 | Very high | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -61.9 | -49.5 | 172 | 176 | 59.3 | 0 | 0 | 0 | 111.8 | L1180 F1184 L1194 L1209 L1212 L1213 D1222 F1223 K1224 A1229 L1230 L1240 | L1180-L1226 HydrophobicContact CD1-CB 4.42Å; F1184-L1226 HydrophobicContact CE2-CD1 4.33Å; F1184-L1226 HydrophobicContact CZ-CD1 3.71Å; L1194-L1226 HydrophobicContact CD1-CD1 3.93Å; L1194-L1226 HydrophobicContact CD2-CD1 4.22Å; L1209-L1226 HydrophobicContact CD1-CD2 4.09Å; L1212-L1226 HydrophobicContact CD2-CD1 4.09Å; L1212-L1226 HydrophobicContact CD2-CD2 4.39Å; L1213-L1226 HydrophobicContact CD2-CB 4.31Å; L1213-L1226 HydrophobicContact CD2-CD2 3.78Å; L1213-L1226 HydrophobicContact CG-CD2 4.44Å; D1222-L1226 WeakPolarHBondContact O-CB 3.34Å; D1222-L1226 PolarHBondContact O-N 3.25Å; F1223-L1226 HydrophobicContact CD2-CD2 4.41Å; F1223-L1226 PolarHBondContact O-N 3.47Å; K1224-L1226 VanDerWaalsContact C-N 3.31Å; K1224-L1226 PolarHBondContact O-N 2.91Å; L1226-A1229 PolarHBondContact O-N 2.71Å; L1226-L1230 HydrophobicContact CD1-CD1 3.87Å; L1226-L1230 HydrophobicContact CD1-CG 4.33Å; L1226-L1230 HydrophobicContact CG-CD1 4.05Å; L1226-L1230 WeakPolarHBondContact O-CD1 3.36Å; L1226-L1230 VanDerWaalsContact O-CG 3.24Å; L1226-L1230 WeakPolarHBondContact O-CG 3.22Å; L1226-L1230 PolarHBondContact O-N 2.89Å; L1226-L1240 HydrophobicContact CD2-CD1 4.01Å |
| 1227 | I | 93.8 | Very high | 91.8 | Very high | 4 Ų | 4 | 36.7 Ų | 36.7 | 2% | 0.021 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -65.6 | -43.1 | -179.2 | -68.6 | -64.1 | 0 | 0 | 0 | 111.5 | F1223 K1224 L1230 G1231 G1232 L1237 L1240 F1271 | F1223-I1227 HydrophobicContact CD1-CG1 4.27Å; F1223-I1227 HydrophobicContact CE1-CD1 4.34Å; F1223-I1227 HydrophobicContact CE1-CG1 3.83Å; F1223-I1227 HydrophobicContact CE2-CD1 4.24Å; F1223-I1227 HydrophobicContact CE2-CG1 4.19Å; F1223-I1227 HydrophobicContact CZ-CD1 3.85Å; F1223-I1227 HydrophobicContact CZ-CG1 3.79Å; F1223-I1227 WeakPolarHBondContact O-CG1 3.42Å; F1223-I1227 PolarHBondContact O-N 3.25Å; K1224-I1227 PolarHBondContact O-N 3.34Å; I1227-L1230 PolarHBondContact O-N 3.21Å; I1227-L1230 VanDerWaalsContact O-N 3.17Å; I1227-G1231 PolarHBondContact O-N 3.44Å; I1227-G1232 WeakPolarHBondContact O-CA 3.38Å; I1227-G1232 PolarHBondContact O-N 3.49Å; I1227-L1237 HydrophobicContact CD1-CB 4.37Å; I1227-L1237 HydrophobicContact CD1-CD1 4.14Å; I1227-L1240 HydrophobicContact CD1-CB 4.3Å; I1227-L1240 HydrophobicContact CD1-CD2 4.06Å; I1227-F1271 HydrophobicContact CG1-CZ 4.43Å; I1227-F1271 HydrophobicContact CG2-CD1 4.47Å; I1227-F1271 HydrophobicContact CG2-CE1 3.66Å; I1227-F1271 HydrophobicContact CG2-CZ 4.11Å |
| 1228 | E | 93.1 | Very high | 92.1 | Very high | 93 Ų | 93 | 37 Ų | 37 | 44% | 0.435 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -60.3 | -43.5 | 174.6 | -74.4 | 176.4 | -173.4 | 0 | 0 | 111.8 | A1177 K1224 L1230 G1231 | A1177-E1228 HydrophobicContact CB-CB 3.61Å; K1224-E1228 WeakPolarHBondContact CE-OE1 3.06Å; K1224-E1228 HydrophobicContact CG-CG 4.42Å; K1224-E1228 WeakPolarHBondContact CG-OE1 3.24Å; K1224-E1228 IonicContact NZ-OE1 2.7Å; K1224-E1228 WeakPolarHBondContact O-CB 2.8Å; K1224-E1228 WeakPolarHBondContact O-CG 3.45Å; K1224-E1228 PolarHBondContact O-N 2.9Å; E1228-L1230 PolarHBondContact O-N 3.42Å; E1228-G1231 PolarHBondContact O-N 2.98Å |
| 1229 | A | 94.3 | Very high | 92.4 | Very high | 8 Ų | 8 | 34 Ų | 34 | 7% | 0.066 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -65.2 | -20 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | A1177 L1180 K1181 F1184 N1225 L1226 | A1177-A1229 WeakPolarHBondContact O-CB 3.35Å; L1180-A1229 HydrophobicContact CB-CB 3.67Å; K1181-A1229 HydrophobicContact CB-CB 4.15Å; F1184-A1229 HydrophobicContact CD2-CB 4.17Å; F1184-A1229 HydrophobicContact CE2-CB 3.64Å; N1225-A1229 WeakPolarHBondContact O-CB 3.38Å; N1225-A1229 PolarHBondContact O-N 3.31Å; L1226-A1229 PolarHBondContact O-N 2.71Å |
| 1230 | L | 94.5 | Very high | 92.6 | Very high | 8 Ų | 8 | 32 Ų | 32 | 4% | 0.042 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.6 | 2.2 | 177.2 | -68.3 | 168.5 | 0 | 0 | 0 | 114.2 | F1184 L1194 L1226 I1227 E1228 N1239 L1240 | F1184-L1230 HydrophobicContact CD2-CD2 4.36Å; F1184-L1230 HydrophobicContact CE2-CD2 3.92Å; F1184-L1230 HydrophobicContact CE2-CG 4.13Å; L1194-L1230 HydrophobicContact CB-CD2 4.19Å; L1194-L1230 HydrophobicContact CD2-CD1 3.89Å; L1194-L1230 HydrophobicContact CD2-CD2 3.96Å; L1194-L1230 HydrophobicContact CD2-CG 4.49Å; L1226-L1230 HydrophobicContact CD1-CD1 3.87Å; L1226-L1230 HydrophobicContact CD1-CG 4.33Å; L1226-L1230 HydrophobicContact CG-CD1 4.05Å; L1226-L1230 WeakPolarHBondContact O-CD1 3.36Å; L1226-L1230 VanDerWaalsContact O-CG 3.24Å; L1226-L1230 WeakPolarHBondContact O-CG 3.22Å; L1226-L1230 PolarHBondContact O-N 2.89Å; I1227-L1230 PolarHBondContact O-N 3.21Å; I1227-L1230 VanDerWaalsContact O-N 3.17Å; E1228-L1230 PolarHBondContact O-N 3.42Å; L1230-N1239 HydrophobicContact CB-CB 4.13Å; L1230-N1239 HydrophobicContact CD2-CB 4.45Å; L1230-N1239 PolarHBondContact O-ND2 2.97Å; L1230-L1240 HydrophobicContact CD1-CB 3.89Å; L1230-L1240 HydrophobicContact CD1-CD1 4.42Å |
| 1231 | G | 90.9 | Very high | 92.6 | Very high | 52 Ų | 52 | 29.3 Ų | 29.3 | 54% | 0.536 | 17% | 0.17 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 122.9 | -14.6 | -180 | 0 | 0 | 0 | 0 | 0 | 114.4 | I1227 E1228 | I1227-G1231 PolarHBondContact O-N 3.44Å; E1228-G1231 PolarHBondContact O-N 2.98Å |
| 1232 | G | 88.8 | Confident | 92.7 | Very high | 20 Ų | 20 | 31.8 Ų | 31.8 | 21% | 0.206 | 18% | 0.179 | C | C | . | . | S | Bend | trans | 78.7 | 162.1 | -178 | 0 | 0 | 0 | 0 | 0 | 114 | I1227 V1234 E1235 G1236 | I1227-G1232 WeakPolarHBondContact O-CA 3.38Å; I1227-G1232 PolarHBondContact O-N 3.49Å; G1232-V1234 PolarHBondContact O-N 3.32Å; G1232-E1235 PolarHBondContact O-N 3.28Å; G1232-G1236 PolarHBondContact O-N 3.48Å |
| 1233 | G | 89 | Confident | 92.6 | Very high | 33 Ų | 33 | 31.9 Ų | 31.9 | 34% | 0.34 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | 52.4 | -137.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | L1237 F1271 | G1233-L1237 PolarHBondContact O-N 3.08Å; G1233-F1271 WeakPolarHBondContact O-CE1 3.45Å |
| 1234 | V | 89.9 | Confident | 92.4 | Very high | 34 Ų | 34 | 31.9 Ų | 31.9 | 21% | 0.206 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.6 | -39.3 | -179.2 | -170.4 | 0 | 0 | 0 | 0 | 111.9 | G1232 L1237 E1238 E1279 I1280 K1283 | G1232-V1234 PolarHBondContact O-N 3.32Å; V1234-L1237 PolarHBondContact O-N 2.9Å; V1234-E1238 PolarHBondContact O-N 2.92Å; V1234-E1279 HydrophobicContact CG2-CB 4.45Å; V1234-E1279 HydrophobicContact CG2-CG 3.65Å; V1234-I1280 HydrophobicContact CG2-CD1 4.22Å; V1234-K1283 HydrophobicContact CG1-CB 4.09Å; V1234-K1283 HydrophobicContact CG1-CD 4.12Å; V1234-K1283 HydrophobicContact CG1-CG 3.78Å |
| 1235 | E | 91 | Very high | 91.7 | Very high | 122 Ų | 122 | 30.7 Ų | 30.7 | 57% | 0.57 | 18% | 0.182 | S | C | * | . | H | α-helix | trans | -66.1 | -45.3 | -179.2 | 178.6 | 171.6 | -176.6 | 0 | 0 | 111.5 | G1232 L1237 E1238 N1239 | G1232-E1235 PolarHBondContact O-N 3.28Å; E1235-L1237 VanDerWaalsContact C-N 3.25Å; E1235-L1237 PolarHBondContact O-N 3.46Å; E1235-E1238 PolarHBondContact O-N 3.47Å; E1235-N1239 WeakPolarHBondContact CG-ND2 3.39Å; E1235-N1239 VanDerWaalsContact O-CB 3.27Å; E1235-N1239 WeakPolarHBondContact O-CB 3.45Å; E1235-N1239 PolarHBondContact O-N 2.81Å; E1235-N1239 PolarHBondContact O-ND2 3.34Å |
| 1236 | G | 92.3 | Very high | 90.8 | Very high | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59.7 | -36.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | G1232 N1239 L1240 | G1232-G1236 PolarHBondContact O-N 3.48Å; G1236-N1239 PolarHBondContact O-N 2.84Å; G1236-L1240 WeakPolarHBondContact O-CB 3.41Å; G1236-L1240 PolarHBondContact O-N 3.39Å |
| 1237 | L | 92.8 | Very high | 90.3 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -71.4 | -42.4 | 176.2 | -170.2 | 65.1 | 0 | 0 | 0 | 112.5 | F1223 I1227 G1233 V1234 E1235 N1239 L1240 F1241 I1280 L1284 | F1223-L1237 HydrophobicContact CZ-CD1 4.38Å; I1227-L1237 HydrophobicContact CD1-CB 4.37Å; I1227-L1237 HydrophobicContact CD1-CD1 4.14Å; G1233-L1237 PolarHBondContact O-N 3.08Å; V1234-L1237 PolarHBondContact O-N 2.9Å; E1235-L1237 VanDerWaalsContact C-N 3.25Å; E1235-L1237 PolarHBondContact O-N 3.46Å; L1237-N1239 VanDerWaalsContact C-N 3.33Å; L1237-L1240 PolarHBondContact O-N 3Å; L1237-F1241 HydrophobicContact CD1-CD2 4.16Å; L1237-F1241 HydrophobicContact CD1-CE2 3.79Å; L1237-F1241 HydrophobicContact CG-CD2 4.13Å; L1237-F1241 HydrophobicContact CG-CE2 4.09Å; L1237-F1241 VanDerWaalsContact O-CD2 3.31Å; L1237-F1241 WeakPolarHBondContact O-CD2 3.17Å; L1237-F1241 PolarHBondContact O-N 3.4Å; L1237-I1280 HydrophobicContact CD2-CD1 4.25Å; L1237-I1280 HydrophobicContact CD2-CG2 4.03Å; L1237-L1284 HydrophobicContact CD2-CD2 4.25Å; L1237-L1284 HydrophobicContact CD2-CG 4.23Å |
| 1238 | E | 91.9 | Very high | 89.9 | Confident | 61 Ų | 61 | 45.5 Ų | 45.5 | 29% | 0.285 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.4 | -45.5 | 170.5 | -78.5 | -163.4 | -179.5 | 0 | 0 | 111.7 | V1234 E1235 L1240 F1241 K1242 K1283 | V1234-E1238 PolarHBondContact O-N 2.92Å; E1235-E1238 PolarHBondContact O-N 3.47Å; E1238-L1240 VanDerWaalsContact C-N 3.28Å; E1238-L1240 PolarHBondContact O-N 3.16Å; E1238-F1241 PolarHBondContact O-N 3.38Å; E1238-F1241 VanDerWaalsContact O-N 3.12Å; E1238-K1242 VanDerWaalsContact O-CG 3.29Å; E1238-K1242 WeakPolarHBondContact O-CG 3.48Å; E1238-K1242 PolarHBondContact O-N 3.48Å; E1238-K1242 IonicContact OE2-NZ 3.95Å; E1238-K1242 PolarHBondContact OE2-NZ 3.43Å; E1238-K1283 WeakPolarHBondContact OE1-CE 3.47Å; E1238-K1283 IonicContact OE1-NZ 3.08Å; E1238-K1283 PolarHBondContact OE1-NZ 3.03Å |
| 1239 | N | 93.9 | Very high | 89.7 | Confident | 21 Ų | 21 | 42.2 Ų | 42.2 | 11% | 0.112 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -66.3 | -31.8 | -177.6 | -72.3 | -15.9 | 0 | 0 | 0 | 111.7 | V1191 L1230 E1235 G1236 L1237 K1242 | V1191-N1239 HydrophobicContact CG2-CB 3.75Å; L1230-N1239 HydrophobicContact CB-CB 4.13Å; L1230-N1239 HydrophobicContact CD2-CB 4.45Å; L1230-N1239 PolarHBondContact O-ND2 2.97Å; E1235-N1239 WeakPolarHBondContact CG-ND2 3.39Å; E1235-N1239 VanDerWaalsContact O-CB 3.27Å; E1235-N1239 WeakPolarHBondContact O-CB 3.45Å; E1235-N1239 PolarHBondContact O-N 2.81Å; E1235-N1239 PolarHBondContact O-ND2 3.34Å; G1236-N1239 PolarHBondContact O-N 2.84Å; L1237-N1239 VanDerWaalsContact C-N 3.33Å; N1239-K1242 PolarHBondContact OD1-NZ 3.24Å |
| 1240 | L | 94.7 | Very high | 89.5 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.8 | -51 | 166.5 | 179.3 | 64.6 | 0 | 0 | 0 | 111.8 | L1194 F1223 L1226 I1227 L1230 G1236 L1237 E1238 K1242 V1243 I1244 L1253 | L1194-L1240 HydrophobicContact CD2-CD1 3.95Å; F1223-L1240 HydrophobicContact CE2-CD2 3.53Å; F1223-L1240 HydrophobicContact CZ-CD2 3.94Å; L1226-L1240 HydrophobicContact CD2-CD1 4.01Å; I1227-L1240 HydrophobicContact CD1-CB 4.3Å; I1227-L1240 HydrophobicContact CD1-CD2 4.06Å; L1230-L1240 HydrophobicContact CD1-CB 3.89Å; L1230-L1240 HydrophobicContact CD1-CD1 4.42Å; G1236-L1240 WeakPolarHBondContact O-CB 3.41Å; G1236-L1240 PolarHBondContact O-N 3.39Å; L1237-L1240 PolarHBondContact O-N 3Å; E1238-L1240 VanDerWaalsContact C-N 3.28Å; E1238-L1240 PolarHBondContact O-N 3.16Å; L1240-K1242 VanDerWaalsContact C-N 3.29Å; L1240-K1242 PolarHBondContact O-N 2.91Å; L1240-V1243 PolarHBondContact O-N 2.96Å; L1240-I1244 HydrophobicContact CD1-CD1 4.19Å; L1240-I1244 HydrophobicContact CD1-CG1 4.47Å; L1240-I1244 HydrophobicContact CD1-CG2 3.81Å; L1240-I1244 HydrophobicContact CD2-CD1 4.13Å; L1240-I1244 HydrophobicContact CG-CD1 3.85Å; L1240-I1244 HydrophobicContact CG-CG1 4.19Å; L1240-I1244 HydrophobicContact CG-CG2 4.44Å; L1240-I1244 PolarHBondContact O-N 3.36Å; L1240-L1253 HydrophobicContact CD2-CD1 4.37Å; L1240-L1253 HydrophobicContact CD2-CD2 4.19Å |
| 1241 | F | 91.9 | Very high | 89.2 | Confident | 19 Ų | 19 | 46.6 Ų | 46.6 | 8% | 0.083 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.7 | -26.5 | -178.4 | -82.8 | -67.6 | 0 | 0 | 0 | 113.9 | L1237 E1238 V1243 I1244 G1245 I1250 L1253 L1284 I1287 | L1237-F1241 HydrophobicContact CD1-CD2 4.16Å; L1237-F1241 HydrophobicContact CD1-CE2 3.79Å; L1237-F1241 HydrophobicContact CG-CD2 4.13Å; L1237-F1241 HydrophobicContact CG-CE2 4.09Å; L1237-F1241 VanDerWaalsContact O-CD2 3.31Å; L1237-F1241 WeakPolarHBondContact O-CD2 3.17Å; L1237-F1241 PolarHBondContact O-N 3.4Å; E1238-F1241 PolarHBondContact O-N 3.38Å; E1238-F1241 VanDerWaalsContact O-N 3.12Å; F1241-V1243 PolarHBondContact O-N 2.88Å; F1241-I1244 HydrophobicContact CD1-CD1 4.26Å; F1241-I1244 HydrophobicContact CD1-CG1 3.94Å; F1241-I1244 HydrophobicContact CE1-CD1 4.05Å; F1241-I1244 HydrophobicContact CE1-CG1 4.2Å; F1241-G1245 VanDerWaalsContact O-CA 3.24Å; F1241-G1245 WeakPolarHBondContact O-CA 3.48Å; F1241-G1245 PolarHBondContact O-N 3.01Å; F1241-I1250 HydrophobicContact CE1-CG1 3.72Å; F1241-I1250 HydrophobicContact CE2-CG1 4.48Å; F1241-I1250 HydrophobicContact CZ-CD1 4.45Å; F1241-I1250 HydrophobicContact CZ-CG1 3.52Å; F1241-L1253 HydrophobicContact CE1-CD2 4.5Å; F1241-L1253 HydrophobicContact CE2-CD2 4.21Å; F1241-L1253 HydrophobicContact CZ-CD2 3.7Å; F1241-L1284 HydrophobicContact CE2-CD2 3.95Å; F1241-L1284 HydrophobicContact CZ-CD2 4.27Å; F1241-I1287 HydrophobicContact CB-CD1 4.29Å; F1241-I1287 HydrophobicContact CD1-CG2 4.16Å; F1241-I1287 HydrophobicContact CD2-CD1 3.63Å; F1241-I1287 HydrophobicContact CD2-CG2 4.26Å; F1241-I1287 HydrophobicContact CE1-CG2 4.5Å; F1241-I1287 HydrophobicContact CE2-CD1 4.31Å; F1241-I1287 HydrophobicContact CG-CD1 4.13Å; F1241-I1287 HydrophobicContact CG-CG2 4.05Å |
| 1242 | K | 92.6 | Very high | 89.1 | Confident | 118 Ų | 118 | 44.6 Ų | 44.6 | 51% | 0.513 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -60.8 | -24.8 | 168.6 | -71 | 163.3 | -158.2 | 158 | 0 | 112.7 | V1191 E1238 N1239 L1240 | V1191-K1242 HydrophobicContact CG1-CB 3.98Å; V1191-K1242 HydrophobicContact CG2-CD 4.48Å; E1238-K1242 VanDerWaalsContact O-CG 3.29Å; E1238-K1242 WeakPolarHBondContact O-CG 3.48Å; E1238-K1242 PolarHBondContact O-N 3.48Å; E1238-K1242 IonicContact OE2-NZ 3.95Å; E1238-K1242 PolarHBondContact OE2-NZ 3.43Å; N1239-K1242 PolarHBondContact OD1-NZ 3.24Å; L1240-K1242 VanDerWaalsContact C-N 3.29Å; L1240-K1242 PolarHBondContact O-N 2.91Å |
| 1243 | V | 91.3 | Very high | 89.3 | Confident | 11 Ų | 11 | 43.6 Ų | 43.6 | 7% | 0.067 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -93.5 | -52.2 | 174.3 | -175.5 | 0 | 0 | 0 | 0 | 112.1 | V1191 L1194 T1195 L1198 M1205 L1240 F1241 | V1191-V1243 HydrophobicContact CB-CG2 4.44Å; V1191-V1243 HydrophobicContact CG1-CG2 3.63Å; V1191-V1243 WeakPolarHBondContact O-CG2 3.49Å; L1194-V1243 HydrophobicContact CB-CG2 4.32Å; L1194-V1243 HydrophobicContact CD2-CB 4.23Å; L1194-V1243 HydrophobicContact CD2-CG1 4.5Å; L1194-V1243 HydrophobicContact CD2-CG2 3.94Å; L1194-V1243 HydrophobicContact CG-CG1 4.36Å; L1194-V1243 HydrophobicContact CG-CG2 4.21Å; T1195-V1243 WeakPolarHBondContact OG1-CG1 3.35Å; T1195-V1243 WeakPolarHBondContact OG1-CG2 3.38Å; L1198-V1243 HydrophobicContact CD1-CG1 3.84Å; M1205-V1243 HydrophobicContact CE-CG1 4.08Å; M1205-V1243 HydrophobicContact SD-CG1 4.29Å; L1240-V1243 PolarHBondContact O-N 2.96Å; F1241-V1243 PolarHBondContact O-N 2.88Å |
| 1244 | I | 89.5 | Confident | 89.5 | Confident | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -87.6 | -23.8 | -167.1 | 74.9 | 169.5 | 0 | 0 | 0 | 113.8 | L1198 L1209 L1240 F1241 K1247 V1248 L1253 | L1198-I1244 HydrophobicContact CD1-CG2 4.4Å; L1209-I1244 HydrophobicContact CD2-CD1 4.21Å; L1209-I1244 HydrophobicContact CD2-CG2 4.38Å; L1240-I1244 HydrophobicContact CD1-CD1 4.19Å; L1240-I1244 HydrophobicContact CD1-CG1 4.47Å; L1240-I1244 HydrophobicContact CD1-CG2 3.81Å; L1240-I1244 HydrophobicContact CD2-CD1 4.13Å; L1240-I1244 HydrophobicContact CG-CD1 3.85Å; L1240-I1244 HydrophobicContact CG-CG1 4.19Å; L1240-I1244 HydrophobicContact CG-CG2 4.44Å; L1240-I1244 PolarHBondContact O-N 3.36Å; F1241-I1244 HydrophobicContact CD1-CD1 4.26Å; F1241-I1244 HydrophobicContact CD1-CG1 3.94Å; F1241-I1244 HydrophobicContact CE1-CD1 4.05Å; F1241-I1244 HydrophobicContact CE1-CG1 4.2Å; I1244-K1247 PolarHBondContact O-N 3.47Å; I1244-K1247 VanDerWaalsContact O-N 3.09Å; I1244-V1248 HydrophobicContact CB-CB 3.93Å; I1244-V1248 HydrophobicContact CB-CG2 3.88Å; I1244-V1248 HydrophobicContact CD1-CB 4.33Å; I1244-V1248 HydrophobicContact CD1-CG1 4.16Å; I1244-V1248 HydrophobicContact CG1-CB 4.38Å; I1244-V1248 HydrophobicContact CG2-CG2 4.48Å; I1244-V1248 PolarHBondContact O-N 3.46Å; I1244-L1253 HydrophobicContact CD1-CB 4.24Å; I1244-L1253 HydrophobicContact CD1-CD1 4.38Å; I1244-L1253 HydrophobicContact CD1-CD2 4.3Å |
| 1245 | G | 80.7 | Confident | 89.5 | Confident | 25 Ų | 25 | 46.4 Ų | 46.4 | 26% | 0.258 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | 2.8 | -111.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 117 | F1241 K1247 G1249 | F1241-G1245 VanDerWaalsContact O-CA 3.24Å; F1241-G1245 WeakPolarHBondContact O-CA 3.48Å; F1241-G1245 PolarHBondContact O-N 3.01Å; G1245-K1247 PolarHBondContact O-N 2.66Å; G1245-G1249 VanDerWaalsContact O-CA 3.25Å; G1245-G1249 WeakPolarHBondContact O-CA 3.44Å; G1245-G1249 PolarHBondContact O-N 2.9Å |
| 1246 | D | 75.4 | Confident | 89.5 | Confident | 178 Ų | 178 | 41.3 Ų | 41.3 | 95% | 0.952 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -71.2 | -11.6 | -176.1 | -56 | -33.2 | 0 | 0 | 0 | 114.3 | ||
| 1247 | K | 83.4 | Confident | 89.5 | Confident | 139 Ų | 139 | 41.3 Ų | 41.3 | 60% | 0.604 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -86.6 | -29.9 | -175.1 | -65.7 | 171.4 | 179 | 171.5 | 0 | 113.1 | M1205 N1206 I1244 G1245 | M1205-K1247 HydrophobicContact CE-CD 4.22Å; M1205-K1247 HydrophobicContact SD-CB 4.19Å; M1205-K1247 HydrophobicContact SD-CD 3.48Å; M1205-K1247 WeakPolarHBondContact SD-CD 3.38Å; N1206-K1247 PolarHBondContact ND2-O 2.81Å; I1244-K1247 PolarHBondContact O-N 3.47Å; I1244-K1247 VanDerWaalsContact O-N 3.09Å; G1245-K1247 PolarHBondContact O-N 2.66Å |
| 1248 | V | 86.4 | Confident | 89.3 | Confident | 14 Ų | 14 | 43.1 Ų | 43.1 | 9% | 0.085 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -120.1 | -45.1 | -178 | 177.7 | 0 | 0 | 0 | 0 | 110 | M1205 N1206 L1209 I1244 G1252 L1253 | M1205-V1248 HydrophobicContact CB-CG2 4.3Å; M1205-V1248 HydrophobicContact CG-CG2 3.96Å; N1206-V1248 WeakPolarHBondContact OD1-CG1 3.19Å; L1209-V1248 HydrophobicContact CD2-CG1 4.07Å; I1244-V1248 HydrophobicContact CB-CB 3.93Å; I1244-V1248 HydrophobicContact CB-CG2 3.88Å; I1244-V1248 HydrophobicContact CD1-CB 4.33Å; I1244-V1248 HydrophobicContact CD1-CG1 4.16Å; I1244-V1248 HydrophobicContact CG1-CB 4.38Å; I1244-V1248 HydrophobicContact CG2-CG2 4.48Å; I1244-V1248 PolarHBondContact O-N 3.46Å; V1248-G1252 WeakPolarHBondContact O-CA 3.47Å; V1248-G1252 PolarHBondContact O-N 3.33Å; V1248-L1253 HydrophobicContact CG1-CB 4.48Å |
| 1249 | G | 87.8 | Confident | 89.1 | Confident | 23 Ų | 23 | 41.4 Ų | 41.4 | 24% | 0.237 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | 63.2 | 176.7 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | G1245 E1251 G1252 L1253 | G1245-G1249 VanDerWaalsContact O-CA 3.25Å; G1245-G1249 WeakPolarHBondContact O-CA 3.44Å; G1245-G1249 PolarHBondContact O-N 2.9Å; G1249-E1251 VanDerWaalsContact C-N 3.31Å; G1249-E1251 PolarHBondContact O-N 3.41Å; G1249-G1252 PolarHBondContact O-N 2.87Å; G1249-L1253 PolarHBondContact O-N 3.45Å |
| 1250 | I | 90.9 | Very high | 89 | Confident | 16 Ų | 16 | 41.5 Ų | 41.5 | 8% | 0.082 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -65.4 | -36.7 | 175.2 | -67.8 | 166.1 | 0 | 0 | 0 | 110.5 | F1241 G1252 L1253 L1254 L1284 I1287 S1288 L1298 | F1241-I1250 HydrophobicContact CE1-CG1 3.72Å; F1241-I1250 HydrophobicContact CE2-CG1 4.48Å; F1241-I1250 HydrophobicContact CZ-CD1 4.45Å; F1241-I1250 HydrophobicContact CZ-CG1 3.52Å; I1250-G1252 PolarHBondContact O-N 3.32Å; I1250-L1253 PolarHBondContact O-N 2.85Å; I1250-L1254 HydrophobicContact CG2-CD1 3.66Å; I1250-L1254 HydrophobicContact CG2-CG 4.06Å; I1250-L1254 WeakPolarHBondContact O-CB 3.42Å; I1250-L1254 VanDerWaalsContact O-CG 3.23Å; I1250-L1254 WeakPolarHBondContact O-CG 3.23Å; I1250-L1254 PolarHBondContact O-N 2.94Å; I1250-L1284 HydrophobicContact CD1-CD2 4.18Å; I1250-L1284 HydrophobicContact CG1-CD2 4.33Å; I1250-I1287 HydrophobicContact CD1-CG2 4.11Å; I1250-S1288 WeakPolarHBondContact CD1-OG 3.43Å; I1250-L1298 HydrophobicContact CG2-CD1 3.95Å |
| 1251 | E | 88.8 | Confident | 88.8 | Confident | 92 Ų | 92 | 42.6 Ų | 42.6 | 43% | 0.43 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -63.8 | -40 | 177.1 | -163.3 | -172.3 | 143.5 | 0 | 0 | 112.5 | G1249 K1255 | G1249-E1251 VanDerWaalsContact C-N 3.31Å; G1249-E1251 PolarHBondContact O-N 3.41Å; E1251-K1255 HydrophobicContact CG-CD 4.44Å; E1251-K1255 WeakPolarHBondContact O-CB 3.33Å; E1251-K1255 WeakPolarHBondContact O-CD 3.45Å; E1251-K1255 WeakPolarHBondContact O-CG 3.22Å; E1251-K1255 PolarHBondContact O-N 3.04Å; E1251-K1255 VanDerWaalsContact O-N 3.08Å; E1251-K1255 VanDerWaalsContact OE1-CE 3.31Å; E1251-K1255 WeakPolarHBondContact OE1-CE 3.23Å; E1251-K1255 IonicContact OE1-NZ 2.82Å; E1251-K1255 PolarHBondContact OE1-NZ 2.86Å |
| 1252 | G | 88.8 | Confident | 88.8 | Confident | 10 Ų | 10 | 47.8 Ų | 47.8 | 10% | 0.103 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -68.1 | -46 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V1248 G1249 I1250 L1254 K1255 T1256 | V1248-G1252 WeakPolarHBondContact O-CA 3.47Å; V1248-G1252 PolarHBondContact O-N 3.33Å; G1249-G1252 PolarHBondContact O-N 2.87Å; I1250-G1252 PolarHBondContact O-N 3.32Å; G1252-L1254 PolarHBondContact O-N 3.08Å; G1252-K1255 WeakPolarHBondContact O-CB 3.4Å; G1252-K1255 PolarHBondContact O-N 3.4Å; G1252-T1256 PolarHBondContact O-N 3.31Å; G1252-T1256 PolarHBondContact O-OG1 2.89Å |
| 1253 | L | 92.8 | Very high | 88.8 | Confident | 0 Ų | 0 | 42.1 Ų | 42.1 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -59 | -48.2 | 177.2 | 177.5 | 62.6 | 0 | 0 | 0 | 111.6 | L1209 L1213 F1223 L1240 F1241 I1244 V1248 G1249 I1250 K1255 T1256 L1257 L1267 | L1209-L1253 HydrophobicContact CD2-CD1 4.1Å; L1213-L1253 HydrophobicContact CD1-CD1 4.44Å; F1223-L1253 HydrophobicContact CD2-CD1 4.41Å; F1223-L1253 HydrophobicContact CE2-CD1 3.76Å; F1223-L1253 HydrophobicContact CE2-CD2 4.39Å; F1223-L1253 HydrophobicContact CZ-CD1 4.39Å; F1223-L1253 HydrophobicContact CZ-CD2 4.28Å; L1240-L1253 HydrophobicContact CD2-CD1 4.37Å; L1240-L1253 HydrophobicContact CD2-CD2 4.19Å; F1241-L1253 HydrophobicContact CE1-CD2 4.5Å; F1241-L1253 HydrophobicContact CE2-CD2 4.21Å; F1241-L1253 HydrophobicContact CZ-CD2 3.7Å; I1244-L1253 HydrophobicContact CD1-CB 4.24Å; I1244-L1253 HydrophobicContact CD1-CD1 4.38Å; I1244-L1253 HydrophobicContact CD1-CD2 4.3Å; V1248-L1253 HydrophobicContact CG1-CB 4.48Å; G1249-L1253 PolarHBondContact O-N 3.45Å; I1250-L1253 PolarHBondContact O-N 2.85Å; L1253-K1255 VanDerWaalsContact C-N 3.31Å; L1253-K1255 PolarHBondContact O-N 3.4Å; L1253-T1256 WeakPolarHBondContact O-CB 3.43Å; L1253-T1256 PolarHBondContact O-N 3.19Å; L1253-L1257 HydrophobicContact CD1-CD1 4.12Å; L1253-L1257 HydrophobicContact CD1-CG 4.43Å; L1253-L1257 HydrophobicContact CG-CD1 4.22Å; L1253-L1257 WeakPolarHBondContact O-CG 3.48Å; L1253-L1257 PolarHBondContact O-N 2.96Å; L1253-L1267 HydrophobicContact CD2-CD1 3.86Å; L1253-L1267 HydrophobicContact CG-CD1 4.41Å |
| 1254 | L | 92.9 | Very high | 89 | Confident | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.005 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.8 | -34.6 | 178.8 | -68.1 | 176.4 | 0 | 0 | 0 | 112 | I1250 G1252 L1257 G1258 G1259 G1263 L1264 L1267 A1302 | I1250-L1254 HydrophobicContact CG2-CD1 3.66Å; I1250-L1254 HydrophobicContact CG2-CG 4.06Å; I1250-L1254 WeakPolarHBondContact O-CB 3.42Å; I1250-L1254 VanDerWaalsContact O-CG 3.23Å; I1250-L1254 WeakPolarHBondContact O-CG 3.23Å; I1250-L1254 PolarHBondContact O-N 2.94Å; G1252-L1254 PolarHBondContact O-N 3.08Å; L1254-L1257 PolarHBondContact O-N 2.92Å; L1254-G1258 PolarHBondContact O-N 3.08Å; L1254-G1259 WeakPolarHBondContact O-CA 3.5Å; L1254-G1259 PolarHBondContact O-N 3.25Å; L1254-G1263 WeakPolarHBondContact O-CA 3.42Å; L1254-L1264 HydrophobicContact CD2-CB 4.11Å; L1254-L1264 HydrophobicContact CD2-CD1 4.16Å; L1254-L1267 HydrophobicContact CD2-CB 4.48Å; L1254-L1267 HydrophobicContact CD2-CD1 4.09Å; L1254-A1302 HydrophobicContact CD1-CB 4.09Å |
| 1255 | K | 90.4 | Very high | 89.1 | Confident | 125 Ų | 125 | 42.3 Ų | 42.3 | 54% | 0.543 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.7 | -47 | 171.5 | -79.5 | 164.7 | 177 | 165.1 | 0 | 111.9 | E1251 G1252 L1253 L1257 G1258 | E1251-K1255 HydrophobicContact CG-CD 4.44Å; E1251-K1255 WeakPolarHBondContact O-CB 3.33Å; E1251-K1255 WeakPolarHBondContact O-CD 3.45Å; E1251-K1255 WeakPolarHBondContact O-CG 3.22Å; E1251-K1255 PolarHBondContact O-N 3.04Å; E1251-K1255 VanDerWaalsContact O-N 3.08Å; E1251-K1255 VanDerWaalsContact OE1-CE 3.31Å; E1251-K1255 WeakPolarHBondContact OE1-CE 3.23Å; E1251-K1255 IonicContact OE1-NZ 2.82Å; E1251-K1255 PolarHBondContact OE1-NZ 2.86Å; G1252-K1255 WeakPolarHBondContact O-CB 3.4Å; G1252-K1255 PolarHBondContact O-N 3.4Å; L1253-K1255 VanDerWaalsContact C-N 3.31Å; L1253-K1255 PolarHBondContact O-N 3.4Å; K1255-L1257 VanDerWaalsContact C-N 3.26Å; K1255-L1257 PolarHBondContact O-N 3.48Å; K1255-G1258 PolarHBondContact O-N 3.45Å |
| 1256 | T | 89.7 | Confident | 89.7 | Confident | 14 Ų | 14 | 41.8 Ų | 41.8 | 9% | 0.086 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -56.7 | -40.7 | 176.2 | -64.5 | 0 | 0 | 0 | 0 | 111.6 | I1210 L1213 Q1219 G1252 L1253 G1258 | I1210-T1256 HydrophobicContact CB-CG2 4.41Å; I1210-T1256 HydrophobicContact CG1-CG2 3.7Å; I1210-T1256 WeakPolarHBondContact CG1-OG1 3.46Å; L1213-T1256 HydrophobicContact CB-CG2 4.17Å; L1213-T1256 HydrophobicContact CD1-CG2 3.92Å; Q1219-T1256 PolarHBondContact NE2-O 3.34Å; Q1219-T1256 PolarHBondContact OE1-O 2.85Å; G1252-T1256 PolarHBondContact O-N 3.31Å; G1252-T1256 PolarHBondContact O-OG1 2.89Å; L1253-T1256 WeakPolarHBondContact O-CB 3.43Å; L1253-T1256 PolarHBondContact O-N 3.19Å; T1256-G1258 PolarHBondContact O-N 3.38Å |
| 1257 | L | 92.2 | Very high | 90.6 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 19% | 0.191 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | 10.7 | 178.7 | -62.6 | 175 | 0 | 0 | 0 | 114.9 | L1213 Q1219 F1223 L1253 L1254 K1255 G1263 T1266 L1267 | L1213-L1257 HydrophobicContact CD1-CD2 4.12Å; Q1219-L1257 HydrophobicContact CB-CD2 4.34Å; F1223-L1257 HydrophobicContact CB-CD2 3.9Å; F1223-L1257 HydrophobicContact CD1-CD1 4.17Å; F1223-L1257 HydrophobicContact CD2-CD1 4.3Å; F1223-L1257 HydrophobicContact CD2-CD2 4.2Å; F1223-L1257 HydrophobicContact CE1-CD1 4.28Å; F1223-L1257 HydrophobicContact CE2-CD1 4.37Å; F1223-L1257 HydrophobicContact CG-CD1 4.21Å; F1223-L1257 HydrophobicContact CG-CD2 3.98Å; F1223-L1257 HydrophobicContact CZ-CD1 4.37Å; L1253-L1257 HydrophobicContact CD1-CD1 4.12Å; L1253-L1257 HydrophobicContact CD1-CG 4.43Å; L1253-L1257 HydrophobicContact CG-CD1 4.22Å; L1253-L1257 WeakPolarHBondContact O-CG 3.48Å; L1253-L1257 PolarHBondContact O-N 2.96Å; L1254-L1257 PolarHBondContact O-N 2.92Å; K1255-L1257 VanDerWaalsContact C-N 3.26Å; K1255-L1257 PolarHBondContact O-N 3.48Å; L1257-G1263 WeakPolarHBondContact O-CA 3.49Å; L1257-T1266 HydrophobicContact CB-CG2 4.18Å; L1257-T1266 HydrophobicContact CD2-CG2 4.11Å; L1257-T1266 PolarHBondContact O-OG1 3.32Å; L1257-L1267 HydrophobicContact CD1-CB 3.74Å; L1257-L1267 HydrophobicContact CD1-CD1 4.19Å; L1257-L1267 HydrophobicContact CD1-CG 4.29Å |
| 1258 | G | 89.4 | Confident | 91.1 | Very high | 39 Ų | 39 | 27 Ų | 27 | 40% | 0.402 | 16% | 0.164 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 110.1 | -0 | 173.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | L1254 K1255 T1256 | L1254-G1258 PolarHBondContact O-N 3.08Å; K1255-G1258 PolarHBondContact O-N 3.45Å; T1256-G1258 PolarHBondContact O-N 3.38Å |
| 1259 | G | 88.7 | Confident | 91.3 | Very high | 24 Ų | 24 | 29.1 Ų | 29.1 | 25% | 0.247 | 18% | 0.175 | C | C | . | . | S | Bend | trans | 83.4 | 147 | 169 | 0 | 0 | 0 | 0 | 0 | 116 | L1254 K1262 G1263 | L1254-G1259 WeakPolarHBondContact O-CA 3.5Å; L1254-G1259 PolarHBondContact O-N 3.25Å; G1259-K1262 PolarHBondContact O-N 3.26Å; G1259-K1262 VanDerWaalsContact O-N 3.16Å; G1259-G1263 PolarHBondContact O-N 2.86Å |
| 1260 | G | 89.9 | Confident | 91.5 | Very high | 24 Ų | 24 | 28.3 Ų | 28.3 | 25% | 0.247 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | 56.3 | -137 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | K1262 G1263 L1264 A1302 | G1260-K1262 VanDerWaalsContact C-N 3.3Å; G1260-K1262 PolarHBondContact O-N 2.87Å; G1260-G1263 PolarHBondContact O-N 2.89Å; G1260-L1264 PolarHBondContact O-N 2.86Å; G1260-A1302 CarbonylContact C-O 3.59Å; G1260-A1302 VanDerWaalsContact C-O 3.28Å; G1260-A1302 VanDerWaalsContact CA-O 3.25Å; G1260-A1302 WeakPolarHBondContact CA-O 3.42Å |
| 1261 | A | 90.6 | Very high | 91.4 | Very high | 22 Ų | 22 | 28.9 Ų | 28.9 | 18% | 0.182 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -57.6 | -39 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | L1264 A1265 A1302 D1307 | A1261-L1264 PolarHBondContact O-N 3.2Å; A1261-A1265 WeakPolarHBondContact O-CB 3.4Å; A1261-A1265 PolarHBondContact O-N 2.74Å; A1261-A1302 PolarHBondContact N-O 3.17Å; A1261-D1307 HydrophobicContact CB-CB 3.97Å |
| 1262 | K | 91.9 | Very high | 91.1 | Very high | 128 Ų | 128 | 26 Ų | 26 | 56% | 0.557 | 16% | 0.162 | S | C | * | . | H | α-helix | trans | -63.9 | -47.3 | 179 | -168.8 | -160.2 | 171.9 | -155.5 | 0 | 110.7 | G1259 G1260 L1264 A1265 T1266 | G1259-K1262 PolarHBondContact O-N 3.26Å; G1259-K1262 VanDerWaalsContact O-N 3.16Å; G1260-K1262 VanDerWaalsContact C-N 3.3Å; G1260-K1262 PolarHBondContact O-N 2.87Å; K1262-L1264 PolarHBondContact O-N 3.36Å; K1262-A1265 PolarHBondContact O-N 2.99Å; K1262-A1265 VanDerWaalsContact O-N 3.16Å; K1262-T1266 PolarHBondContact O-N 2.8Å; K1262-T1266 PolarHBondContact O-OG1 3.2Å |
| 1263 | G | 93.1 | Very high | 90.5 | Very high | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -56.1 | -38.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | L1254 L1257 G1259 G1260 L1267 | L1254-G1263 WeakPolarHBondContact O-CA 3.42Å; L1257-G1263 WeakPolarHBondContact O-CA 3.49Å; G1259-G1263 PolarHBondContact O-N 2.86Å; G1260-G1263 PolarHBondContact O-N 2.89Å; G1263-L1267 WeakPolarHBondContact O-CB 3.31Å; G1263-L1267 PolarHBondContact O-N 2.9Å |
| 1264 | L | 94.7 | Very high | 89.7 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -72.9 | -39.6 | 177.2 | -172.1 | 60.2 | 0 | 0 | 0 | 112.2 | L1254 G1260 A1261 K1262 L1267 L1268 I1281 L1284 A1302 I1312 | L1254-L1264 HydrophobicContact CD2-CB 4.11Å; L1254-L1264 HydrophobicContact CD2-CD1 4.16Å; G1260-L1264 PolarHBondContact O-N 2.86Å; A1261-L1264 PolarHBondContact O-N 3.2Å; K1262-L1264 PolarHBondContact O-N 3.36Å; L1264-L1267 PolarHBondContact O-N 3.34Å; L1264-L1268 HydrophobicContact CD1-CD1 4.32Å; L1264-L1268 HydrophobicContact CD1-CG 4.4Å; L1264-L1268 HydrophobicContact CG-CD1 3.99Å; L1264-L1268 WeakPolarHBondContact O-CB 3.46Å; L1264-L1268 VanDerWaalsContact O-CG 3.24Å; L1264-L1268 WeakPolarHBondContact O-CG 3.45Å; L1264-L1268 PolarHBondContact O-N 2.77Å; L1264-I1281 HydrophobicContact CD1-CD1 4.16Å; L1264-L1284 HydrophobicContact CD1-CD1 4.35Å; L1264-A1302 HydrophobicContact CB-CB 4.48Å; L1264-A1302 HydrophobicContact CD2-CB 4.04Å; L1264-I1312 HydrophobicContact CD2-CD1 4.11Å; L1264-I1312 HydrophobicContact CD2-CG1 3.73Å |
| 1265 | A | 92.7 | Very high | 89 | Confident | 15 Ų | 15 | 44 Ų | 44 | 12% | 0.124 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -62.4 | -47.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112 | A1261 K1262 L1267 L1268 N1269 E1311 | A1261-A1265 WeakPolarHBondContact O-CB 3.4Å; A1261-A1265 PolarHBondContact O-N 2.74Å; K1262-A1265 PolarHBondContact O-N 2.99Å; K1262-A1265 VanDerWaalsContact O-N 3.16Å; A1265-L1267 VanDerWaalsContact C-N 3.33Å; A1265-L1267 PolarHBondContact O-N 3.07Å; A1265-L1268 PolarHBondContact O-N 3.34Å; A1265-N1269 WeakPolarHBondContact O-CB 3.48Å; A1265-N1269 PolarHBondContact O-N 2.84Å; A1265-N1269 PolarHBondContact O-ND2 3.26Å; A1265-E1311 HydrophobicContact CB-CG 4.25Å; A1265-E1311 WeakPolarHBondContact CB-OE1 3.25Å |
| 1266 | T | 92.8 | Very high | 88.9 | Confident | 14 Ų | 14 | 42.2 Ų | 42.2 | 9% | 0.086 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -56.3 | -46.9 | 173.9 | -48.6 | 0 | 0 | 0 | 0 | 110.8 | Q1219 E1220 L1257 K1262 L1268 N1269 S1270 | Q1219-T1266 HydrophobicContact CB-CG2 4.41Å; E1220-T1266 HydrophobicContact CB-CG2 3.98Å; E1220-T1266 HydrophobicContact CG-CG2 4.44Å; L1257-T1266 HydrophobicContact CB-CG2 4.18Å; L1257-T1266 HydrophobicContact CD2-CG2 4.11Å; L1257-T1266 PolarHBondContact O-OG1 3.32Å; K1262-T1266 PolarHBondContact O-N 2.8Å; K1262-T1266 PolarHBondContact O-OG1 3.2Å; T1266-L1268 VanDerWaalsContact C-N 3.34Å; T1266-L1268 PolarHBondContact O-N 2.91Å; T1266-N1269 PolarHBondContact O-N 2.61Å; T1266-S1270 PolarHBondContact O-N 3.39Å |
| 1267 | L | 94.8 | Very high | 89 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.8 | -41.1 | 177.3 | -175.8 | 151.5 | 0 | 0 | 0 | 112 | F1223 L1253 L1254 L1257 G1263 L1264 A1265 S1270 F1271 I1280 L1284 | F1223-L1267 HydrophobicContact CE1-CB 4.48Å; F1223-L1267 HydrophobicContact CE1-CD1 4.43Å; F1223-L1267 HydrophobicContact CE1-CG 3.88Å; F1223-L1267 HydrophobicContact CZ-CD1 4.38Å; F1223-L1267 HydrophobicContact CZ-CG 4.32Å; L1253-L1267 HydrophobicContact CD2-CD1 3.86Å; L1253-L1267 HydrophobicContact CG-CD1 4.41Å; L1254-L1267 HydrophobicContact CD2-CB 4.48Å; L1254-L1267 HydrophobicContact CD2-CD1 4.09Å; L1257-L1267 HydrophobicContact CD1-CB 3.74Å; L1257-L1267 HydrophobicContact CD1-CD1 4.19Å; L1257-L1267 HydrophobicContact CD1-CG 4.29Å; G1263-L1267 WeakPolarHBondContact O-CB 3.31Å; G1263-L1267 PolarHBondContact O-N 2.9Å; L1264-L1267 PolarHBondContact O-N 3.34Å; A1265-L1267 VanDerWaalsContact C-N 3.33Å; A1265-L1267 PolarHBondContact O-N 3.07Å; L1267-S1270 PolarHBondContact O-OG 3.1Å; L1267-F1271 HydrophobicContact CD2-CE2 4.15Å; L1267-F1271 WeakPolarHBondContact O-CD2 3.44Å; L1267-F1271 WeakPolarHBondContact O-CE2 3.36Å; L1267-I1280 HydrophobicContact CD2-CG2 3.93Å; L1267-L1284 HydrophobicContact CD1-CD1 4.42Å; L1267-L1284 HydrophobicContact CD2-CD1 3.73Å |
| 1268 | L | 92.9 | Very high | 88.9 | Confident | 5 Ų | 5 | 45.2 Ų | 45.2 | 3% | 0.026 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -76.6 | -31 | -178 | -71.5 | 168.2 | 0 | 0 | 0 | 112.7 | L1264 A1265 T1266 K1277 I1280 I1281 E1311 A1315 | L1264-L1268 HydrophobicContact CD1-CD1 4.32Å; L1264-L1268 HydrophobicContact CD1-CG 4.4Å; L1264-L1268 HydrophobicContact CG-CD1 3.99Å; L1264-L1268 WeakPolarHBondContact O-CB 3.46Å; L1264-L1268 VanDerWaalsContact O-CG 3.24Å; L1264-L1268 WeakPolarHBondContact O-CG 3.45Å; L1264-L1268 PolarHBondContact O-N 2.77Å; A1265-L1268 PolarHBondContact O-N 3.34Å; T1266-L1268 VanDerWaalsContact C-N 3.34Å; T1266-L1268 PolarHBondContact O-N 2.91Å; L1268-K1277 HydrophobicContact CB-CD 4.31Å; L1268-K1277 HydrophobicContact CD2-CB 4.27Å; L1268-K1277 WeakPolarHBondContact O-CE 3.25Å; L1268-K1277 PolarHBondContact O-NZ 3.16Å; L1268-I1280 HydrophobicContact CD2-CG2 4.12Å; L1268-I1281 HydrophobicContact CD1-CD1 4.2Å; L1268-I1281 HydrophobicContact CD2-CD1 3.81Å; L1268-I1281 HydrophobicContact CD2-CG1 3.92Å; L1268-I1281 HydrophobicContact CG-CD1 4.44Å; L1268-E1311 HydrophobicContact CD1-CB 4.42Å; L1268-A1315 HydrophobicContact CD1-CB 4.22Å; L1268-A1315 HydrophobicContact CD2-CB 4.27Å |
| 1269 | N | 91.1 | Very high | 89.1 | Confident | 60 Ų | 60 | 47.6 Ų | 47.6 | 32% | 0.321 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -79.8 | -25.6 | -178 | -69 | -17.2 | 0 | 0 | 0 | 113.3 | E1220 A1265 T1266 F1271 G1272 K1277 | E1220-N1269 HydrophobicContact CG-CB 4.13Å; E1220-N1269 WeakPolarHBondContact OE1-CB 3.43Å; E1220-N1269 WeakPolarHBondContact OE2-CB 3.47Å; A1265-N1269 WeakPolarHBondContact O-CB 3.48Å; A1265-N1269 PolarHBondContact O-N 2.84Å; A1265-N1269 PolarHBondContact O-ND2 3.26Å; T1266-N1269 PolarHBondContact O-N 2.61Å; N1269-F1271 PolarHBondContact O-N 3.27Å; N1269-F1271 VanDerWaalsContact O-N 3.08Å; N1269-G1272 WeakPolarHBondContact O-CA 3.28Å; N1269-G1272 PolarHBondContact O-N 3.22Å; N1269-K1277 PolarHBondContact OD1-NZ 3.28Å |
| 1270 | S | 91.2 | Very high | 89.3 | Confident | 5 Ų | 5 | 46.6 Ų | 46.6 | 4% | 0.035 | 25% | 0.254 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59.3 | -19.7 | 172.5 | 73.4 | 0 | 0 | 0 | 0 | 114 | E1220 F1223 K1224 T1266 L1267 G1272 | E1220-S1270 WeakPolarHBondContact O-CB 3.37Å; F1223-S1270 VanDerWaalsContact CD1-OG 3.26Å; F1223-S1270 WeakPolarHBondContact CD1-OG 3.24Å; K1224-S1270 VanDerWaalsContact CB-O 3.31Å; K1224-S1270 WeakPolarHBondContact CB-O 3.46Å; K1224-S1270 WeakPolarHBondContact CD-O 3.47Å; K1224-S1270 WeakPolarHBondContact CG-O 3.43Å; T1266-S1270 PolarHBondContact O-N 3.39Å; L1267-S1270 PolarHBondContact O-OG 3.1Å; S1270-G1272 VanDerWaalsContact C-N 3.28Å |
| 1271 | F | 89.9 | Confident | 89.5 | Confident | 29 Ų | 29 | 45.5 Ų | 45.5 | 13% | 0.127 | 24% | 0.243 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -83.6 | -1.5 | 173.4 | -63.4 | -86.4 | 0 | 0 | 0 | 113.3 | F1223 I1227 G1233 L1267 N1269 G1275 I1280 | F1223-F1271 HydrophobicContact CE1-CE2 4.46Å; I1227-F1271 HydrophobicContact CG1-CZ 4.43Å; I1227-F1271 HydrophobicContact CG2-CD1 4.47Å; I1227-F1271 HydrophobicContact CG2-CE1 3.66Å; I1227-F1271 HydrophobicContact CG2-CZ 4.11Å; G1233-F1271 WeakPolarHBondContact O-CE1 3.45Å; L1267-F1271 HydrophobicContact CD2-CE2 4.15Å; L1267-F1271 WeakPolarHBondContact O-CD2 3.44Å; L1267-F1271 WeakPolarHBondContact O-CE2 3.36Å; N1269-F1271 PolarHBondContact O-N 3.27Å; N1269-F1271 VanDerWaalsContact O-N 3.08Å; F1271-G1275 WeakPolarHBondContact O-CA 3.5Å; F1271-G1275 PolarHBondContact O-N 2.68Å; F1271-I1280 HydrophobicContact CD1-CD1 3.83Å; F1271-I1280 HydrophobicContact CD1-CG1 3.97Å; F1271-I1280 HydrophobicContact CD2-CG1 4.06Å; F1271-I1280 HydrophobicContact CD2-CG2 4.25Å; F1271-I1280 HydrophobicContact CE1-CD1 3.38Å; F1271-I1280 HydrophobicContact CE1-CG1 3.94Å; F1271-I1280 HydrophobicContact CE2-CD1 4.16Å; F1271-I1280 HydrophobicContact CE2-CG1 4.06Å; F1271-I1280 HydrophobicContact CE2-CG2 3.79Å; F1271-I1280 HydrophobicContact CG-CD1 4.38Å; F1271-I1280 HydrophobicContact CG-CG1 4.03Å; F1271-I1280 HydrophobicContact CZ-CD1 3.58Å; F1271-I1280 HydrophobicContact CZ-CG1 4Å; F1271-I1280 HydrophobicContact CZ-CG2 4.16Å |
| 1272 | G | 81.8 | Confident | 89.7 | Confident | 31 Ų | 31 | 48.8 Ų | 48.8 | 32% | 0.32 | 25% | 0.251 | S | S | . | . | trans | 74.4 | 176.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | N1269 S1270 N1274 G1275 K1277 | N1269-G1272 WeakPolarHBondContact O-CA 3.28Å; N1269-G1272 PolarHBondContact O-N 3.22Å; S1270-G1272 VanDerWaalsContact C-N 3.28Å; G1272-N1274 VanDerWaalsContact C-N 3.32Å; G1272-G1275 PolarHBondContact O-N 2.95Å; G1272-K1277 WeakPolarHBondContact O-CE 3.24Å | ||
| 1273 | E | 76.1 | Confident | 89.7 | Confident | 190 Ų | 190 | 43.8 Ų | 43.8 | 89% | 0.888 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -69.5 | -29.4 | 176.4 | -64.3 | -167.8 | 149.5 | 0 | 0 | 113 | ||
| 1274 | N | 76.4 | Confident | 89.8 | Confident | 174 Ų | 174 | 43.8 Ų | 43.8 | 93% | 0.93 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | -3.7 | 177.5 | -64.1 | -42.5 | 0 | 0 | 0 | 113.4 | G1272 | G1272-N1274 VanDerWaalsContact C-N 3.32Š|
| 1275 | G | 78 | Confident | 89.6 | Confident | 24 Ų | 24 | 44 Ų | 44 | 25% | 0.247 | 23% | 0.23 | C | C | . | . | S | Bend | trans | -72 | 145.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | F1271 G1272 K1277 | F1271-G1275 WeakPolarHBondContact O-CA 3.5Å; F1271-G1275 PolarHBondContact O-N 2.68Å; G1272-G1275 PolarHBondContact O-N 2.95Å; G1275-K1277 PolarHBondContact O-N 2.89Å |
| 1276 | N | 88.1 | Confident | 89.6 | Confident | 88 Ų | 88 | 48.6 Ų | 48.6 | 47% | 0.471 | 25% | 0.249 | S | C | . | . | trans | -77.1 | 71.3 | 179.2 | -163.8 | -1.4 | 0 | 0 | 0 | 111.5 | E1278 E1279 I1280 | N1276-E1278 PolarHBondContact O-N 2.94Å; N1276-E1279 HydrophobicContact CB-CB 3.98Å; N1276-E1279 VanDerWaalsContact CG-CB 3.47Å; N1276-E1279 WeakPolarHBondContact ND2-CB 3.45Å; N1276-E1279 PolarHBondContact ND2-OE2 3.33Å; N1276-E1279 WeakPolarHBondContact O-CB 3.43Å; N1276-E1279 PolarHBondContact O-N 3.16Å; N1276-I1280 PolarHBondContact O-N 3.39Å; N1276-I1280 VanDerWaalsContact O-N 3.08Å | ||
| 1277 | K | 91.7 | Very high | 89.4 | Confident | 42 Ų | 42 | 50.8 Ų | 50.8 | 18% | 0.183 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -57.8 | -31.4 | -176.6 | -61.2 | -173.1 | -176.1 | -167.2 | 0 | 112.6 | L1268 N1269 G1272 G1275 I1280 I1281 A1315 | L1268-K1277 HydrophobicContact CB-CD 4.31Å; L1268-K1277 HydrophobicContact CD2-CB 4.27Å; L1268-K1277 WeakPolarHBondContact O-CE 3.25Å; L1268-K1277 PolarHBondContact O-NZ 3.16Å; N1269-K1277 PolarHBondContact OD1-NZ 3.28Å; G1272-K1277 WeakPolarHBondContact O-CE 3.24Å; G1275-K1277 PolarHBondContact O-N 2.89Å; K1277-I1280 PolarHBondContact O-N 2.9Å; K1277-I1281 PolarHBondContact O-N 3.43Å; K1277-A1315 HydrophobicContact CB-CB 3.71Å |
| 1278 | E | 91.9 | Very high | 89.1 | Confident | 35 Ų | 35 | 52 Ų | 52 | 16% | 0.164 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.1 | -47.2 | 170.9 | 155.9 | 156.2 | -161.5 | 0 | 0 | 111.8 | N1276 I1281 R1282 A1315 F1316 K1325 | N1276-E1278 PolarHBondContact O-N 2.94Å; E1278-I1281 PolarHBondContact O-N 3.24Å; E1278-R1282 VanDerWaalsContact O-CG 3.28Å; E1278-R1282 WeakPolarHBondContact O-CG 3.35Å; E1278-R1282 PolarHBondContact O-N 3.04Å; E1278-R1282 IonicContact OE1-CZ 3.45Å; E1278-R1282 VanDerWaalsContact OE1-CZ 3.31Å; E1278-R1282 IonicContact OE1-NE 3.68Å; E1278-R1282 PolarHBondContact OE1-NE 3.22Å; E1278-R1282 IonicContact OE1-NH2 2.63Å; E1278-R1282 PolarHBondContact OE1-NH2 2.95Å; E1278-A1315 PolarHBondContact N-O 3.33Å; E1278-A1315 VanDerWaalsContact N-O 3.16Å; E1278-F1316 HydrophobicContact CB-CD1 3.89Å; E1278-F1316 HydrophobicContact CB-CE1 4.15Å; E1278-F1316 HydrophobicContact CB-CG 4.44Å; E1278-F1316 HydrophobicContact CG-CD1 3.57Å; E1278-F1316 HydrophobicContact CG-CE1 3.53Å; E1278-F1316 HydrophobicContact CG-CZ 4.45Å; E1278-F1316 WeakPolarHBondContact OE1-CD1 3.4Å; E1278-F1316 WeakPolarHBondContact OE1-CE1 3.23Å; E1278-K1325 WeakPolarHBondContact OE2-CD 3.36Å; E1278-K1325 WeakPolarHBondContact OE2-CE 3.34Å; E1278-K1325 IonicContact OE2-NZ 2.67Å; E1278-K1325 PolarHBondContact OE2-NZ 2.72Å |
| 1279 | E | 92.2 | Very high | 88.8 | Confident | 90 Ų | 90 | 54.5 Ų | 54.5 | 42% | 0.421 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -69.4 | -34.8 | 179.3 | -166.8 | 178.3 | -174.7 | 0 | 0 | 112.3 | V1234 N1276 R1282 K1283 | V1234-E1279 HydrophobicContact CG2-CB 4.45Å; V1234-E1279 HydrophobicContact CG2-CG 3.65Å; N1276-E1279 HydrophobicContact CB-CB 3.98Å; N1276-E1279 VanDerWaalsContact CG-CB 3.47Å; N1276-E1279 WeakPolarHBondContact ND2-CB 3.45Å; N1276-E1279 PolarHBondContact ND2-OE2 3.33Å; N1276-E1279 WeakPolarHBondContact O-CB 3.43Å; N1276-E1279 PolarHBondContact O-N 3.16Å; E1279-R1282 PolarHBondContact O-N 3.25Å; E1279-K1283 WeakPolarHBondContact O-CB 3.07Å; E1279-K1283 PolarHBondContact O-N 3.48Å |
| 1280 | I | 93.9 | Very high | 88.6 | Confident | 3 Ų | 3 | 52.8 Ų | 52.8 | 2% | 0.015 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.2 | -45 | 171.5 | -63.2 | -56.5 | 0 | 0 | 0 | 111.6 | V1234 L1237 L1267 L1268 F1271 N1276 K1277 K1283 L1284 | V1234-I1280 HydrophobicContact CG2-CD1 4.22Å; L1237-I1280 HydrophobicContact CD2-CD1 4.25Å; L1237-I1280 HydrophobicContact CD2-CG2 4.03Å; L1267-I1280 HydrophobicContact CD2-CG2 3.93Å; L1268-I1280 HydrophobicContact CD2-CG2 4.12Å; F1271-I1280 HydrophobicContact CD1-CD1 3.83Å; F1271-I1280 HydrophobicContact CD1-CG1 3.97Å; F1271-I1280 HydrophobicContact CD2-CG1 4.06Å; F1271-I1280 HydrophobicContact CD2-CG2 4.25Å; F1271-I1280 HydrophobicContact CE1-CD1 3.38Å; F1271-I1280 HydrophobicContact CE1-CG1 3.94Å; F1271-I1280 HydrophobicContact CE2-CD1 4.16Å; F1271-I1280 HydrophobicContact CE2-CG1 4.06Å; F1271-I1280 HydrophobicContact CE2-CG2 3.79Å; F1271-I1280 HydrophobicContact CG-CD1 4.38Å; F1271-I1280 HydrophobicContact CG-CG1 4.03Å; F1271-I1280 HydrophobicContact CZ-CD1 3.58Å; F1271-I1280 HydrophobicContact CZ-CG1 4Å; F1271-I1280 HydrophobicContact CZ-CG2 4.16Å; N1276-I1280 PolarHBondContact O-N 3.39Å; N1276-I1280 VanDerWaalsContact O-N 3.08Å; K1277-I1280 PolarHBondContact O-N 2.9Å; I1280-K1283 PolarHBondContact O-N 3.28Å; I1280-L1284 HydrophobicContact CG2-CD1 4.25Å; I1280-L1284 WeakPolarHBondContact O-CG 3.24Å; I1280-L1284 PolarHBondContact O-N 3.38Å |
| 1281 | I | 94.3 | Very high | 88.5 | Confident | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 174.1 | -68 | -62.2 | 0 | 0 | 0 | 111.5 | L1264 L1268 K1277 E1278 K1283 L1284 I1285 L1298 I1312 A1315 F1316 | L1264-I1281 HydrophobicContact CD1-CD1 4.16Å; L1268-I1281 HydrophobicContact CD1-CD1 4.2Å; L1268-I1281 HydrophobicContact CD2-CD1 3.81Å; L1268-I1281 HydrophobicContact CD2-CG1 3.92Å; L1268-I1281 HydrophobicContact CG-CD1 4.44Å; K1277-I1281 PolarHBondContact O-N 3.43Å; E1278-I1281 PolarHBondContact O-N 3.24Å; I1281-K1283 VanDerWaalsContact C-N 3.25Å; I1281-K1283 PolarHBondContact O-N 2.98Å; I1281-L1284 HydrophobicContact CD1-CD1 4.29Å; I1281-L1284 PolarHBondContact O-N 3.43Å; I1281-L1284 VanDerWaalsContact O-N 3.15Å; I1281-I1285 HydrophobicContact CG2-CD1 3.87Å; I1281-I1285 HydrophobicContact CG2-CG1 4.32Å; I1281-I1285 WeakPolarHBondContact O-CG1 3.18Å; I1281-I1285 PolarHBondContact O-N 3Å; I1281-L1298 HydrophobicContact CD1-CD2 4.49Å; I1281-L1298 HydrophobicContact CG2-CD2 4.38Å; I1281-I1312 HydrophobicContact CD1-CG1 4.07Å; I1281-I1312 HydrophobicContact CG2-CG2 4.25Å; I1281-A1315 HydrophobicContact CG1-CB 3.88Å; I1281-F1316 HydrophobicContact CB-CE2 4.03Å; I1281-F1316 HydrophobicContact CB-CZ 4.41Å; I1281-F1316 HydrophobicContact CG2-CE2 3.63Å; I1281-F1316 HydrophobicContact CG2-CZ 4.11Å |
| 1282 | R | 93.7 | Very high | 88.6 | Confident | 92 Ų | 92 | 54 Ų | 54 | 35% | 0.347 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -54.8 | -43.5 | 175.5 | -73.2 | 169.8 | 179.7 | -76.7 | -3.5 | 111.1 | E1278 E1279 I1285 E1286 F1316 S1329 | E1278-R1282 VanDerWaalsContact O-CG 3.28Å; E1278-R1282 WeakPolarHBondContact O-CG 3.35Å; E1278-R1282 PolarHBondContact O-N 3.04Å; E1278-R1282 IonicContact OE1-CZ 3.45Å; E1278-R1282 VanDerWaalsContact OE1-CZ 3.31Å; E1278-R1282 IonicContact OE1-NE 3.68Å; E1278-R1282 PolarHBondContact OE1-NE 3.22Å; E1278-R1282 IonicContact OE1-NH2 2.63Å; E1278-R1282 PolarHBondContact OE1-NH2 2.95Å; E1279-R1282 PolarHBondContact O-N 3.25Å; R1282-I1285 PolarHBondContact O-N 3.04Å; R1282-E1286 PolarHBondContact O-N 2.77Å; R1282-F1316 HydrophobicContact CG-CE1 4.32Å; R1282-F1316 HydrophobicContact CG-CZ 4.18Å; R1282-S1329 PolarHBondContact NH1-OG 2.91Å; R1282-S1329 PolarHBondContact NH2-OG 3.45Å |
| 1283 | K | 93.2 | Very high | 89 | Confident | 22 Ų | 22 | 60.1 Ų | 60.1 | 10% | 0.096 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -70.4 | -36.7 | 177.1 | -166.2 | 59.6 | 161.1 | -172.9 | 0 | 113.4 | V1234 E1238 E1279 I1280 I1281 I1285 E1286 I1287 | V1234-K1283 HydrophobicContact CG1-CB 4.09Å; V1234-K1283 HydrophobicContact CG1-CD 4.12Å; V1234-K1283 HydrophobicContact CG1-CG 3.78Å; E1238-K1283 WeakPolarHBondContact OE1-CE 3.47Å; E1238-K1283 IonicContact OE1-NZ 3.08Å; E1238-K1283 PolarHBondContact OE1-NZ 3.03Å; E1279-K1283 WeakPolarHBondContact O-CB 3.07Å; E1279-K1283 PolarHBondContact O-N 3.48Å; I1280-K1283 PolarHBondContact O-N 3.28Å; I1281-K1283 VanDerWaalsContact C-N 3.25Å; I1281-K1283 PolarHBondContact O-N 2.98Å; K1283-I1285 VanDerWaalsContact C-N 3.32Å; K1283-I1285 PolarHBondContact O-N 2.95Å; K1283-E1286 HydrophobicContact CD-CB 4.27Å; K1283-E1286 WeakPolarHBondContact CD-OE2 3.35Å; K1283-E1286 IonicContact NZ-OE1 3.4Å; K1283-E1286 PolarHBondContact NZ-OE1 3.44Å; K1283-E1286 IonicContact NZ-OE2 3.01Å; K1283-E1286 PolarHBondContact NZ-OE2 3.28Å; K1283-E1286 WeakPolarHBondContact O-CB 3.14Å; K1283-E1286 PolarHBondContact O-N 3.13Å; K1283-I1287 HydrophobicContact CD-CD1 4.43Å; K1283-I1287 HydrophobicContact CD-CG1 4.48Å; K1283-I1287 HydrophobicContact CG-CD1 3.91Å; K1283-I1287 HydrophobicContact CG-CG1 4.37Å; K1283-I1287 WeakPolarHBondContact O-CB 3.1Å; K1283-I1287 WeakPolarHBondContact O-CG1 3.26Å; K1283-I1287 PolarHBondContact O-N 3.12Å |
| 1284 | L | 93.6 | Very high | 89.7 | Confident | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.005 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.5 | -35.9 | 173.2 | -75.4 | 171 | 0 | 0 | 0 | 112.2 | L1237 F1241 I1250 L1264 L1267 I1280 I1281 S1288 L1298 | L1237-L1284 HydrophobicContact CD2-CD2 4.25Å; L1237-L1284 HydrophobicContact CD2-CG 4.23Å; F1241-L1284 HydrophobicContact CE2-CD2 3.95Å; F1241-L1284 HydrophobicContact CZ-CD2 4.27Å; I1250-L1284 HydrophobicContact CD1-CD2 4.18Å; I1250-L1284 HydrophobicContact CG1-CD2 4.33Å; L1264-L1284 HydrophobicContact CD1-CD1 4.35Å; L1267-L1284 HydrophobicContact CD1-CD1 4.42Å; L1267-L1284 HydrophobicContact CD2-CD1 3.73Å; I1280-L1284 HydrophobicContact CG2-CD1 4.25Å; I1280-L1284 WeakPolarHBondContact O-CG 3.24Å; I1280-L1284 PolarHBondContact O-N 3.38Å; I1281-L1284 HydrophobicContact CD1-CD1 4.29Å; I1281-L1284 PolarHBondContact O-N 3.43Å; I1281-L1284 VanDerWaalsContact O-N 3.15Å; L1284-S1288 VanDerWaalsContact O-CB 3.23Å; L1284-S1288 WeakPolarHBondContact O-CB 3.33Å; L1284-S1288 PolarHBondContact O-N 3.18Å; L1284-S1288 PolarHBondContact O-OG 2.91Å; L1284-L1298 HydrophobicContact CB-CD1 4.09Å; L1284-L1298 HydrophobicContact CB-CD2 3.9Å; L1284-L1298 HydrophobicContact CD1-CD1 4.41Å |
| 1285 | I | 92.2 | Very high | 90.5 | Very high | 3 Ų | 3 | 42.8 Ų | 42.8 | 2% | 0.015 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64.7 | -45.8 | 172 | -68.7 | 168.9 | 0 | 0 | 0 | 110.2 | I1281 R1282 K1283 S1288 G1289 G1290 G1291 G1294 L1295 L1298 L1326 | I1281-I1285 HydrophobicContact CG2-CD1 3.87Å; I1281-I1285 HydrophobicContact CG2-CG1 4.32Å; I1281-I1285 WeakPolarHBondContact O-CG1 3.18Å; I1281-I1285 PolarHBondContact O-N 3Å; R1282-I1285 PolarHBondContact O-N 3.04Å; K1283-I1285 VanDerWaalsContact C-N 3.32Å; K1283-I1285 PolarHBondContact O-N 2.95Å; I1285-S1288 WeakPolarHBondContact O-CB 3.47Å; I1285-S1288 PolarHBondContact O-N 3.37Å; I1285-G1289 PolarHBondContact O-N 3.36Å; I1285-G1290 VanDerWaalsContact O-CA 3.31Å; I1285-G1290 WeakPolarHBondContact O-CA 3.46Å; I1285-G1290 PolarHBondContact O-N 3.32Å; I1285-G1291 WeakPolarHBondContact CG2-O 3.49Å; I1285-G1294 WeakPolarHBondContact O-CA 3.4Å; I1285-L1295 HydrophobicContact CD1-CD1 4.2Å; I1285-L1298 HydrophobicContact CG1-CD2 3.85Å; I1285-L1326 HydrophobicContact CD1-CD1 4.12Å |
| 1286 | E | 91.4 | Very high | 91.1 | Very high | 112 Ų | 112 | 43 Ų | 43 | 52% | 0.523 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -56.2 | -53.1 | 175.3 | -168.3 | -161.8 | 127.5 | 0 | 0 | 111.9 | R1282 K1283 S1288 G1289 G1290 | R1282-E1286 PolarHBondContact O-N 2.77Å; K1283-E1286 HydrophobicContact CD-CB 4.27Å; K1283-E1286 WeakPolarHBondContact CD-OE2 3.35Å; K1283-E1286 IonicContact NZ-OE1 3.4Å; K1283-E1286 PolarHBondContact NZ-OE1 3.44Å; K1283-E1286 IonicContact NZ-OE2 3.01Å; K1283-E1286 PolarHBondContact NZ-OE2 3.28Å; K1283-E1286 WeakPolarHBondContact O-CB 3.14Å; K1283-E1286 PolarHBondContact O-N 3.13Å; E1286-S1288 PolarHBondContact O-N 3.42Å; E1286-G1289 PolarHBondContact O-N 3.07Å; E1286-G1290 PolarHBondContact O-N 3.03Å |
| 1287 | I | 89 | Confident | 91.2 | Very high | 61 Ų | 61 | 40.6 Ų | 40.6 | 31% | 0.313 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -64.7 | -26.6 | 179.1 | -65.9 | 172.6 | 0 | 0 | 0 | 111.9 | F1241 I1250 K1283 G1289 | F1241-I1287 HydrophobicContact CB-CD1 4.29Å; F1241-I1287 HydrophobicContact CD1-CG2 4.16Å; F1241-I1287 HydrophobicContact CD2-CD1 3.63Å; F1241-I1287 HydrophobicContact CD2-CG2 4.26Å; F1241-I1287 HydrophobicContact CE1-CG2 4.5Å; F1241-I1287 HydrophobicContact CE2-CD1 4.31Å; F1241-I1287 HydrophobicContact CG-CD1 4.13Å; F1241-I1287 HydrophobicContact CG-CG2 4.05Å; I1250-I1287 HydrophobicContact CD1-CG2 4.11Å; K1283-I1287 HydrophobicContact CD-CD1 4.43Å; K1283-I1287 HydrophobicContact CD-CG1 4.48Å; K1283-I1287 HydrophobicContact CG-CD1 3.91Å; K1283-I1287 HydrophobicContact CG-CG1 4.37Å; K1283-I1287 WeakPolarHBondContact O-CB 3.1Å; K1283-I1287 WeakPolarHBondContact O-CG1 3.26Å; K1283-I1287 PolarHBondContact O-N 3.12Å; I1287-G1289 PolarHBondContact O-N 2.89Å |
| 1288 | S | 88.5 | Confident | 91.3 | Very high | 24 Ų | 24 | 38.6 Ų | 38.6 | 17% | 0.168 | 22% | 0.224 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -1.5 | 175 | -61.3 | 0 | 0 | 0 | 0 | 114.4 | I1250 L1284 I1285 E1286 G1294 | I1250-S1288 WeakPolarHBondContact CD1-OG 3.43Å; L1284-S1288 VanDerWaalsContact O-CB 3.23Å; L1284-S1288 WeakPolarHBondContact O-CB 3.33Å; L1284-S1288 PolarHBondContact O-N 3.18Å; L1284-S1288 PolarHBondContact O-OG 2.91Å; I1285-S1288 WeakPolarHBondContact O-CB 3.47Å; I1285-S1288 PolarHBondContact O-N 3.37Å; E1286-S1288 PolarHBondContact O-N 3.42Å; S1288-G1294 WeakPolarHBondContact CB-O 3.5Å |
| 1289 | G | 87 | Confident | 91.3 | Very high | 59 Ų | 59 | 37 Ų | 37 | 61% | 0.608 | 22% | 0.216 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 119.6 | -8.2 | -176.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | I1285 E1286 I1287 | I1285-G1289 PolarHBondContact O-N 3.36Å; E1286-G1289 PolarHBondContact O-N 3.07Å; I1287-G1289 PolarHBondContact O-N 2.89Å |
| 1290 | G | 86.9 | Confident | 91.3 | Very high | 23 Ų | 23 | 39.9 Ų | 39.9 | 24% | 0.237 | 23% | 0.227 | C | C | . | . | S | Bend | trans | 80 | 162.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | I1285 E1286 E1293 G1294 | I1285-G1290 VanDerWaalsContact O-CA 3.31Å; I1285-G1290 WeakPolarHBondContact O-CA 3.46Å; I1285-G1290 PolarHBondContact O-N 3.32Å; E1286-G1290 PolarHBondContact O-N 3.03Å; G1290-E1293 PolarHBondContact O-N 2.91Å; G1290-G1294 PolarHBondContact O-N 3.32Å |
| 1291 | G | 89.9 | Confident | 91.1 | Very high | 30 Ų | 30 | 40.9 Ų | 40.9 | 31% | 0.309 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | 55.9 | -138.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | I1285 L1295 C1330 | I1285-G1291 WeakPolarHBondContact CG2-O 3.49Å; G1291-L1295 PolarHBondContact O-N 2.91Å; G1291-C1330 VanDerWaalsContact CA-O 3.32Å; G1291-C1330 WeakPolarHBondContact CA-O 3.5Å |
| 1292 | V | 90.7 | Very high | 91 | Very high | 31 Ų | 31 | 40.9 Ų | 40.9 | 19% | 0.188 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -72.5 | -37.1 | 179.7 | -177.3 | 0 | 0 | 0 | 0 | 112.4 | L1295 A1296 C1330 E1336 A1337 V1340 | V1292-L1295 PolarHBondContact O-N 3.46Å; V1292-A1296 PolarHBondContact O-N 3Å; V1292-C1330 HydrophobicContact CG2-CB 4.12Å; V1292-E1336 HydrophobicContact CG1-CG 4.29Å; V1292-A1337 HydrophobicContact CG2-CB 4.01Å; V1292-V1340 HydrophobicContact CG1-CB 4.12Å; V1292-V1340 HydrophobicContact CG1-CG2 3.51Å |
| 1293 | E | 90.2 | Very high | 90.7 | Very high | 158 Ų | 158 | 39.2 Ų | 39.2 | 74% | 0.738 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -66.1 | -42.4 | 179.9 | -62.6 | -175.8 | 178.1 | 0 | 0 | 110.9 | G1290 A1296 A1297 | G1290-E1293 PolarHBondContact O-N 2.91Å; E1293-A1296 PolarHBondContact O-N 3.14Å; E1293-A1297 WeakPolarHBondContact O-CB 3.42Å; E1293-A1297 PolarHBondContact O-N 3.02Å |
| 1294 | G | 91.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 38.8 Ų | 38.8 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.1 | -39.6 | 173 | 0 | 0 | 0 | 0 | 0 | 113.3 | I1285 S1288 G1290 A1297 L1298 | I1285-G1294 WeakPolarHBondContact O-CA 3.4Å; S1288-G1294 WeakPolarHBondContact CB-O 3.5Å; G1290-G1294 PolarHBondContact O-N 3.32Å; G1294-A1297 PolarHBondContact O-N 3.4Å; G1294-L1298 VanDerWaalsContact O-CB 3.29Å; G1294-L1298 WeakPolarHBondContact O-CB 3.47Å; G1294-L1298 PolarHBondContact O-N 3.03Å |
| 1295 | L | 92.5 | Very high | 89.8 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64 | -44.3 | 173.1 | 179 | 61.7 | 0 | 0 | 0 | 111.4 | I1285 G1291 V1292 A1297 L1298 L1299 L1326 C1330 L1341 | I1285-L1295 HydrophobicContact CD1-CD1 4.2Å; G1291-L1295 PolarHBondContact O-N 2.91Å; V1292-L1295 PolarHBondContact O-N 3.46Å; L1295-A1297 PolarHBondContact O-N 3.26Å; L1295-L1298 PolarHBondContact O-N 2.89Å; L1295-L1299 HydrophobicContact CD1-CD1 3.87Å; L1295-L1299 HydrophobicContact CD1-CG 3.95Å; L1295-L1299 HydrophobicContact CD2-CD1 4.46Å; L1295-L1299 HydrophobicContact CG-CD1 3.81Å; L1295-L1299 HydrophobicContact CG-CG 4.33Å; L1295-L1299 WeakPolarHBondContact O-CB 3.41Å; L1295-L1299 VanDerWaalsContact O-CG 3.24Å; L1295-L1299 WeakPolarHBondContact O-CG 3.48Å; L1295-L1299 PolarHBondContact O-N 3.3Å; L1295-L1326 HydrophobicContact CD1-CD1 4.07Å; L1295-C1330 VanDerWaalsContact CD2-SG 3.57Å; L1295-L1341 HydrophobicContact CD2-CD1 4.44Å; L1295-L1341 HydrophobicContact CD2-CD2 4.36Å; L1295-L1341 HydrophobicContact CD2-CG 4.15Å |
| 1296 | A | 91.1 | Very high | 89.6 | Confident | 30 Ų | 30 | 42.8 Ų | 42.8 | 25% | 0.248 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -60.8 | -44.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | V1292 E1293 K1300 V1340 | V1292-A1296 PolarHBondContact O-N 3Å; E1293-A1296 PolarHBondContact O-N 3.14Å; A1296-K1300 WeakPolarHBondContact O-CB 3.31Å; A1296-K1300 PolarHBondContact O-N 3.31Å; A1296-V1340 HydrophobicContact CB-CG1 3.77Å |
| 1297 | A | 91.1 | Very high | 89.5 | Confident | 37 Ų | 37 | 41.2 Ų | 41.2 | 31% | 0.306 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -68.1 | -40.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | E1293 G1294 L1295 S1301 | E1293-A1297 WeakPolarHBondContact O-CB 3.42Å; E1293-A1297 PolarHBondContact O-N 3.02Å; G1294-A1297 PolarHBondContact O-N 3.4Å; L1295-A1297 PolarHBondContact O-N 3.26Å; A1297-S1301 WeakPolarHBondContact O-CB 3.36Å; A1297-S1301 PolarHBondContact O-N 3.08Å; A1297-S1301 PolarHBondContact O-OG 2.93Å |
| 1298 | L | 93.7 | Very high | 89.6 | Confident | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.5 | -48.9 | 173.5 | 178.6 | 58.4 | 0 | 0 | 0 | 111.4 | I1250 I1281 L1284 I1285 G1294 L1295 K1300 S1301 A1302 | I1250-L1298 HydrophobicContact CG2-CD1 3.95Å; I1281-L1298 HydrophobicContact CD1-CD2 4.49Å; I1281-L1298 HydrophobicContact CG2-CD2 4.38Å; L1284-L1298 HydrophobicContact CB-CD1 4.09Å; L1284-L1298 HydrophobicContact CB-CD2 3.9Å; L1284-L1298 HydrophobicContact CD1-CD1 4.41Å; I1285-L1298 HydrophobicContact CG1-CD2 3.85Å; G1294-L1298 VanDerWaalsContact O-CB 3.29Å; G1294-L1298 WeakPolarHBondContact O-CB 3.47Å; G1294-L1298 PolarHBondContact O-N 3.03Å; L1295-L1298 PolarHBondContact O-N 2.89Å; L1298-K1300 VanDerWaalsContact C-N 3.34Å; L1298-K1300 PolarHBondContact O-N 2.76Å; L1298-S1301 PolarHBondContact O-N 3.47Å; L1298-A1302 WeakPolarHBondContact O-CB 3.22Å; L1298-A1302 PolarHBondContact O-N 2.95Å |
| 1299 | L | 91.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 37.2 Ų | 37.2 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.7 | -44.8 | 177.9 | -74.5 | 170.8 | 0 | 0 | 0 | 111.6 | L1295 A1302 G1303 G1304 I1309 I1312 V1340 L1341 M1344 | L1295-L1299 HydrophobicContact CD1-CD1 3.87Å; L1295-L1299 HydrophobicContact CD1-CG 3.95Å; L1295-L1299 HydrophobicContact CD2-CD1 4.46Å; L1295-L1299 HydrophobicContact CG-CD1 3.81Å; L1295-L1299 HydrophobicContact CG-CG 4.33Å; L1295-L1299 WeakPolarHBondContact O-CB 3.41Å; L1295-L1299 VanDerWaalsContact O-CG 3.24Å; L1295-L1299 WeakPolarHBondContact O-CG 3.48Å; L1295-L1299 PolarHBondContact O-N 3.3Å; L1299-A1302 CarbonylContact O-C 3.18Å; L1299-A1302 VanDerWaalsContact O-C 3.31Å; L1299-A1302 PolarHBondContact O-N 3.19Å; L1299-G1303 PolarHBondContact O-N 3.24Å; L1299-G1303 VanDerWaalsContact O-N 3.12Å; L1299-G1304 WeakPolarHBondContact O-CA 3.44Å; L1299-G1304 PolarHBondContact O-N 3.08Å; L1299-I1309 HydrophobicContact CD2-CD1 4.29Å; L1299-I1309 HydrophobicContact CD2-CG1 3.52Å; L1299-I1312 HydrophobicContact CD2-CD1 3.6Å; L1299-I1312 HydrophobicContact CG-CD1 4.42Å; L1299-V1340 HydrophobicContact CD1-CG1 4.48Å; L1299-L1341 HydrophobicContact CD1-CD2 3.76Å; L1299-M1344 HydrophobicContact CB-CE 4.11Å; L1299-M1344 HydrophobicContact CB-CG 4.23Å; L1299-M1344 HydrophobicContact CD1-CB 4.4Å; L1299-M1344 HydrophobicContact CD1-CG 4.05Å |
| 1300 | K | 91.3 | Very high | 89.9 | Confident | 151 Ų | 151 | 37.5 Ų | 37.5 | 66% | 0.657 | 23% | 0.229 | S | C | * | . | H | α-helix | trans | -61.8 | -42.6 | 176.2 | -177.4 | -177.7 | 175.6 | -171.3 | 0 | 111.9 | A1296 L1298 A1302 G1303 M1344 | A1296-K1300 WeakPolarHBondContact O-CB 3.31Å; A1296-K1300 PolarHBondContact O-N 3.31Å; L1298-K1300 VanDerWaalsContact C-N 3.34Å; L1298-K1300 PolarHBondContact O-N 2.76Å; K1300-A1302 VanDerWaalsContact C-N 3.32Å; K1300-A1302 PolarHBondContact O-N 3.09Å; K1300-G1303 PolarHBondContact O-N 3.16Å; K1300-M1344 HydrophobicContact CB-CE 4.33Å |
| 1301 | S | 90.8 | Very high | 90.1 | Very high | 25 Ų | 25 | 39.3 Ų | 39.3 | 18% | 0.175 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64.2 | -37 | 175.3 | -57.6 | 0 | 0 | 0 | 0 | 112 | A1297 L1298 G1303 | A1297-S1301 WeakPolarHBondContact O-CB 3.36Å; A1297-S1301 PolarHBondContact O-N 3.08Å; A1297-S1301 PolarHBondContact O-OG 2.93Å; L1298-S1301 PolarHBondContact O-N 3.47Å; S1301-G1303 PolarHBondContact O-N 3.34Å |
| 1302 | A | 91.1 | Very high | 90.3 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80 | 13.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | L1254 G1260 A1261 L1264 L1298 L1299 K1300 G1304 S1308 | L1254-A1302 HydrophobicContact CD1-CB 4.09Å; G1260-A1302 CarbonylContact C-O 3.59Å; G1260-A1302 VanDerWaalsContact C-O 3.28Å; G1260-A1302 VanDerWaalsContact CA-O 3.25Å; G1260-A1302 WeakPolarHBondContact CA-O 3.42Å; A1261-A1302 PolarHBondContact N-O 3.17Å; L1264-A1302 HydrophobicContact CB-CB 4.48Å; L1264-A1302 HydrophobicContact CD2-CB 4.04Å; L1298-A1302 WeakPolarHBondContact O-CB 3.22Å; L1298-A1302 PolarHBondContact O-N 2.95Å; L1299-A1302 CarbonylContact O-C 3.18Å; L1299-A1302 VanDerWaalsContact O-C 3.31Å; L1299-A1302 PolarHBondContact O-N 3.19Å; K1300-A1302 VanDerWaalsContact C-N 3.32Å; K1300-A1302 PolarHBondContact O-N 3.09Å; A1302-G1304 PolarHBondContact O-N 3.37Å; A1302-S1308 WeakPolarHBondContact O-CB 3.49Å; A1302-S1308 PolarHBondContact O-OG 2.79Å |
| 1303 | G | 86.6 | Confident | 90.3 | Very high | 57 Ų | 57 | 36.4 Ų | 36.4 | 59% | 0.588 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 77.9 | 8.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 116.3 | L1299 K1300 S1301 S1305 | L1299-G1303 PolarHBondContact O-N 3.24Å; L1299-G1303 VanDerWaalsContact O-N 3.12Å; K1300-G1303 PolarHBondContact O-N 3.16Å; S1301-G1303 PolarHBondContact O-N 3.34Å; G1303-S1305 PolarHBondContact O-N 3.39Å; G1303-S1305 VanDerWaalsContact O-N 3.12Å |
| 1304 | G | 82.8 | Confident | 90.3 | Very high | 12 Ų | 12 | 33.1 Ų | 33.1 | 12% | 0.124 | 20% | 0.195 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 66.7 | 10.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | L1299 A1302 M1344 | L1299-G1304 WeakPolarHBondContact O-CA 3.44Å; L1299-G1304 PolarHBondContact O-N 3.08Å; A1302-G1304 PolarHBondContact O-N 3.37Å; G1304-M1344 VanDerWaalsContact CA-CE 3.46Å |
| 1305 | S | 86.1 | Confident | 90.3 | Very high | 40 Ų | 40 | 33.8 Ų | 33.8 | 28% | 0.28 | 20% | 0.2 | S | C | . | . | trans | -78.3 | 156.2 | -172.3 | 82.3 | 0 | 0 | 0 | 0 | 113 | G1303 D1307 S1308 I1309 | G1303-S1305 PolarHBondContact O-N 3.39Å; G1303-S1305 VanDerWaalsContact O-N 3.12Å; S1305-D1307 PolarHBondContact O-N 3.17Å; S1305-D1307 PolarHBondContact OG-N 3.39Å; S1305-S1308 PolarHBondContact N-OG 3.28Å; S1305-S1308 VanDerWaalsContact O-CB 3.31Å; S1305-S1308 WeakPolarHBondContact O-CB 3.49Å; S1305-S1308 PolarHBondContact O-N 3.28Å; S1305-S1308 PolarHBondContact OG-N 2.89Å; S1305-S1308 PolarHBondContact OG-OG 2.62Å; S1305-I1309 PolarHBondContact O-N 3Å; S1305-I1309 VanDerWaalsContact O-N 3.12Å | ||
| 1306 | I | 87 | Confident | 90.2 | Very high | 48 Ų | 48 | 34 Ų | 34 | 25% | 0.246 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -55.4 | -33 | 170.7 | -167.4 | -179.7 | 0 | 0 | 0 | 112 | I1309 K1310 L1345 N1354 A1358 | I1306-I1309 PolarHBondContact O-N 2.83Å; I1306-K1310 WeakPolarHBondContact O-CG 3.3Å; I1306-K1310 PolarHBondContact O-N 2.83Å; I1306-L1345 HydrophobicContact CB-CD2 3.89Å; I1306-L1345 HydrophobicContact CG1-CD2 4.1Å; I1306-N1354 HydrophobicContact CD1-CB 3.9Å; I1306-N1354 WeakPolarHBondContact CD1-O 3.41Å; I1306-A1358 HydrophobicContact CG1-CB 4.07Å |
| 1307 | D | 89.9 | Confident | 89.9 | Confident | 79 Ų | 79 | 35.9 Ų | 35.9 | 42% | 0.422 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -76.2 | -31.5 | 178.9 | -56.7 | -48.2 | 0 | 0 | 0 | 111.7 | A1261 S1305 I1309 K1310 E1311 | A1261-D1307 HydrophobicContact CB-CB 3.97Å; S1305-D1307 PolarHBondContact O-N 3.17Å; S1305-D1307 PolarHBondContact OG-N 3.39Å; D1307-I1309 VanDerWaalsContact C-N 3.29Å; D1307-I1309 PolarHBondContact O-N 3.24Å; D1307-K1310 WeakPolarHBondContact O-CB 3.36Å; D1307-K1310 PolarHBondContact O-N 3.17Å; D1307-K1310 IonicContact OD1-NZ 3.8Å; D1307-K1310 PolarHBondContact OD1-NZ 3Å; D1307-E1311 WeakPolarHBondContact O-CG 3.45Å; D1307-E1311 PolarHBondContact O-N 2.77Å |
| 1308 | S | 90.7 | Very high | 89.6 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.6 | -38.4 | 170.1 | -43.1 | 0 | 0 | 0 | 0 | 111.1 | A1302 S1305 I1312 | A1302-S1308 WeakPolarHBondContact O-CB 3.49Å; A1302-S1308 PolarHBondContact O-OG 2.79Å; S1305-S1308 PolarHBondContact N-OG 3.28Å; S1305-S1308 VanDerWaalsContact O-CB 3.31Å; S1305-S1308 WeakPolarHBondContact O-CB 3.49Å; S1305-S1308 PolarHBondContact O-N 3.28Å; S1305-S1308 PolarHBondContact OG-N 2.89Å; S1305-S1308 PolarHBondContact OG-OG 2.62Å; S1308-I1312 WeakPolarHBondContact O-CG1 3.5Å; S1308-I1312 PolarHBondContact O-N 3.19Å |
| 1309 | I | 91 | Very high | 89.2 | Confident | 1 Ų | 1 | 36.4 Ų | 36.4 | 1% | 0.005 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -71.6 | -38.2 | 175.8 | -70.3 | 167.2 | 0 | 0 | 0 | 111.2 | L1299 S1305 I1306 D1307 I1312 L1313 L1341 L1345 L1355 A1358 | L1299-I1309 HydrophobicContact CD2-CD1 4.29Å; L1299-I1309 HydrophobicContact CD2-CG1 3.52Å; S1305-I1309 PolarHBondContact O-N 3Å; S1305-I1309 VanDerWaalsContact O-N 3.12Å; I1306-I1309 PolarHBondContact O-N 2.83Å; D1307-I1309 VanDerWaalsContact C-N 3.29Å; D1307-I1309 PolarHBondContact O-N 3.24Å; I1309-I1312 PolarHBondContact O-N 2.82Å; I1309-L1313 HydrophobicContact CG2-CD1 3.84Å; I1309-L1313 HydrophobicContact CG2-CG 4.39Å; I1309-L1313 VanDerWaalsContact O-CG 3.32Å; I1309-L1313 WeakPolarHBondContact O-CG 3.42Å; I1309-L1313 PolarHBondContact O-N 3.09Å; I1309-L1341 HydrophobicContact CD1-CD2 4.1Å; I1309-L1341 HydrophobicContact CG1-CD2 4.14Å; I1309-L1341 HydrophobicContact CG2-CD2 4.34Å; I1309-L1345 HydrophobicContact CD1-CD1 3.92Å; I1309-L1345 HydrophobicContact CD1-CD2 3.78Å; I1309-L1345 HydrophobicContact CD1-CG 3.57Å; I1309-L1355 HydrophobicContact CG2-CD1 3.87Å; I1309-A1358 HydrophobicContact CG2-CB 4.19Å |
| 1310 | K | 90.6 | Very high | 88.7 | Confident | 66 Ų | 66 | 38.6 Ų | 38.6 | 29% | 0.287 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -58 | -48 | 172.2 | -73.2 | 171.2 | -162.8 | 159.9 | 0 | 111.8 | I1306 D1307 I1312 L1313 N1314 A1358 | I1306-K1310 WeakPolarHBondContact O-CG 3.3Å; I1306-K1310 PolarHBondContact O-N 2.83Å; D1307-K1310 WeakPolarHBondContact O-CB 3.36Å; D1307-K1310 PolarHBondContact O-N 3.17Å; D1307-K1310 IonicContact OD1-NZ 3.8Å; D1307-K1310 PolarHBondContact OD1-NZ 3Å; K1310-I1312 VanDerWaalsContact C-N 3.3Å; K1310-I1312 PolarHBondContact O-N 3.41Å; K1310-L1313 CarbonylContact O-C 3.45Å; K1310-L1313 PolarHBondContact O-N 3.34Å; K1310-L1313 VanDerWaalsContact O-N 3.09Å; K1310-N1314 WeakPolarHBondContact O-CB 3.31Å; K1310-N1314 PolarHBondContact O-N 3.34Å; K1310-N1314 PolarHBondContact O-ND2 3.11Å; K1310-A1358 HydrophobicContact CG-CB 3.73Å |
| 1311 | E | 91.8 | Very high | 88.5 | Confident | 60 Ų | 60 | 37.5 Ų | 37.5 | 28% | 0.28 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -68.8 | -30.6 | -177.1 | -60.8 | -65.2 | -120.4 | 0 | 0 | 112.6 | A1265 L1268 D1307 N1314 A1315 | A1265-E1311 HydrophobicContact CB-CG 4.25Å; A1265-E1311 WeakPolarHBondContact CB-OE1 3.25Å; L1268-E1311 HydrophobicContact CD1-CB 4.42Å; D1307-E1311 WeakPolarHBondContact O-CG 3.45Å; D1307-E1311 PolarHBondContact O-N 2.77Å; E1311-N1314 PolarHBondContact OE2-ND2 3.26Å; E1311-A1315 WeakPolarHBondContact O-CB 3.49Å; E1311-A1315 PolarHBondContact O-N 2.68Å; E1311-A1315 VanDerWaalsContact O-N 3.08Å |
| 1312 | I | 93.5 | Very high | 88.5 | Confident | 1 Ų | 1 | 36.3 Ų | 36.3 | 1% | 0.005 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.1 | -51.9 | 166.2 | -71.3 | 171.4 | 0 | 0 | 0 | 110.7 | L1264 I1281 L1299 S1308 I1309 K1310 N1314 A1315 F1316 L1326 | L1264-I1312 HydrophobicContact CD2-CD1 4.11Å; L1264-I1312 HydrophobicContact CD2-CG1 3.73Å; I1281-I1312 HydrophobicContact CD1-CG1 4.07Å; I1281-I1312 HydrophobicContact CG2-CG2 4.25Å; L1299-I1312 HydrophobicContact CD2-CD1 3.6Å; L1299-I1312 HydrophobicContact CG-CD1 4.42Å; S1308-I1312 WeakPolarHBondContact O-CG1 3.5Å; S1308-I1312 PolarHBondContact O-N 3.19Å; I1309-I1312 PolarHBondContact O-N 2.82Å; K1310-I1312 VanDerWaalsContact C-N 3.3Å; K1310-I1312 PolarHBondContact O-N 3.41Å; I1312-N1314 VanDerWaalsContact C-N 3.33Å; I1312-N1314 PolarHBondContact O-N 3.27Å; I1312-A1315 WeakPolarHBondContact O-CB 3.25Å; I1312-A1315 PolarHBondContact O-N 2.68Å; I1312-A1315 VanDerWaalsContact O-N 3.16Å; I1312-F1316 HydrophobicContact CG2-CD2 4.33Å; I1312-F1316 HydrophobicContact CG2-CE2 4.23Å; I1312-F1316 WeakPolarHBondContact O-CD2 3.41Å; I1312-F1316 PolarHBondContact O-N 3.31Å; I1312-L1326 HydrophobicContact CG2-CD1 3.62Å; I1312-L1326 HydrophobicContact CG2-CD2 3.73Å; I1312-L1326 HydrophobicContact CG2-CG 4.27Å |
| 1313 | L | 91.8 | Very high | 88.4 | Confident | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.6 | -37.7 | -178.9 | -69.3 | 167.5 | 0 | 0 | 0 | 112.2 | I1309 K1310 A1315 F1316 G1317 G1318 A1322 L1323 L1326 A1358 | I1309-L1313 HydrophobicContact CG2-CD1 3.84Å; I1309-L1313 HydrophobicContact CG2-CG 4.39Å; I1309-L1313 VanDerWaalsContact O-CG 3.32Å; I1309-L1313 WeakPolarHBondContact O-CG 3.42Å; I1309-L1313 PolarHBondContact O-N 3.09Å; K1310-L1313 CarbonylContact O-C 3.45Å; K1310-L1313 PolarHBondContact O-N 3.34Å; K1310-L1313 VanDerWaalsContact O-N 3.09Å; L1313-A1315 VanDerWaalsContact C-N 3.33Å; L1313-A1315 PolarHBondContact O-N 3.41Å; L1313-F1316 PolarHBondContact O-N 3.12Å; L1313-F1316 VanDerWaalsContact O-N 3.14Å; L1313-G1317 PolarHBondContact O-N 3.45Å; L1313-G1318 WeakPolarHBondContact O-CA 3.37Å; L1313-G1318 PolarHBondContact O-N 3.26Å; L1313-A1322 HydrophobicContact CB-CB 4.4Å; L1313-A1322 HydrophobicContact CD2-CB 4.17Å; L1313-A1322 VanDerWaalsContact O-CB 3.23Å; L1313-A1322 WeakPolarHBondContact O-CB 3.39Å; L1313-L1323 HydrophobicContact CD2-CB 3.91Å; L1313-L1323 HydrophobicContact CD2-CD1 4.21Å; L1313-L1326 HydrophobicContact CD2-CD2 4.08Å; L1313-A1358 HydrophobicContact CD1-CB 4.12Å |
| 1314 | N | 90.2 | Very high | 88.4 | Confident | 89 Ų | 89 | 34.7 Ų | 34.7 | 48% | 0.476 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -61.8 | -39.7 | 174.4 | -70.6 | -22.9 | 0 | 0 | 0 | 111.3 | K1310 E1311 I1312 F1316 G1317 | K1310-N1314 WeakPolarHBondContact O-CB 3.31Å; K1310-N1314 PolarHBondContact O-N 3.34Å; K1310-N1314 PolarHBondContact O-ND2 3.11Å; E1311-N1314 PolarHBondContact OE2-ND2 3.26Å; I1312-N1314 VanDerWaalsContact C-N 3.33Å; I1312-N1314 PolarHBondContact O-N 3.27Å; N1314-F1316 PolarHBondContact O-N 2.8Å; N1314-G1317 PolarHBondContact O-N 3.38Å |
| 1315 | A | 91 | Very high | 88.8 | Confident | 13 Ų | 13 | 37.6 Ų | 37.6 | 11% | 0.107 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.9 | -26.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | L1268 K1277 E1278 I1281 E1311 I1312 L1313 | L1268-A1315 HydrophobicContact CD1-CB 4.22Å; L1268-A1315 HydrophobicContact CD2-CB 4.27Å; K1277-A1315 HydrophobicContact CB-CB 3.71Å; E1278-A1315 PolarHBondContact N-O 3.33Å; E1278-A1315 VanDerWaalsContact N-O 3.16Å; I1281-A1315 HydrophobicContact CG1-CB 3.88Å; E1311-A1315 WeakPolarHBondContact O-CB 3.49Å; E1311-A1315 PolarHBondContact O-N 2.68Å; E1311-A1315 VanDerWaalsContact O-N 3.08Å; I1312-A1315 WeakPolarHBondContact O-CB 3.25Å; I1312-A1315 PolarHBondContact O-N 2.68Å; I1312-A1315 VanDerWaalsContact O-N 3.16Å; L1313-A1315 VanDerWaalsContact C-N 3.33Å; L1313-A1315 PolarHBondContact O-N 3.41Å |
| 1316 | F | 90.3 | Very high | 89.1 | Confident | 4 Ų | 4 | 35.7 Ų | 35.7 | 2% | 0.018 | 21% | 0.209 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -88 | -2.3 | 173.5 | -76.9 | -83.6 | 0 | 0 | 0 | 114.2 | E1278 I1281 R1282 I1312 L1313 N1314 A1322 K1325 L1326 S1329 | E1278-F1316 HydrophobicContact CB-CD1 3.89Å; E1278-F1316 HydrophobicContact CB-CE1 4.15Å; E1278-F1316 HydrophobicContact CB-CG 4.44Å; E1278-F1316 HydrophobicContact CG-CD1 3.57Å; E1278-F1316 HydrophobicContact CG-CE1 3.53Å; E1278-F1316 HydrophobicContact CG-CZ 4.45Å; E1278-F1316 WeakPolarHBondContact OE1-CD1 3.4Å; E1278-F1316 WeakPolarHBondContact OE1-CE1 3.23Å; I1281-F1316 HydrophobicContact CB-CE2 4.03Å; I1281-F1316 HydrophobicContact CB-CZ 4.41Å; I1281-F1316 HydrophobicContact CG2-CE2 3.63Å; I1281-F1316 HydrophobicContact CG2-CZ 4.11Å; R1282-F1316 HydrophobicContact CG-CE1 4.32Å; R1282-F1316 HydrophobicContact CG-CZ 4.18Å; I1312-F1316 HydrophobicContact CG2-CD2 4.33Å; I1312-F1316 HydrophobicContact CG2-CE2 4.23Å; I1312-F1316 WeakPolarHBondContact O-CD2 3.41Å; I1312-F1316 PolarHBondContact O-N 3.31Å; L1313-F1316 PolarHBondContact O-N 3.12Å; L1313-F1316 VanDerWaalsContact O-N 3.14Å; N1314-F1316 PolarHBondContact O-N 2.8Å; F1316-A1322 HydrophobicContact CB-CB 3.67Å; F1316-K1325 HydrophobicContact CB-CB 4.46Å; F1316-K1325 HydrophobicContact CB-CD 4.2Å; F1316-K1325 HydrophobicContact CD1-CB 3.52Å; F1316-K1325 HydrophobicContact CD1-CD 3.88Å; F1316-K1325 HydrophobicContact CD1-CG 4.42Å; F1316-K1325 HydrophobicContact CE1-CB 4.04Å; F1316-K1325 HydrophobicContact CG-CB 4.23Å; F1316-K1325 PolarHBondContact O-NZ 2.97Å; F1316-L1326 HydrophobicContact CD2-CB 4.23Å; F1316-L1326 HydrophobicContact CD2-CD1 4.43Å; F1316-L1326 HydrophobicContact CE2-CB 4.12Å; F1316-L1326 HydrophobicContact CE2-CD1 3.71Å; F1316-L1326 HydrophobicContact CZ-CD1 4.26Å; F1316-S1329 WeakPolarHBondContact CE1-OG 3.35Å; F1316-S1329 WeakPolarHBondContact CZ-OG 3.47Å |
| 1317 | G | 85.7 | Confident | 89.3 | Confident | 70 Ų | 70 | 33.5 Ų | 33.5 | 72% | 0.722 | 20% | 0.198 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 109.4 | -0.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | L1313 N1314 | L1313-G1317 PolarHBondContact O-N 3.45Å; N1314-G1317 PolarHBondContact O-N 3.38Å |
| 1318 | G | 84.1 | Confident | 89.2 | Confident | 20 Ų | 20 | 33 Ų | 33 | 21% | 0.206 | 21% | 0.205 | C | C | . | . | S | Bend | trans | 71.7 | -179.5 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | L1313 A1322 | L1313-G1318 WeakPolarHBondContact O-CA 3.37Å; L1313-G1318 PolarHBondContact O-N 3.26Å; G1318-A1322 VanDerWaalsContact C-CB 3.48Å; G1318-A1322 WeakPolarHBondContact O-CB 3.21Å; G1318-A1322 PolarHBondContact O-N 3.37Å |
| 1319 | G | 84.5 | Confident | 89.1 | Confident | 29 Ų | 29 | 34 Ų | 34 | 30% | 0.299 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | 73.6 | -163.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | S1359 | G1319-S1359 CarbonylContact C-O 3.59Å; G1319-S1359 WeakPolarHBondContact CA-O 3.48Å; G1319-S1359 PolarHBondContact N-O 3.33Å |
| 1320 | H | 82.4 | Confident | 89 | Confident | 45 Ų | 45 | 34.4 Ų | 34.4 | 21% | 0.208 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -72.9 | -40 | 177.5 | 50.8 | -79.4 | 0 | 0 | 0 | 112.2 | A1322 L1323 A1324 L1361 L1371 | H1320-A1322 VanDerWaalsContact C-N 3.29Å; H1320-A1322 PolarHBondContact O-N 2.79Å; H1320-L1323 PolarHBondContact O-N 3.15Å; H1320-L1323 VanDerWaalsContact O-N 3.14Å; H1320-A1324 PolarHBondContact O-N 2.94Å; H1320-L1361 HydrophobicContact CB-CD1 4.13Å; H1320-L1361 HydrophobicContact CB-CD2 4.45Å; H1320-L1371 HydrophobicContact CB-CB 4.32Å; H1320-L1371 PolarHBondContact CD2-O 3.36Å |
| 1321 | E | 86 | Confident | 88.7 | Confident | 128 Ų | 128 | 33 Ų | 33 | 60% | 0.598 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -58.7 | -39.3 | 177.5 | -65.4 | -171.7 | -174.4 | 0 | 0 | 112.2 | L1323 A1324 K1325 | E1321-L1323 VanDerWaalsContact C-N 3.32Å; E1321-L1323 PolarHBondContact O-N 2.77Å; E1321-A1324 PolarHBondContact O-N 2.91Å; E1321-K1325 WeakPolarHBondContact O-CG 3.38Å; E1321-K1325 PolarHBondContact O-N 3.22Å |
| 1322 | A | 90.8 | Very high | 88.3 | Confident | 1 Ų | 1 | 38.5 Ų | 38.5 | 1% | 0.008 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -60.1 | -38.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | L1313 F1316 G1318 H1320 K1325 L1326 | L1313-A1322 HydrophobicContact CB-CB 4.4Å; L1313-A1322 HydrophobicContact CD2-CB 4.17Å; L1313-A1322 VanDerWaalsContact O-CB 3.23Å; L1313-A1322 WeakPolarHBondContact O-CB 3.39Å; F1316-A1322 HydrophobicContact CB-CB 3.67Å; G1318-A1322 VanDerWaalsContact C-CB 3.48Å; G1318-A1322 WeakPolarHBondContact O-CB 3.21Å; G1318-A1322 PolarHBondContact O-N 3.37Å; H1320-A1322 VanDerWaalsContact C-N 3.29Å; H1320-A1322 PolarHBondContact O-N 2.79Å; A1322-K1325 PolarHBondContact O-N 3.36Å; A1322-L1326 VanDerWaalsContact O-CB 3.32Å; A1322-L1326 WeakPolarHBondContact O-CB 3.29Å; A1322-L1326 PolarHBondContact O-N 3.4Å |
| 1323 | L | 89.3 | Confident | 87.9 | Confident | 2 Ų | 2 | 42.4 Ų | 42.4 | 1% | 0.01 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -67.9 | -42.9 | 176.5 | -179.4 | 56.5 | 0 | 0 | 0 | 110.8 | L1313 H1320 E1321 K1325 L1326 L1327 L1341 L1355 L1372 | L1313-L1323 HydrophobicContact CD2-CB 3.91Å; L1313-L1323 HydrophobicContact CD2-CD1 4.21Å; H1320-L1323 PolarHBondContact O-N 3.15Å; H1320-L1323 VanDerWaalsContact O-N 3.14Å; E1321-L1323 VanDerWaalsContact C-N 3.32Å; E1321-L1323 PolarHBondContact O-N 2.77Å; L1323-K1325 PolarHBondContact O-N 2.96Å; L1323-L1326 HydrophobicContact CD1-CD2 4.5Å; L1323-L1326 PolarHBondContact O-N 2.63Å; L1323-L1327 HydrophobicContact CD1-CD1 4.13Å; L1323-L1327 HydrophobicContact CD1-CG 4.13Å; L1323-L1327 HydrophobicContact CG-CD1 4.07Å; L1323-L1327 WeakPolarHBondContact O-CG 3.45Å; L1323-L1327 PolarHBondContact O-N 3.41Å; L1323-L1341 HydrophobicContact CD1-CD1 3.77Å; L1323-L1355 HydrophobicContact CD1-CD1 4.4Å; L1323-L1355 HydrophobicContact CD1-CD2 4.45Å; L1323-L1355 HydrophobicContact CD2-CD2 4.14Å; L1323-L1355 HydrophobicContact CD2-CG 4.25Å; L1323-L1372 HydrophobicContact CD2-CD1 3.77Å |
| 1324 | A | 87.5 | Confident | 87.7 | Confident | 20 Ų | 20 | 44.2 Ų | 44.2 | 17% | 0.165 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.2 | -43 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | H1320 E1321 L1327 A1328 S1375 | H1320-A1324 PolarHBondContact O-N 2.94Å; E1321-A1324 PolarHBondContact O-N 2.91Å; A1324-L1327 PolarHBondContact O-N 3.2Å; A1324-A1328 WeakPolarHBondContact O-CB 3.47Å; A1324-A1328 PolarHBondContact O-N 3.21Å; A1324-S1375 VanDerWaalsContact CB-O 3.25Å; A1324-S1375 WeakPolarHBondContact CB-O 3.41Å |
| 1325 | K | 91.2 | Very high | 87.7 | Confident | 73 Ų | 73 | 40.6 Ų | 40.6 | 32% | 0.317 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -61.5 | -41.8 | 173.9 | -71.1 | 178.8 | 175.4 | -170.6 | 0 | 112.7 | E1278 F1316 E1321 A1322 L1323 A1328 S1329 | E1278-K1325 WeakPolarHBondContact OE2-CD 3.36Å; E1278-K1325 WeakPolarHBondContact OE2-CE 3.34Å; E1278-K1325 IonicContact OE2-NZ 2.67Å; E1278-K1325 PolarHBondContact OE2-NZ 2.72Å; F1316-K1325 HydrophobicContact CB-CB 4.46Å; F1316-K1325 HydrophobicContact CB-CD 4.2Å; F1316-K1325 HydrophobicContact CD1-CB 3.52Å; F1316-K1325 HydrophobicContact CD1-CD 3.88Å; F1316-K1325 HydrophobicContact CD1-CG 4.42Å; F1316-K1325 HydrophobicContact CE1-CB 4.04Å; F1316-K1325 HydrophobicContact CG-CB 4.23Å; F1316-K1325 PolarHBondContact O-NZ 2.97Å; E1321-K1325 WeakPolarHBondContact O-CG 3.38Å; E1321-K1325 PolarHBondContact O-N 3.22Å; A1322-K1325 PolarHBondContact O-N 3.36Å; L1323-K1325 PolarHBondContact O-N 2.96Å; K1325-A1328 CarbonylContact O-C 3.59Å; K1325-A1328 PolarHBondContact O-N 3.38Å; K1325-S1329 PolarHBondContact O-N 3.12Å; K1325-S1329 PolarHBondContact O-OG 3.06Å |
| 1326 | L | 92.8 | Very high | 87.7 | Confident | 1 Ų | 1 | 43.5 Ų | 43.5 | 1% | 0.005 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63 | -47.1 | 177 | 174.6 | 63.5 | 0 | 0 | 0 | 111.2 | I1285 L1295 I1312 L1313 F1316 A1322 L1323 A1328 S1329 C1330 L1341 | I1285-L1326 HydrophobicContact CD1-CD1 4.12Å; L1295-L1326 HydrophobicContact CD1-CD1 4.07Å; I1312-L1326 HydrophobicContact CG2-CD1 3.62Å; I1312-L1326 HydrophobicContact CG2-CD2 3.73Å; I1312-L1326 HydrophobicContact CG2-CG 4.27Å; L1313-L1326 HydrophobicContact CD2-CD2 4.08Å; F1316-L1326 HydrophobicContact CD2-CB 4.23Å; F1316-L1326 HydrophobicContact CD2-CD1 4.43Å; F1316-L1326 HydrophobicContact CE2-CB 4.12Å; F1316-L1326 HydrophobicContact CE2-CD1 3.71Å; F1316-L1326 HydrophobicContact CZ-CD1 4.26Å; A1322-L1326 VanDerWaalsContact O-CB 3.32Å; A1322-L1326 WeakPolarHBondContact O-CB 3.29Å; A1322-L1326 PolarHBondContact O-N 3.4Å; L1323-L1326 HydrophobicContact CD1-CD2 4.5Å; L1323-L1326 PolarHBondContact O-N 2.63Å; L1326-A1328 PolarHBondContact O-N 3.01Å; L1326-S1329 WeakPolarHBondContact O-CA 3.39Å; L1326-S1329 WeakPolarHBondContact O-CB 3.47Å; L1326-S1329 PolarHBondContact O-N 3.42Å; L1326-C1330 PolarHBondContact O-N 3.42Å; L1326-C1330 PolarHBondContact O-SG 3.07Å; L1326-C1330 VanDerWaalsContact O-SG 3.4Å; L1326-L1341 HydrophobicContact CD2-CD1 3.99Å; L1326-L1341 HydrophobicContact CD2-CD2 4.3Å |
| 1327 | L | 90.2 | Very high | 87.8 | Confident | 2 Ų | 2 | 43.3 Ų | 43.3 | 1% | 0.01 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -63.1 | -42.5 | 177.4 | -65 | 170.1 | 0 | 0 | 0 | 111.3 | L1323 A1324 S1329 C1330 P1334 A1337 L1338 L1341 L1376 | L1323-L1327 HydrophobicContact CD1-CD1 4.13Å; L1323-L1327 HydrophobicContact CD1-CG 4.13Å; L1323-L1327 HydrophobicContact CG-CD1 4.07Å; L1323-L1327 WeakPolarHBondContact O-CG 3.45Å; L1323-L1327 PolarHBondContact O-N 3.41Å; A1324-L1327 PolarHBondContact O-N 3.2Å; L1327-S1329 PolarHBondContact O-N 3.08Å; L1327-C1330 WeakPolarHBondContact O-CB 3.42Å; L1327-C1330 PolarHBondContact O-N 3.41Å; L1327-P1334 HydrophobicContact CB-CB 4.01Å; L1327-A1337 HydrophobicContact CD2-CB 3.55Å; L1327-L1338 HydrophobicContact CD1-CB 4.38Å; L1327-L1338 HydrophobicContact CD2-CB 3.84Å; L1327-L1338 VanDerWaalsContact CD2-N 3.29Å; L1327-L1341 HydrophobicContact CD2-CD1 3.98Å; L1327-L1376 HydrophobicContact CD1-CD2 3.61Å |
| 1328 | A | 88.1 | Confident | 88.1 | Confident | 69 Ų | 69 | 40.1 Ų | 40.1 | 57% | 0.57 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -67.2 | -16.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | A1324 K1325 L1326 C1330 | A1324-A1328 WeakPolarHBondContact O-CB 3.47Å; A1324-A1328 PolarHBondContact O-N 3.21Å; K1325-A1328 CarbonylContact O-C 3.59Å; K1325-A1328 PolarHBondContact O-N 3.38Å; L1326-A1328 PolarHBondContact O-N 3.01Å; A1328-C1330 VanDerWaalsContact C-N 3.25Å |
| 1329 | S | 89.3 | Confident | 88.4 | Confident | 21 Ų | 21 | 42 Ų | 42 | 15% | 0.147 | 24% | 0.244 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | -15.2 | 170 | -54.1 | 0 | 0 | 0 | 0 | 112.6 | R1282 F1316 K1325 L1326 L1327 | R1282-S1329 PolarHBondContact NH1-OG 2.91Å; R1282-S1329 PolarHBondContact NH2-OG 3.45Å; F1316-S1329 WeakPolarHBondContact CE1-OG 3.35Å; F1316-S1329 WeakPolarHBondContact CZ-OG 3.47Å; K1325-S1329 PolarHBondContact O-N 3.12Å; K1325-S1329 PolarHBondContact O-OG 3.06Å; L1326-S1329 WeakPolarHBondContact O-CA 3.39Å; L1326-S1329 WeakPolarHBondContact O-CB 3.47Å; L1326-S1329 PolarHBondContact O-N 3.42Å; L1327-S1329 PolarHBondContact O-N 3.08Å |
| 1330 | C | 88.5 | Confident | 88.7 | Confident | 8 Ų | 8 | 41.3 Ų | 41.3 | 5% | 0.054 | 23% | 0.234 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -98.1 | 3.9 | -178.2 | -59 | 0 | 0 | 0 | 0 | 113.7 | G1291 V1292 L1295 L1326 L1327 A1328 A1337 | G1291-C1330 VanDerWaalsContact CA-O 3.32Å; G1291-C1330 WeakPolarHBondContact CA-O 3.5Å; V1292-C1330 HydrophobicContact CG2-CB 4.12Å; L1295-C1330 VanDerWaalsContact CD2-SG 3.57Å; L1326-C1330 PolarHBondContact O-N 3.42Å; L1326-C1330 PolarHBondContact O-SG 3.07Å; L1326-C1330 VanDerWaalsContact O-SG 3.4Å; L1327-C1330 WeakPolarHBondContact O-CB 3.42Å; L1327-C1330 PolarHBondContact O-N 3.41Å; A1328-C1330 VanDerWaalsContact C-N 3.25Å; C1330-A1337 HydrophobicContact CB-CB 3.66Å |
| 1331 | G | 84 | Confident | 89.1 | Confident | 36 Ų | 36 | 39.2 Ų | 39.2 | 37% | 0.371 | 23% | 0.225 | S | C | . | . | trans | 97.4 | -166.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | N1333 | G1331-N1333 PolarHBondContact O-N 3.43Š| ||
| 1332 | D | 82.4 | Confident | 89.3 | Confident | 176 Ų | 176 | 33.7 Ų | 33.7 | 94% | 0.941 | 20% | 0.199 | S | C | * | . | S | Bend | trans | -72 | -1.3 | -166.4 | -58.2 | -40.2 | 0 | 0 | 0 | 115.5 | P1334 | D1332-P1334 VanDerWaalsContact C-CD 3.49Å; D1332-P1334 VanDerWaalsContact O-CD 3.25Å; D1332-P1334 WeakPolarHBondContact O-CD 3.32Å |
| 1333 | N | 86.4 | Confident | 89.2 | Confident | 84 Ų | 84 | 38.9 Ų | 38.9 | 45% | 0.449 | 22% | 0.223 | S | C | . | . | trans | -116.1 | 79 | 179.6 | -171.2 | -6.1 | 0 | 0 | 0 | 112.1 | G1331 A1335 E1336 A1337 | G1331-N1333 PolarHBondContact O-N 3.43Å; N1333-A1335 PolarHBondContact O-N 2.71Å; N1333-A1335 PolarHBondContact OD1-N 3.43Å; N1333-E1336 WeakPolarHBondContact ND2-CB 3.43Å; N1333-E1336 PolarHBondContact O-N 3.34Å; N1333-E1336 PolarHBondContact OD1-N 3.25Å; N1333-E1336 VanDerWaalsContact OD1-N 3.15Å; N1333-A1337 PolarHBondContact O-N 3.21Å | ||
| 1334 | P | 88.1 | Confident | 89 | Confident | 38 Ų | 38 | 41.7 Ų | 41.7 | 25% | 0.247 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -65.7 | -19.8 | 178.3 | 27.4 | -35.9 | 0 | 0 | 0 | 113.4 | L1327 D1332 L1338 I1385 | L1327-P1334 HydrophobicContact CB-CB 4.01Å; D1332-P1334 VanDerWaalsContact C-CD 3.49Å; D1332-P1334 VanDerWaalsContact O-CD 3.25Å; D1332-P1334 WeakPolarHBondContact O-CD 3.32Å; P1334-L1338 WeakPolarHBondContact O-CB 3.38Å; P1334-L1338 PolarHBondContact O-N 3.05Å; P1334-I1385 HydrophobicContact CB-CD1 4.36Å; P1334-I1385 HydrophobicContact CG-CD1 3.68Å; P1334-I1385 HydrophobicContact CG-CG1 4.21Å |
| 1335 | A | 89.5 | Confident | 88.9 | Confident | 13 Ų | 13 | 41.7 Ų | 41.7 | 11% | 0.107 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -71.9 | -41 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | N1333 L1338 K1339 I1385 N1388 A1389 | N1333-A1335 PolarHBondContact O-N 2.71Å; N1333-A1335 PolarHBondContact OD1-N 3.43Å; A1335-L1338 PolarHBondContact O-N 3.1Å; A1335-K1339 VanDerWaalsContact O-CB 3.31Å; A1335-K1339 WeakPolarHBondContact O-CB 3.36Å; A1335-K1339 PolarHBondContact O-N 3.15Å; A1335-I1385 HydrophobicContact CB-CG2 4.32Å; A1335-N1388 HydrophobicContact CB-CB 4.12Å; A1335-A1389 WeakPolarHBondContact O-CB 3.29Å |
| 1336 | E | 90.6 | Very high | 88.5 | Confident | 73 Ų | 73 | 41.1 Ų | 41.1 | 34% | 0.341 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -73.4 | -36.3 | 176.8 | -165.4 | 65.7 | -160 | 0 | 0 | 111.5 | V1292 N1333 K1339 V1340 | V1292-E1336 HydrophobicContact CG1-CG 4.29Å; N1333-E1336 WeakPolarHBondContact ND2-CB 3.43Å; N1333-E1336 PolarHBondContact O-N 3.34Å; N1333-E1336 PolarHBondContact OD1-N 3.25Å; N1333-E1336 VanDerWaalsContact OD1-N 3.15Å; E1336-K1339 PolarHBondContact O-N 2.99Å; E1336-K1339 IonicContact OE1-NZ 3.36Å; E1336-K1339 PolarHBondContact OE1-NZ 3.11Å; E1336-K1339 IonicContact OE2-NZ 3.67Å; E1336-K1339 PolarHBondContact OE2-NZ 3.19Å; E1336-V1340 PolarHBondContact O-N 2.88Å |
| 1337 | A | 91.5 | Very high | 87.9 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.9 | -41.7 | 171 | 0 | 0 | 0 | 0 | 0 | 112.3 | V1292 L1327 C1330 N1333 V1340 L1341 | V1292-A1337 HydrophobicContact CG2-CB 4.01Å; L1327-A1337 HydrophobicContact CD2-CB 3.55Å; C1330-A1337 HydrophobicContact CB-CB 3.66Å; N1333-A1337 PolarHBondContact O-N 3.21Å; A1337-V1340 PolarHBondContact O-N 3.18Å; A1337-L1341 PolarHBondContact O-N 3.02Å |
| 1338 | L | 92.1 | Very high | 87.6 | Confident | 3 Ų | 3 | 47 Ų | 47 | 2% | 0.016 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -68.1 | -40.8 | 176.3 | 179.7 | 61.7 | 0 | 0 | 0 | 111.5 | L1327 P1334 A1335 V1340 L1341 L1342 L1355 I1385 L1386 A1389 | L1327-L1338 HydrophobicContact CD1-CB 4.38Å; L1327-L1338 HydrophobicContact CD2-CB 3.84Å; L1327-L1338 VanDerWaalsContact CD2-N 3.29Å; P1334-L1338 WeakPolarHBondContact O-CB 3.38Å; P1334-L1338 PolarHBondContact O-N 3.05Å; A1335-L1338 PolarHBondContact O-N 3.1Å; L1338-V1340 VanDerWaalsContact C-N 3.34Å; L1338-V1340 PolarHBondContact O-N 3.48Å; L1338-L1341 WeakPolarHBondContact O-CB 3.38Å; L1338-L1341 PolarHBondContact O-N 2.95Å; L1338-L1341 VanDerWaalsContact O-N 3.16Å; L1338-L1342 HydrophobicContact CG-CD1 4.39Å; L1338-L1342 WeakPolarHBondContact O-CG 3.15Å; L1338-L1342 PolarHBondContact O-N 3.45Å; L1338-L1355 HydrophobicContact CD1-CD2 3.4Å; L1338-L1355 VanDerWaalsContact CD1-CD2 3.4Å; L1338-I1385 HydrophobicContact CD2-CG2 3.94Å; L1338-L1386 HydrophobicContact CD2-CD1 4.14Å; L1338-A1389 HydrophobicContact CB-CB 3.93Å; L1338-A1389 HydrophobicContact CD2-CB 3.72Å; L1338-A1389 HydrophobicContact CG-CB 3.73Å |
| 1339 | K | 91.9 | Very high | 87.1 | Confident | 59 Ų | 59 | 47.1 Ų | 47.1 | 26% | 0.257 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -57.3 | -45 | 174.2 | 176.2 | -177.9 | 151.9 | -146.1 | 0 | 111.6 | A1335 E1336 L1341 L1342 E1343 A1389 | A1335-K1339 VanDerWaalsContact O-CB 3.31Å; A1335-K1339 WeakPolarHBondContact O-CB 3.36Å; A1335-K1339 PolarHBondContact O-N 3.15Å; E1336-K1339 PolarHBondContact O-N 2.99Å; E1336-K1339 IonicContact OE1-NZ 3.36Å; E1336-K1339 PolarHBondContact OE1-NZ 3.11Å; E1336-K1339 IonicContact OE2-NZ 3.67Å; E1336-K1339 PolarHBondContact OE2-NZ 3.19Å; K1339-L1341 VanDerWaalsContact C-N 3.34Å; K1339-L1341 PolarHBondContact O-N 3.27Å; K1339-L1342 PolarHBondContact O-N 2.85Å; K1339-L1342 VanDerWaalsContact O-N 3.12Å; K1339-E1343 WeakPolarHBondContact CE-OE1 3.45Å; K1339-E1343 HydrophobicContact CG-CG 4.35Å; K1339-E1343 WeakPolarHBondContact O-CG 3.23Å; K1339-E1343 PolarHBondContact O-N 3.08Å; K1339-A1389 HydrophobicContact CB-CB 4.22Å |
| 1340 | V | 90.1 | Very high | 86.9 | Confident | 16 Ų | 16 | 50 Ų | 50 | 10% | 0.097 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.5 | -40.6 | 175.1 | 162.3 | 0 | 0 | 0 | 0 | 112.2 | V1292 A1296 L1299 E1336 A1337 L1338 L1342 E1343 M1344 | V1292-V1340 HydrophobicContact CG1-CB 4.12Å; V1292-V1340 HydrophobicContact CG1-CG2 3.51Å; A1296-V1340 HydrophobicContact CB-CG1 3.77Å; L1299-V1340 HydrophobicContact CD1-CG1 4.48Å; E1336-V1340 PolarHBondContact O-N 2.88Å; A1337-V1340 PolarHBondContact O-N 3.18Å; L1338-V1340 VanDerWaalsContact C-N 3.34Å; L1338-V1340 PolarHBondContact O-N 3.48Å; V1340-L1342 VanDerWaalsContact C-N 3.33Å; V1340-L1342 PolarHBondContact O-N 3.14Å; V1340-E1343 PolarHBondContact O-N 3.36Å; V1340-M1344 HydrophobicContact CG1-CG 4.38Å; V1340-M1344 WeakPolarHBondContact O-CB 3.36Å; V1340-M1344 VanDerWaalsContact O-CG 3.27Å; V1340-M1344 WeakPolarHBondContact O-CG 3.37Å; V1340-M1344 PolarHBondContact O-N 3.4Å |
| 1341 | L | 91.4 | Very high | 86.9 | Confident | 1 Ų | 1 | 49.6 Ų | 49.6 | 1% | 0.005 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.8 | -39.9 | 173.8 | -73.8 | 163.5 | 0 | 0 | 0 | 112.1 | L1295 L1299 I1309 L1323 L1326 L1327 A1337 L1338 K1339 L1345 L1355 | L1295-L1341 HydrophobicContact CD2-CD1 4.44Å; L1295-L1341 HydrophobicContact CD2-CD2 4.36Å; L1295-L1341 HydrophobicContact CD2-CG 4.15Å; L1299-L1341 HydrophobicContact CD1-CD2 3.76Å; I1309-L1341 HydrophobicContact CD1-CD2 4.1Å; I1309-L1341 HydrophobicContact CG1-CD2 4.14Å; I1309-L1341 HydrophobicContact CG2-CD2 4.34Å; L1323-L1341 HydrophobicContact CD1-CD1 3.77Å; L1326-L1341 HydrophobicContact CD2-CD1 3.99Å; L1326-L1341 HydrophobicContact CD2-CD2 4.3Å; L1327-L1341 HydrophobicContact CD2-CD1 3.98Å; A1337-L1341 PolarHBondContact O-N 3.02Å; L1338-L1341 WeakPolarHBondContact O-CB 3.38Å; L1338-L1341 PolarHBondContact O-N 2.95Å; L1338-L1341 VanDerWaalsContact O-N 3.16Å; K1339-L1341 VanDerWaalsContact C-N 3.34Å; K1339-L1341 PolarHBondContact O-N 3.27Å; L1341-L1345 WeakPolarHBondContact O-CB 3.48Å; L1341-L1345 WeakPolarHBondContact O-CG 3.33Å; L1341-L1345 PolarHBondContact O-N 3.34Å; L1341-L1345 VanDerWaalsContact O-N 3.11Å; L1341-L1355 HydrophobicContact CB-CD1 4.41Å; L1341-L1355 HydrophobicContact CB-CD2 4.27Å |
| 1342 | L | 90.3 | Very high | 87.1 | Confident | 12 Ų | 12 | 48.1 Ų | 48.1 | 6% | 0.063 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -69.5 | -42.5 | 176.9 | -64.1 | 174.4 | 0 | 0 | 0 | 112.3 | L1338 K1339 V1340 L1345 G1346 G1347 A1351 L1352 L1355 A1389 M1390 | L1338-L1342 HydrophobicContact CG-CD1 4.39Å; L1338-L1342 WeakPolarHBondContact O-CG 3.15Å; L1338-L1342 PolarHBondContact O-N 3.45Å; K1339-L1342 PolarHBondContact O-N 2.85Å; K1339-L1342 VanDerWaalsContact O-N 3.12Å; V1340-L1342 VanDerWaalsContact C-N 3.33Å; V1340-L1342 PolarHBondContact O-N 3.14Å; L1342-L1345 CarbonylContact O-C 3.17Å; L1342-L1345 PolarHBondContact O-N 2.94Å; L1342-G1346 PolarHBondContact O-N 3.4Å; L1342-G1347 WeakPolarHBondContact O-CA 3.48Å; L1342-G1347 PolarHBondContact O-N 3.39Å; L1342-A1351 HydrophobicContact CB-CB 4.29Å; L1342-A1351 HydrophobicContact CD2-CB 4.07Å; L1342-A1351 WeakPolarHBondContact O-CB 3.45Å; L1342-L1352 VanDerWaalsContact CD2-CA 3.49Å; L1342-L1352 HydrophobicContact CD2-CB 3.73Å; L1342-L1352 HydrophobicContact CD2-CD1 4.34Å; L1342-L1355 HydrophobicContact CD2-CD2 4.17Å; L1342-A1389 HydrophobicContact CD1-CB 4.12Å; L1342-M1390 HydrophobicContact CD1-CG 4.06Å |
| 1343 | E | 88.9 | Confident | 87.3 | Confident | 110 Ų | 110 | 42.1 Ų | 42.1 | 51% | 0.514 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -64.2 | -42.4 | 176.7 | -73.6 | 179.8 | 178.6 | 0 | 0 | 111.7 | K1339 V1340 L1345 G1346 G1347 | K1339-E1343 WeakPolarHBondContact CE-OE1 3.45Å; K1339-E1343 HydrophobicContact CG-CG 4.35Å; K1339-E1343 WeakPolarHBondContact O-CG 3.23Å; K1339-E1343 PolarHBondContact O-N 3.08Å; V1340-E1343 PolarHBondContact O-N 3.36Å; E1343-L1345 VanDerWaalsContact C-N 3.29Å; E1343-L1345 PolarHBondContact O-N 2.9Å; E1343-G1346 PolarHBondContact O-N 3.26Å; E1343-G1347 PolarHBondContact O-N 3.38Å |
| 1344 | M | 85.3 | Confident | 87.4 | Confident | 61 Ų | 61 | 40.6 Ų | 40.6 | 30% | 0.3 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -64.7 | -31.3 | 173.7 | -70.5 | -59 | -58 | 0 | 0 | 112.7 | L1299 K1300 G1304 V1340 G1346 | L1299-M1344 HydrophobicContact CB-CE 4.11Å; L1299-M1344 HydrophobicContact CB-CG 4.23Å; L1299-M1344 HydrophobicContact CD1-CB 4.4Å; L1299-M1344 HydrophobicContact CD1-CG 4.05Å; K1300-M1344 HydrophobicContact CB-CE 4.33Å; G1304-M1344 VanDerWaalsContact CA-CE 3.46Å; V1340-M1344 HydrophobicContact CG1-CG 4.38Å; V1340-M1344 WeakPolarHBondContact O-CB 3.36Å; V1340-M1344 VanDerWaalsContact O-CG 3.27Å; V1340-M1344 WeakPolarHBondContact O-CG 3.37Å; V1340-M1344 PolarHBondContact O-N 3.4Å; M1344-G1346 PolarHBondContact O-N 3.1Å |
| 1345 | L | 85.5 | Confident | 87.4 | Confident | 20 Ų | 20 | 38.9 Ų | 38.9 | 11% | 0.105 | 22% | 0.219 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -78.5 | 9.8 | 171.2 | -74.7 | 169.9 | 0 | 0 | 0 | 114.2 | I1306 I1309 L1341 L1342 E1343 A1351 N1354 L1355 | I1306-L1345 HydrophobicContact CB-CD2 3.89Å; I1306-L1345 HydrophobicContact CG1-CD2 4.1Å; I1309-L1345 HydrophobicContact CD1-CD1 3.92Å; I1309-L1345 HydrophobicContact CD1-CD2 3.78Å; I1309-L1345 HydrophobicContact CD1-CG 3.57Å; L1341-L1345 WeakPolarHBondContact O-CB 3.48Å; L1341-L1345 WeakPolarHBondContact O-CG 3.33Å; L1341-L1345 PolarHBondContact O-N 3.34Å; L1341-L1345 VanDerWaalsContact O-N 3.11Å; L1342-L1345 CarbonylContact O-C 3.17Å; L1342-L1345 PolarHBondContact O-N 2.94Å; E1343-L1345 VanDerWaalsContact C-N 3.29Å; E1343-L1345 PolarHBondContact O-N 2.9Å; L1345-A1351 HydrophobicContact CB-CB 3.89Å; L1345-A1351 WeakPolarHBondContact CD1-O 3.46Å; L1345-N1354 HydrophobicContact CD1-CB 4.33Å; L1345-N1354 HydrophobicContact CD2-CB 4.24Å; L1345-L1355 HydrophobicContact CD1-CB 3.67Å; L1345-L1355 HydrophobicContact CD1-CD1 4.1Å; L1345-L1355 HydrophobicContact CD1-CG 4.42Å |
| 1346 | G | 81.8 | Confident | 87.3 | Confident | 61 Ų | 61 | 38.3 Ų | 38.3 | 63% | 0.629 | 22% | 0.215 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 109.6 | -7.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 115 | L1342 E1343 M1344 D1348 | L1342-G1346 PolarHBondContact O-N 3.4Å; E1343-G1346 PolarHBondContact O-N 3.26Å; M1344-G1346 PolarHBondContact O-N 3.1Å; G1346-D1348 PolarHBondContact O-N 3.43Å; G1346-D1348 VanDerWaalsContact O-N 3.13Å |
| 1347 | G | 80.8 | Confident | 87 | Confident | 45 Ų | 45 | 39.4 Ų | 39.4 | 46% | 0.464 | 22% | 0.222 | S | C | . | . | S | Bend | trans | 64.9 | 10.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | L1342 E1343 | L1342-G1347 WeakPolarHBondContact O-CA 3.48Å; L1342-G1347 PolarHBondContact O-N 3.39Å; E1343-G1347 PolarHBondContact O-N 3.38Å |
| 1348 | D | 83.7 | Confident | 86.7 | Confident | 81 Ų | 81 | 39.8 Ų | 39.8 | 43% | 0.433 | 23% | 0.225 | S | C | . | . | S | Bend | trans | -93 | 179 | -179.6 | 87.4 | -19.9 | 0 | 0 | 0 | 112.4 | G1346 N1350 A1351 | G1346-D1348 PolarHBondContact O-N 3.43Å; G1346-D1348 VanDerWaalsContact O-N 3.13Å; D1348-N1350 PolarHBondContact O-N 2.87Å; D1348-N1350 VanDerWaalsContact O-N 3.16Å; D1348-N1350 WeakPolarHBondContact OD1-CA 3.44Å; D1348-N1350 WeakPolarHBondContact OD1-CB 3.14Å; D1348-N1350 PolarHBondContact OD1-N 2.77Å; D1348-N1350 PolarHBondContact OD2-ND2 2.87Å; D1348-A1351 VanDerWaalsContact O-CB 3.31Å; D1348-A1351 WeakPolarHBondContact O-CB 3.42Å; D1348-A1351 PolarHBondContact O-N 2.88Å; D1348-A1351 VanDerWaalsContact O-N 3.17Å; D1348-A1351 PolarHBondContact OD1-N 3.22Å |
| 1349 | E | 76.7 | Confident | 86.3 | Confident | 71 Ų | 71 | 39.8 Ų | 39.8 | 33% | 0.332 | 23% | 0.225 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72 | -1.9 | 179.6 | -62.5 | 151.7 | 177.3 | 0 | 0 | 113.2 | K1402 T1403 | E1349-K1402 HydrophobicContact CG-CG 4.45Å; E1349-K1402 WeakPolarHBondContact OE1-CD 2.84Å; E1349-K1402 IonicContact OE1-NZ 2.59Å; E1349-K1402 PolarHBondContact OE1-NZ 2.9Å; E1349-K1402 VanDerWaalsContact OE2-CE 3.22Å; E1349-K1402 WeakPolarHBondContact OE2-CE 3.47Å; E1349-K1402 IonicContact OE2-NZ 2.98Å; E1349-K1402 PolarHBondContact OE2-NZ 2.75Å; E1349-T1403 WeakPolarHBondContact O-CA 3.37Å; E1349-T1403 WeakPolarHBondContact O-CB 3.29Å; E1349-T1403 WeakPolarHBondContact O-CG2 3.49Å; E1349-T1403 PolarHBondContact O-OG1 3.02Å; E1349-T1403 VanDerWaalsContact O-OG1 3.12Å |
| 1350 | N | 85.1 | Confident | 86 | Confident | 81 Ų | 81 | 40.3 Ų | 40.3 | 43% | 0.433 | 25% | 0.247 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -100.7 | -18.6 | 172.4 | -55.9 | -76.2 | 0 | 0 | 0 | 111.9 | D1348 L1352 R1353 N1354 | D1348-N1350 PolarHBondContact O-N 2.87Å; D1348-N1350 VanDerWaalsContact O-N 3.16Å; D1348-N1350 WeakPolarHBondContact OD1-CA 3.44Å; D1348-N1350 WeakPolarHBondContact OD1-CB 3.14Å; D1348-N1350 PolarHBondContact OD1-N 2.77Å; D1348-N1350 PolarHBondContact OD2-ND2 2.87Å; N1350-L1352 VanDerWaalsContact C-N 3.27Å; N1350-L1352 PolarHBondContact O-N 3.37Å; N1350-R1353 WeakPolarHBondContact O-CA 3.49Å; N1350-R1353 WeakPolarHBondContact O-CB 3.42Å; N1350-R1353 PolarHBondContact O-N 3.4Å; N1350-N1354 VanDerWaalsContact O-CG 3.32Å; N1350-N1354 PolarHBondContact O-N 2.88Å; N1350-N1354 PolarHBondContact O-ND2 2.96Å |
| 1351 | A | 88.7 | Confident | 85.7 | Confident | 1 Ų | 1 | 40.2 Ų | 40.2 | 1% | 0.008 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -51.6 | -42.5 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113 | L1342 L1345 D1348 N1354 L1355 | L1342-A1351 HydrophobicContact CB-CB 4.29Å; L1342-A1351 HydrophobicContact CD2-CB 4.07Å; L1342-A1351 WeakPolarHBondContact O-CB 3.45Å; L1345-A1351 HydrophobicContact CB-CB 3.89Å; L1345-A1351 WeakPolarHBondContact CD1-O 3.46Å; D1348-A1351 VanDerWaalsContact O-CB 3.31Å; D1348-A1351 WeakPolarHBondContact O-CB 3.42Å; D1348-A1351 PolarHBondContact O-N 2.88Å; D1348-A1351 VanDerWaalsContact O-N 3.17Å; D1348-A1351 PolarHBondContact OD1-N 3.22Å; A1351-N1354 PolarHBondContact O-N 3.14Å; A1351-L1355 WeakPolarHBondContact O-CB 3.27Å; A1351-L1355 PolarHBondContact O-N 2.98Å |
| 1352 | L | 88 | Confident | 85.4 | Confident | 4 Ų | 4 | 44.1 Ų | 44.1 | 2% | 0.021 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -71.4 | -36 | 176.8 | 174.2 | 61.3 | 0 | 0 | 0 | 112.7 | L1342 N1350 N1354 L1355 L1356 L1386 M1390 L1400 T1403 | L1342-L1352 VanDerWaalsContact CD2-CA 3.49Å; L1342-L1352 HydrophobicContact CD2-CB 3.73Å; L1342-L1352 HydrophobicContact CD2-CD1 4.34Å; N1350-L1352 VanDerWaalsContact C-N 3.27Å; N1350-L1352 PolarHBondContact O-N 3.37Å; L1352-N1354 VanDerWaalsContact C-N 3.33Å; L1352-L1355 PolarHBondContact O-N 3.17Å; L1352-L1356 HydrophobicContact CD1-CD1 4.23Å; L1352-L1356 HydrophobicContact CD1-CG 4.2Å; L1352-L1356 HydrophobicContact CG-CD1 4.18Å; L1352-L1356 WeakPolarHBondContact O-CB 3.34Å; L1352-L1356 VanDerWaalsContact O-CG 3.32Å; L1352-L1356 WeakPolarHBondContact O-CG 3.45Å; L1352-L1356 PolarHBondContact O-N 3.41Å; L1352-L1386 HydrophobicContact CD1-CD1 4.08Å; L1352-L1386 HydrophobicContact CD2-CD1 4.28Å; L1352-L1386 HydrophobicContact CD2-CD2 3.93Å; L1352-L1386 HydrophobicContact CD2-CG 4.15Å; L1352-M1390 HydrophobicContact CD2-CE 4.14Å; L1352-M1390 HydrophobicContact CD2-SD 3.96Å; L1352-L1400 HydrophobicContact CD2-CD1 3.79Å; L1352-T1403 HydrophobicContact CB-CG2 3.98Å; L1352-T1403 HydrophobicContact CD2-CG2 4.2Å; L1352-T1403 HydrophobicContact CG-CG2 4.27Å |
| 1353 | R | 87.2 | Confident | 84.8 | Confident | 50 Ų | 50 | 43.7 Ų | 43.7 | 19% | 0.189 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -62.9 | -42.2 | 170.9 | -71.2 | -167.5 | 176.8 | -100.5 | 0.5 | 111.2 | N1350 L1355 L1356 L1357 P1363 N1364 T1403 L1404 | N1350-R1353 WeakPolarHBondContact O-CA 3.49Å; N1350-R1353 WeakPolarHBondContact O-CB 3.42Å; N1350-R1353 PolarHBondContact O-N 3.4Å; R1353-L1355 VanDerWaalsContact C-N 3.34Å; R1353-L1356 PolarHBondContact O-N 3.4Å; R1353-L1357 WeakPolarHBondContact O-CB 3.35Å; R1353-L1357 VanDerWaalsContact O-CG 3.25Å; R1353-L1357 WeakPolarHBondContact O-CG 3.48Å; R1353-L1357 PolarHBondContact O-N 3.32Å; R1353-P1363 HydrophobicContact CB-CB 4.37Å; R1353-P1363 HydrophobicContact CB-CG 4.23Å; R1353-P1363 HydrophobicContact CG-CB 3.92Å; R1353-P1363 HydrophobicContact CG-CG 4.07Å; R1353-N1364 PolarHBondContact NH1-OD1 3.34Å; R1353-T1403 HydrophobicContact CG-CG2 3.86Å; R1353-T1403 PolarHBondContact NE-O 3.41Å; R1353-T1403 PolarHBondContact NH2-O 3.07Å; R1353-L1404 PolarHBondContact NH2-O 3.1Å |
| 1354 | N | 87.6 | Confident | 84.3 | Confident | 53 Ų | 53 | 42.7 Ų | 42.7 | 28% | 0.283 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63.3 | -40.5 | 177.3 | -68.4 | -25.3 | 0 | 0 | 0 | 111.3 | I1306 L1345 N1350 A1351 L1352 A1358 | I1306-N1354 HydrophobicContact CD1-CB 3.9Å; I1306-N1354 WeakPolarHBondContact CD1-O 3.41Å; L1345-N1354 HydrophobicContact CD1-CB 4.33Å; L1345-N1354 HydrophobicContact CD2-CB 4.24Å; N1350-N1354 VanDerWaalsContact O-CG 3.32Å; N1350-N1354 PolarHBondContact O-N 2.88Å; N1350-N1354 PolarHBondContact O-ND2 2.96Å; A1351-N1354 PolarHBondContact O-N 3.14Å; L1352-N1354 VanDerWaalsContact C-N 3.33Å; N1354-A1358 WeakPolarHBondContact O-CB 3.39Å; N1354-A1358 PolarHBondContact O-N 3.37Å |
| 1355 | L | 89.2 | Confident | 84.3 | Confident | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.005 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -65.8 | -46.3 | 175.5 | -173.7 | 60.4 | 0 | 0 | 0 | 112 | I1309 L1323 L1338 L1341 L1342 L1345 A1351 L1352 R1353 L1357 A1358 S1359 | I1309-L1355 HydrophobicContact CG2-CD1 3.87Å; L1323-L1355 HydrophobicContact CD1-CD1 4.4Å; L1323-L1355 HydrophobicContact CD1-CD2 4.45Å; L1323-L1355 HydrophobicContact CD2-CD2 4.14Å; L1323-L1355 HydrophobicContact CD2-CG 4.25Å; L1338-L1355 HydrophobicContact CD1-CD2 3.4Å; L1338-L1355 VanDerWaalsContact CD1-CD2 3.4Å; L1341-L1355 HydrophobicContact CB-CD1 4.41Å; L1341-L1355 HydrophobicContact CB-CD2 4.27Å; L1342-L1355 HydrophobicContact CD2-CD2 4.17Å; L1345-L1355 HydrophobicContact CD1-CB 3.67Å; L1345-L1355 HydrophobicContact CD1-CD1 4.1Å; L1345-L1355 HydrophobicContact CD1-CG 4.42Å; A1351-L1355 WeakPolarHBondContact O-CB 3.27Å; A1351-L1355 PolarHBondContact O-N 2.98Å; L1352-L1355 PolarHBondContact O-N 3.17Å; R1353-L1355 VanDerWaalsContact C-N 3.34Å; L1355-L1357 PolarHBondContact O-N 3.49Å; L1355-A1358 CarbonylContact O-C 3.3Å; L1355-A1358 WeakPolarHBondContact O-CA 3.41Å; L1355-A1358 WeakPolarHBondContact O-CB 3.38Å; L1355-A1358 PolarHBondContact O-N 3.08Å; L1355-A1358 VanDerWaalsContact O-N 3.1Å; L1355-S1359 PolarHBondContact O-N 3.03Å; L1355-S1359 PolarHBondContact O-OG 3.42Å |
| 1356 | L | 86.3 | Confident | 84.4 | Confident | 2 Ų | 2 | 42.9 Ų | 42.9 | 1% | 0.01 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -58 | -47.2 | 175.4 | -74.2 | 166.6 | 0 | 0 | 0 | 111.2 | L1352 R1353 A1358 S1359 G1360 L1361 P1363 L1369 L1372 | L1352-L1356 HydrophobicContact CD1-CD1 4.23Å; L1352-L1356 HydrophobicContact CD1-CG 4.2Å; L1352-L1356 HydrophobicContact CG-CD1 4.18Å; L1352-L1356 WeakPolarHBondContact O-CB 3.34Å; L1352-L1356 VanDerWaalsContact O-CG 3.32Å; L1352-L1356 WeakPolarHBondContact O-CG 3.45Å; L1352-L1356 PolarHBondContact O-N 3.41Å; R1353-L1356 PolarHBondContact O-N 3.4Å; L1356-A1358 VanDerWaalsContact C-N 3.28Å; L1356-A1358 PolarHBondContact O-N 3.49Å; L1356-S1359 CarbonylContact O-C 2.97Å; L1356-S1359 WeakPolarHBondContact O-CA 3.33Å; L1356-S1359 WeakPolarHBondContact O-CB 3.44Å; L1356-S1359 PolarHBondContact O-N 2.92Å; L1356-S1359 VanDerWaalsContact O-N 3.08Å; L1356-G1360 PolarHBondContact O-N 3.21Å; L1356-G1360 VanDerWaalsContact O-N 3.14Å; L1356-L1361 CarbonylContact C-O 3.59Å; L1356-L1361 VanDerWaalsContact C-O 3.31Å; L1356-L1361 HydrophobicContact CB-CB 4.2Å; L1356-L1361 HydrophobicContact CD2-CB 4Å; L1356-L1361 HydrophobicContact CD2-CD1 3.68Å; L1356-L1361 WeakPolarHBondContact O-CB 3.36Å; L1356-L1361 PolarHBondContact O-N 3.39Å; L1356-P1363 HydrophobicContact CB-CB 4.37Å; L1356-P1363 HydrophobicContact CD1-CB 3.77Å; L1356-L1369 HydrophobicContact CD1-CD2 4Å; L1356-L1372 HydrophobicContact CD2-CD2 3.96Å |
| 1357 | L | 85.1 | Confident | 84.7 | Confident | 96 Ų | 96 | 44.6 Ų | 44.6 | 50% | 0.503 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -64.6 | -30.1 | 175.9 | -69.2 | 170.2 | 0 | 0 | 0 | 112.8 | R1353 L1355 G1360 P1363 | R1353-L1357 WeakPolarHBondContact O-CB 3.35Å; R1353-L1357 VanDerWaalsContact O-CG 3.25Å; R1353-L1357 WeakPolarHBondContact O-CG 3.48Å; R1353-L1357 PolarHBondContact O-N 3.32Å; L1355-L1357 PolarHBondContact O-N 3.49Å; L1357-G1360 PolarHBondContact O-N 2.93Å; L1357-P1363 HydrophobicContact CG-CG 4.45Å |
| 1358 | A | 84.7 | Confident | 85 | Confident | 7 Ų | 7 | 42.7 Ų | 42.7 | 6% | 0.058 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -71.3 | -33.6 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | I1306 I1309 K1310 L1313 N1354 L1355 L1356 G1360 | I1306-A1358 HydrophobicContact CG1-CB 4.07Å; I1309-A1358 HydrophobicContact CG2-CB 4.19Å; K1310-A1358 HydrophobicContact CG-CB 3.73Å; L1313-A1358 HydrophobicContact CD1-CB 4.12Å; N1354-A1358 WeakPolarHBondContact O-CB 3.39Å; N1354-A1358 PolarHBondContact O-N 3.37Å; L1355-A1358 CarbonylContact O-C 3.3Å; L1355-A1358 WeakPolarHBondContact O-CA 3.41Å; L1355-A1358 WeakPolarHBondContact O-CB 3.38Å; L1355-A1358 PolarHBondContact O-N 3.08Å; L1355-A1358 VanDerWaalsContact O-N 3.1Å; L1356-A1358 VanDerWaalsContact C-N 3.28Å; L1356-A1358 PolarHBondContact O-N 3.49Å; A1358-G1360 PolarHBondContact O-N 2.77Å |
| 1359 | S | 84.9 | Confident | 85.2 | Confident | 3 Ų | 3 | 38.8 Ų | 38.8 | 2% | 0.021 | 22% | 0.221 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.4 | 0.7 | 169.9 | -61.4 | 0 | 0 | 0 | 0 | 114.1 | G1319 L1355 L1356 L1361 | G1319-S1359 CarbonylContact C-O 3.59Å; G1319-S1359 WeakPolarHBondContact CA-O 3.48Å; G1319-S1359 PolarHBondContact N-O 3.33Å; L1355-S1359 PolarHBondContact O-N 3.03Å; L1355-S1359 PolarHBondContact O-OG 3.42Å; L1356-S1359 CarbonylContact O-C 2.97Å; L1356-S1359 WeakPolarHBondContact O-CA 3.33Å; L1356-S1359 WeakPolarHBondContact O-CB 3.44Å; L1356-S1359 PolarHBondContact O-N 2.92Å; L1356-S1359 VanDerWaalsContact O-N 3.08Å; S1359-L1361 VanDerWaalsContact C-N 3.34Å |
| 1360 | G | 84.5 | Confident | 85.9 | Confident | 70 Ų | 70 | 39.5 Ų | 39.5 | 72% | 0.722 | 22% | 0.223 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 73.3 | 22.4 | -177 | 0 | 0 | 0 | 0 | 0 | 114.6 | L1356 L1357 A1358 | L1356-G1360 PolarHBondContact O-N 3.21Å; L1356-G1360 VanDerWaalsContact O-N 3.14Å; L1357-G1360 PolarHBondContact O-N 2.93Å; A1358-G1360 PolarHBondContact O-N 2.77Å |
| 1361 | L | 84.4 | Confident | 85.9 | Confident | 14 Ų | 14 | 38.6 Ų | 38.6 | 7% | 0.073 | 22% | 0.218 | C | C | . | . | trans | -104.7 | 133 | -178.2 | -63.5 | 173.3 | 0 | 0 | 0 | 110.3 | H1320 L1356 S1359 P1363 A1368 | H1320-L1361 HydrophobicContact CB-CD1 4.13Å; H1320-L1361 HydrophobicContact CB-CD2 4.45Å; L1356-L1361 CarbonylContact C-O 3.59Å; L1356-L1361 VanDerWaalsContact C-O 3.31Å; L1356-L1361 HydrophobicContact CB-CB 4.2Å; L1356-L1361 HydrophobicContact CD2-CB 4Å; L1356-L1361 HydrophobicContact CD2-CD1 3.68Å; L1356-L1361 WeakPolarHBondContact O-CB 3.36Å; L1356-L1361 PolarHBondContact O-N 3.39Å; S1359-L1361 VanDerWaalsContact C-N 3.34Å; L1361-P1363 WeakPolarHBondContact O-CD 3.42Å; L1361-A1368 HydrophobicContact CB-CB 4.08Å; L1361-A1368 HydrophobicContact CD2-CB 4.14Å | ||
| 1362 | D | 83.9 | Confident | 85.9 | Confident | 84 Ų | 84 | 38.7 Ų | 38.7 | 45% | 0.449 | 22% | 0.218 | S | C | . | . | trans | -78.9 | 115.9 | 172.3 | -171.1 | -27.6 | 0 | 0 | 0 | 109.7 | N1364 D1365 A1368 | D1362-N1364 PolarHBondContact O-N 2.89Å; D1362-N1364 WeakPolarHBondContact OD1-CB 3.34Å; D1362-N1364 PolarHBondContact OD1-N 3.31Å; D1362-N1364 PolarHBondContact OD1-ND2 3.44Å; D1362-D1365 HydrophobicContact CB-CB 4.22Å; D1362-D1365 PolarHBondContact O-N 2.88Å; D1362-D1365 VanDerWaalsContact O-N 3.11Å; D1362-A1368 VanDerWaalsContact O-CB 3.29Å; D1362-A1368 WeakPolarHBondContact O-CB 3.48Å | ||
| 1363 | P | 78.8 | Confident | 86 | Confident | 3 Ų | 3 | 38.6 Ų | 38.6 | 2% | 0.019 | 22% | 0.218 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -66.1 | -4.9 | -179.5 | 28.2 | -36.4 | 0 | 0 | 0 | 114.7 | R1353 L1356 L1357 L1361 | R1353-P1363 HydrophobicContact CB-CB 4.37Å; R1353-P1363 HydrophobicContact CB-CG 4.23Å; R1353-P1363 HydrophobicContact CG-CB 3.92Å; R1353-P1363 HydrophobicContact CG-CG 4.07Å; L1356-P1363 HydrophobicContact CB-CB 4.37Å; L1356-P1363 HydrophobicContact CD1-CB 3.77Å; L1357-P1363 HydrophobicContact CG-CG 4.45Å; L1361-P1363 WeakPolarHBondContact O-CD 3.42Å |
| 1364 | N | 78.9 | Confident | 86 | Confident | 88 Ų | 88 | 41.4 Ų | 41.4 | 47% | 0.471 | 23% | 0.233 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -101.4 | -9.8 | 176.4 | -44.6 | -76.3 | 0 | 0 | 0 | 113 | R1353 D1362 N1411 | R1353-N1364 PolarHBondContact NH1-OD1 3.34Å; D1362-N1364 PolarHBondContact O-N 2.89Å; D1362-N1364 WeakPolarHBondContact OD1-CB 3.34Å; D1362-N1364 PolarHBondContact OD1-N 3.31Å; D1362-N1364 PolarHBondContact OD1-ND2 3.44Å; N1364-N1411 PolarHBondContact O-ND2 3.41Å |
| 1365 | D | 85.3 | Confident | 85.9 | Confident | 61 Ų | 61 | 40.3 Ų | 40.3 | 33% | 0.326 | 23% | 0.229 | S | C | . | . | trans | -89.3 | 117.1 | 175 | 179.7 | 8.5 | 0 | 0 | 0 | 110.3 | D1362 N1367 A1368 L1369 | D1362-D1365 HydrophobicContact CB-CB 4.22Å; D1362-D1365 PolarHBondContact O-N 2.88Å; D1362-D1365 VanDerWaalsContact O-N 3.11Å; D1365-N1367 PolarHBondContact O-N 3.16Å; D1365-N1367 WeakPolarHBondContact OD1-CB 3.44Å; D1365-N1367 PolarHBondContact OD1-N 3.36Å; D1365-N1367 PolarHBondContact OD1-ND2 3.43Å; D1365-A1368 HydrophobicContact CB-CB 4.06Å; D1365-A1368 WeakPolarHBondContact O-CB 3.25Å; D1365-A1368 PolarHBondContact O-N 3.24Å; D1365-L1369 PolarHBondContact O-N 3.01Å | ||
| 1366 | P | 86.4 | Confident | 85.8 | Confident | 25 Ų | 25 | 40.9 Ų | 40.9 | 16% | 0.162 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -61.8 | -22.3 | 175.5 | 25.3 | -33.7 | 0 | 0 | 0 | 113.1 | A1368 K1370 N1411 T1414 A1415 | P1366-A1368 VanDerWaalsContact C-N 3.34Å; P1366-K1370 WeakPolarHBondContact O-CB 3.32Å; P1366-K1370 PolarHBondContact O-N 3.08Å; P1366-N1411 HydrophobicContact CB-CB 4.25Å; P1366-T1414 HydrophobicContact CB-CG2 3.9Å; P1366-T1414 HydrophobicContact CG-CG2 4.11Å; P1366-A1415 VanDerWaalsContact O-CB 3.29Å; P1366-A1415 WeakPolarHBondContact O-CB 3.27Å |
| 1367 | N | 88.6 | Confident | 85.8 | Confident | 96 Ų | 96 | 43.5 Ų | 43.5 | 51% | 0.513 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -70 | -32.2 | 172.7 | -56.6 | -81.5 | 0 | 0 | 0 | 111.9 | D1365 K1370 L1371 | D1365-N1367 PolarHBondContact O-N 3.16Å; D1365-N1367 WeakPolarHBondContact OD1-CB 3.44Å; D1365-N1367 PolarHBondContact OD1-N 3.36Å; D1365-N1367 PolarHBondContact OD1-ND2 3.43Å; N1367-K1370 WeakPolarHBondContact O-CB 3.35Å; N1367-K1370 PolarHBondContact O-N 2.95Å; N1367-L1371 VanDerWaalsContact O-CG 3.29Å; N1367-L1371 WeakPolarHBondContact O-CG 3.24Å; N1367-L1371 PolarHBondContact O-N 3.2Å |
| 1368 | A | 86.3 | Confident | 86 | Confident | 5 Ų | 5 | 40 Ų | 40 | 4% | 0.041 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -70.1 | -40.6 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | L1361 D1362 D1365 P1366 K1370 L1371 L1372 | L1361-A1368 HydrophobicContact CB-CB 4.08Å; L1361-A1368 HydrophobicContact CD2-CB 4.14Å; D1362-A1368 VanDerWaalsContact O-CB 3.29Å; D1362-A1368 WeakPolarHBondContact O-CB 3.48Å; D1365-A1368 HydrophobicContact CB-CB 4.06Å; D1365-A1368 WeakPolarHBondContact O-CB 3.25Å; D1365-A1368 PolarHBondContact O-N 3.24Å; P1366-A1368 VanDerWaalsContact C-N 3.34Å; A1368-K1370 VanDerWaalsContact C-N 3.35Å; A1368-L1371 PolarHBondContact O-N 3.27Å; A1368-L1372 PolarHBondContact O-N 3.33Å; A1368-L1372 VanDerWaalsContact O-N 3.09Å |
| 1369 | L | 88.6 | Confident | 86.3 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64 | -39 | 169.5 | -68.3 | 175.1 | 0 | 0 | 0 | 111.9 | L1356 D1365 L1372 F1373 L1404 N1411 L1412 A1415 | L1356-L1369 HydrophobicContact CD1-CD2 4Å; D1365-L1369 PolarHBondContact O-N 3.01Å; L1369-L1372 WeakPolarHBondContact O-CB 3.46Å; L1369-L1372 PolarHBondContact O-N 3.35Å; L1369-F1373 HydrophobicContact CB-CE2 4.47Å; L1369-F1373 WeakPolarHBondContact O-CD2 3.32Å; L1369-F1373 VanDerWaalsContact O-CG 3.3Å; L1369-F1373 WeakPolarHBondContact O-CG 3.48Å; L1369-F1373 PolarHBondContact O-N 3.49Å; L1369-L1404 HydrophobicContact CD1-CD1 3.8Å; L1369-L1404 HydrophobicContact CD1-CD2 4.1Å; L1369-L1404 HydrophobicContact CD2-CD2 4.28Å; L1369-N1411 HydrophobicContact CD1-CB 4.37Å; L1369-L1412 HydrophobicContact CD1-CD2 4.42Å; L1369-A1415 HydrophobicContact CB-CB 3.65Å |
| 1370 | K | 90.2 | Very high | 86.4 | Confident | 85 Ų | 85 | 43.6 Ų | 43.6 | 37% | 0.37 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -61.3 | -48.1 | 175.3 | -179.2 | -177.7 | 163.4 | -170.4 | 0 | 111.9 | P1366 N1367 A1368 L1372 F1373 E1374 A1415 | P1366-K1370 WeakPolarHBondContact O-CB 3.32Å; P1366-K1370 PolarHBondContact O-N 3.08Å; N1367-K1370 WeakPolarHBondContact O-CB 3.35Å; N1367-K1370 PolarHBondContact O-N 2.95Å; A1368-K1370 VanDerWaalsContact C-N 3.35Å; K1370-L1372 VanDerWaalsContact C-N 3.28Å; K1370-L1372 PolarHBondContact O-N 3.38Å; K1370-F1373 PolarHBondContact O-N 2.91Å; K1370-F1373 VanDerWaalsContact O-N 3.08Å; K1370-E1374 VanDerWaalsContact CE-CD 3.4Å; K1370-E1374 WeakPolarHBondContact CE-OE1 3.45Å; K1370-E1374 HydrophobicContact CG-CG 4.41Å; K1370-E1374 IonicContact NZ-OE1 2.71Å; K1370-E1374 PolarHBondContact NZ-OE1 2.84Å; K1370-E1374 WeakPolarHBondContact O-CG 3.24Å; K1370-E1374 PolarHBondContact O-N 2.91Å; K1370-A1415 HydrophobicContact CB-CB 4.22Å; K1370-A1415 WeakPolarHBondContact CG-O 3.29Å |
| 1371 | L | 87 | Confident | 86.6 | Confident | 63 Ų | 63 | 43.9 Ų | 43.9 | 33% | 0.33 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -61.9 | -36.5 | 178 | -72.1 | 171.4 | 0 | 0 | 0 | 111.7 | H1320 N1367 A1368 S1375 | H1320-L1371 HydrophobicContact CB-CB 4.32Å; H1320-L1371 PolarHBondContact CD2-O 3.36Å; N1367-L1371 VanDerWaalsContact O-CG 3.29Å; N1367-L1371 WeakPolarHBondContact O-CG 3.24Å; N1367-L1371 PolarHBondContact O-N 3.2Å; A1368-L1371 PolarHBondContact O-N 3.27Å; L1371-S1375 WeakPolarHBondContact O-CB 3.06Å; L1371-S1375 PolarHBondContact O-N 3.27Å |
| 1372 | L | 87.8 | Confident | 86.9 | Confident | 3 Ų | 3 | 43.2 Ų | 43.2 | 2% | 0.016 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -60 | -50.9 | 169.3 | 178.7 | 64.5 | 0 | 0 | 0 | 111 | L1323 L1356 A1368 L1369 K1370 E1374 S1375 L1376 L1386 | L1323-L1372 HydrophobicContact CD2-CD1 3.77Å; L1356-L1372 HydrophobicContact CD2-CD2 3.96Å; A1368-L1372 PolarHBondContact O-N 3.33Å; A1368-L1372 VanDerWaalsContact O-N 3.09Å; L1369-L1372 WeakPolarHBondContact O-CB 3.46Å; L1369-L1372 PolarHBondContact O-N 3.35Å; K1370-L1372 VanDerWaalsContact C-N 3.28Å; K1370-L1372 PolarHBondContact O-N 3.38Å; L1372-E1374 PolarHBondContact O-N 3.31Å; L1372-S1375 PolarHBondContact O-N 3.27Å; L1372-S1375 VanDerWaalsContact O-N 3.16Å; L1372-S1375 PolarHBondContact O-OG 2.77Å; L1372-L1376 HydrophobicContact CD1-CD1 3.85Å; L1372-L1376 HydrophobicContact CD1-CG 4.12Å; L1372-L1376 HydrophobicContact CG-CD1 3.91Å; L1372-L1376 HydrophobicContact CG-CG 4.45Å; L1372-L1376 WeakPolarHBondContact O-CG 3.41Å; L1372-L1376 PolarHBondContact O-N 3.49Å; L1372-L1386 HydrophobicContact CD2-CD1 3.73Å |
| 1373 | F | 89.8 | Confident | 87.3 | Confident | 2 Ų | 2 | 39.2 Ų | 39.2 | 1% | 0.009 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61.3 | -42.3 | 178.8 | -59.8 | -30 | 0 | 0 | 0 | 112.7 | L1369 K1370 S1375 L1376 G1377 G1378 L1383 L1386 L1412 A1415 | L1369-F1373 HydrophobicContact CB-CE2 4.47Å; L1369-F1373 WeakPolarHBondContact O-CD2 3.32Å; L1369-F1373 VanDerWaalsContact O-CG 3.3Å; L1369-F1373 WeakPolarHBondContact O-CG 3.48Å; L1369-F1373 PolarHBondContact O-N 3.49Å; K1370-F1373 PolarHBondContact O-N 2.91Å; K1370-F1373 VanDerWaalsContact O-N 3.08Å; F1373-S1375 VanDerWaalsContact C-N 3.29Å; F1373-S1375 PolarHBondContact O-N 3.44Å; F1373-L1376 CarbonylContact O-C 3.59Å; F1373-L1376 PolarHBondContact O-N 2.8Å; F1373-G1377 PolarHBondContact O-N 2.75Å; F1373-G1378 CarbonylContact O-C 3.53Å; F1373-G1378 VanDerWaalsContact O-CA 3.31Å; F1373-G1378 WeakPolarHBondContact O-CA 3.47Å; F1373-G1378 PolarHBondContact O-N 2.73Å; F1373-L1383 HydrophobicContact CE1-CB 4.11Å; F1373-L1383 HydrophobicContact CE1-CD1 4.13Å; F1373-L1383 HydrophobicContact CZ-CB 4.2Å; F1373-L1383 HydrophobicContact CZ-CD1 3.75Å; F1373-L1386 HydrophobicContact CE1-CD2 4.17Å; F1373-L1412 HydrophobicContact CZ-CD2 3.96Å; F1373-A1415 HydrophobicContact CD2-CB 4.08Å; F1373-A1415 HydrophobicContact CE2-CB 3.71Å |
| 1374 | E | 87.5 | Confident | 87.9 | Confident | 108 Ų | 108 | 41.1 Ų | 41.1 | 51% | 0.505 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -59.2 | -39.7 | 175.1 | -72.8 | 176.9 | 155.5 | 0 | 0 | 111.2 | K1370 L1372 L1376 | K1370-E1374 VanDerWaalsContact CE-CD 3.4Å; K1370-E1374 WeakPolarHBondContact CE-OE1 3.45Å; K1370-E1374 HydrophobicContact CG-CG 4.41Å; K1370-E1374 IonicContact NZ-OE1 2.71Å; K1370-E1374 PolarHBondContact NZ-OE1 2.84Å; K1370-E1374 WeakPolarHBondContact O-CG 3.24Å; K1370-E1374 PolarHBondContact O-N 2.91Å; L1372-E1374 PolarHBondContact O-N 3.31Å; E1374-L1376 VanDerWaalsContact C-N 3.34Å; E1374-L1376 PolarHBondContact O-N 3.43Å |
| 1375 | S | 84.9 | Confident | 88.5 | Confident | 30 Ų | 30 | 37.8 Ų | 37.8 | 21% | 0.21 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.9 | -28.4 | 173.6 | 80.8 | 0 | 0 | 0 | 0 | 114.3 | A1324 L1371 L1372 F1373 | A1324-S1375 VanDerWaalsContact CB-O 3.25Å; A1324-S1375 WeakPolarHBondContact CB-O 3.41Å; L1371-S1375 WeakPolarHBondContact O-CB 3.06Å; L1371-S1375 PolarHBondContact O-N 3.27Å; L1372-S1375 PolarHBondContact O-N 3.27Å; L1372-S1375 VanDerWaalsContact O-N 3.16Å; L1372-S1375 PolarHBondContact O-OG 2.77Å; F1373-S1375 VanDerWaalsContact C-N 3.29Å; F1373-S1375 PolarHBondContact O-N 3.44Å |
| 1376 | L | 87.9 | Confident | 88.8 | Confident | 14 Ų | 14 | 35 Ų | 35 | 7% | 0.073 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.3 | 18.4 | -179 | -62.8 | 179.2 | 0 | 0 | 0 | 113.6 | L1327 L1372 F1373 E1374 V1381 I1385 | L1327-L1376 HydrophobicContact CD1-CD2 3.61Å; L1372-L1376 HydrophobicContact CD1-CD1 3.85Å; L1372-L1376 HydrophobicContact CD1-CG 4.12Å; L1372-L1376 HydrophobicContact CG-CD1 3.91Å; L1372-L1376 HydrophobicContact CG-CG 4.45Å; L1372-L1376 WeakPolarHBondContact O-CG 3.41Å; L1372-L1376 PolarHBondContact O-N 3.49Å; F1373-L1376 CarbonylContact O-C 3.59Å; F1373-L1376 PolarHBondContact O-N 2.8Å; E1374-L1376 VanDerWaalsContact C-N 3.34Å; E1374-L1376 PolarHBondContact O-N 3.43Å; L1376-V1381 WeakPolarHBondContact O-CG1 3.17Å; L1376-I1385 HydrophobicContact CB-CD1 4.3Å; L1376-I1385 HydrophobicContact CD1-CG2 4.22Å |
| 1377 | G | 87 | Confident | 89 | Confident | 57 Ų | 57 | 33.8 Ų | 33.8 | 59% | 0.588 | 20% | 0.202 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 97.5 | 16.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | F1373 | F1373-G1377 PolarHBondContact O-N 2.75Š|
| 1378 | G | 89.2 | Confident | 89.2 | Confident | 22 Ų | 22 | 33 Ų | 33 | 23% | 0.227 | 20% | 0.198 | C | C | . | . | S | Bend | trans | 97.8 | 173.4 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | F1373 D1380 V1381 G1382 | F1373-G1378 CarbonylContact O-C 3.53Å; F1373-G1378 VanDerWaalsContact O-CA 3.31Å; F1373-G1378 WeakPolarHBondContact O-CA 3.47Å; F1373-G1378 PolarHBondContact O-N 2.73Å; G1378-D1380 PolarHBondContact O-N 3.06Å; G1378-V1381 PolarHBondContact O-N 3.4Å; G1378-G1382 PolarHBondContact O-N 3.44Å |
| 1379 | A | 89.2 | Confident | 89.4 | Confident | 27 Ų | 27 | 33 Ų | 33 | 22% | 0.223 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -48.9 | -59.4 | -172.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | V1381 L1383 A1416 A1425 | A1379-V1381 PolarHBondContact O-N 3.13Å; A1379-L1383 WeakPolarHBondContact O-CB 3.29Å; A1379-L1383 PolarHBondContact O-N 3.37Å; A1379-A1416 HydrophobicContact CB-CB 3.98Å; A1379-A1425 HydrophobicContact CB-CB 4.35Å |
| 1380 | D | 88.3 | Confident | 89.4 | Confident | 58 Ų | 58 | 33.8 Ų | 33.8 | 31% | 0.31 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -55.5 | -48.8 | -178.8 | -67.1 | 4.7 | 0 | 0 | 0 | 112.6 | G1378 T1384 K1428 | G1378-D1380 PolarHBondContact O-N 3.06Å; D1380-T1384 VanDerWaalsContact O-CB 3.26Å; D1380-T1384 WeakPolarHBondContact O-CB 3.32Å; D1380-T1384 PolarHBondContact O-N 3.22Å; D1380-T1384 VanDerWaalsContact O-N 3.15Å; D1380-T1384 PolarHBondContact O-OG1 3.27Å; D1380-K1428 HydrophobicContact CB-CD 4.31Å; D1380-K1428 IonicContact OD1-NZ 2.75Å; D1380-K1428 WeakPolarHBondContact OD2-CD 3.44Å; D1380-K1428 IonicContact OD2-NZ 3.17Å; D1380-K1428 PolarHBondContact OD2-NZ 2.73Å |
| 1381 | V | 88.3 | Confident | 89.3 | Confident | 76 Ų | 76 | 32.5 Ų | 32.5 | 46% | 0.461 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -74.8 | -48.7 | -173.1 | -174.3 | 0 | 0 | 0 | 0 | 110.3 | L1376 G1378 A1379 L1383 T1384 I1385 | L1376-V1381 WeakPolarHBondContact O-CG1 3.17Å; G1378-V1381 PolarHBondContact O-N 3.4Å; A1379-V1381 PolarHBondContact O-N 3.13Å; V1381-L1383 PolarHBondContact O-N 3.44Å; V1381-T1384 PolarHBondContact O-N 3.03Å; V1381-I1385 HydrophobicContact CG1-CD1 3.84Å; V1381-I1385 HydrophobicContact CG1-CG1 4.49Å; V1381-I1385 WeakPolarHBondContact O-CB 3.41Å; V1381-I1385 WeakPolarHBondContact O-CG1 3.32Å; V1381-I1385 PolarHBondContact O-N 2.81Å |
| 1382 | G | 91 | Very high | 89.3 | Confident | 0 Ų | 0 | 30.4 Ų | 30.4 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.1 | -42 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | G1378 I1385 L1386 | G1378-G1382 PolarHBondContact O-N 3.44Å; G1382-I1385 PolarHBondContact O-N 2.86Å; G1382-L1386 WeakPolarHBondContact O-CB 3.4Å; G1382-L1386 PolarHBondContact O-N 3.16Å |
| 1383 | L | 92.1 | Very high | 89.4 | Confident | 0 Ų | 0 | 31.5 Ų | 31.5 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.8 | -37.8 | 175.6 | -175.4 | 62.2 | 0 | 0 | 0 | 111.8 | F1373 A1379 V1381 L1386 V1387 L1400 L1412 A1425 L1426 A1429 | F1373-L1383 HydrophobicContact CE1-CB 4.11Å; F1373-L1383 HydrophobicContact CE1-CD1 4.13Å; F1373-L1383 HydrophobicContact CZ-CB 4.2Å; F1373-L1383 HydrophobicContact CZ-CD1 3.75Å; A1379-L1383 WeakPolarHBondContact O-CB 3.29Å; A1379-L1383 PolarHBondContact O-N 3.37Å; V1381-L1383 PolarHBondContact O-N 3.44Å; L1383-L1386 WeakPolarHBondContact O-CB 3.44Å; L1383-L1386 PolarHBondContact O-N 3.43Å; L1383-V1387 HydrophobicContact CD1-CG2 4.4Å; L1383-V1387 WeakPolarHBondContact O-CB 3.42Å; L1383-V1387 WeakPolarHBondContact O-CG2 3.48Å; L1383-V1387 PolarHBondContact O-N 3.12Å; L1383-L1400 HydrophobicContact CD1-CD2 3.76Å; L1383-L1412 HydrophobicContact CD1-CD2 3.91Å; L1383-A1425 HydrophobicContact CD2-CB 4.14Å; L1383-L1426 HydrophobicContact CD2-CD2 4.16Å; L1383-L1426 HydrophobicContact CD2-CG 4.45Å; L1383-A1429 HydrophobicContact CB-CB 4.23Å; L1383-A1429 HydrophobicContact CD2-CB 3.85Å; L1383-A1429 HydrophobicContact CG-CB 3.6Å |
| 1384 | T | 91.6 | Very high | 89.3 | Confident | 43 Ų | 43 | 35.9 Ų | 35.9 | 26% | 0.264 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -66.1 | -42.8 | 175.1 | -59.2 | 0 | 0 | 0 | 0 | 111.7 | D1380 V1381 L1386 V1387 N1388 | D1380-T1384 VanDerWaalsContact O-CB 3.26Å; D1380-T1384 WeakPolarHBondContact O-CB 3.32Å; D1380-T1384 PolarHBondContact O-N 3.22Å; D1380-T1384 VanDerWaalsContact O-N 3.15Å; D1380-T1384 PolarHBondContact O-OG1 3.27Å; V1381-T1384 PolarHBondContact O-N 3.03Å; T1384-L1386 VanDerWaalsContact C-N 3.32Å; T1384-L1386 PolarHBondContact O-N 2.94Å; T1384-V1387 PolarHBondContact O-N 3.01Å; T1384-N1388 VanDerWaalsContact O-CB 3.28Å; T1384-N1388 WeakPolarHBondContact O-CB 3.31Å; T1384-N1388 PolarHBondContact O-N 3.49Å; T1384-N1388 PolarHBondContact O-ND2 2.58Å |
| 1385 | I | 90.9 | Very high | 89.4 | Confident | 19 Ų | 19 | 35.2 Ų | 35.2 | 10% | 0.097 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -57.6 | -46.4 | 172.5 | -74 | 166.5 | 0 | 0 | 0 | 110.3 | P1334 A1335 L1338 L1376 V1381 G1382 A1389 | P1334-I1385 HydrophobicContact CB-CD1 4.36Å; P1334-I1385 HydrophobicContact CG-CD1 3.68Å; P1334-I1385 HydrophobicContact CG-CG1 4.21Å; A1335-I1385 HydrophobicContact CB-CG2 4.32Å; L1338-I1385 HydrophobicContact CD2-CG2 3.94Å; L1376-I1385 HydrophobicContact CB-CD1 4.3Å; L1376-I1385 HydrophobicContact CD1-CG2 4.22Å; V1381-I1385 HydrophobicContact CG1-CD1 3.84Å; V1381-I1385 HydrophobicContact CG1-CG1 4.49Å; V1381-I1385 WeakPolarHBondContact O-CB 3.41Å; V1381-I1385 WeakPolarHBondContact O-CG1 3.32Å; V1381-I1385 PolarHBondContact O-N 2.81Å; G1382-I1385 PolarHBondContact O-N 2.86Å; I1385-A1389 WeakPolarHBondContact O-CB 3.34Å; I1385-A1389 PolarHBondContact O-N 3.37Å |
| 1386 | L | 91.4 | Very high | 89.6 | Confident | 2 Ų | 2 | 33.8 Ų | 33.8 | 1% | 0.01 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.2 | -54.9 | 179.1 | -149.3 | 85.4 | 0 | 0 | 0 | 111.3 | L1338 L1352 L1372 F1373 G1382 L1383 T1384 N1388 A1389 M1390 L1400 | L1338-L1386 HydrophobicContact CD2-CD1 4.14Å; L1352-L1386 HydrophobicContact CD1-CD1 4.08Å; L1352-L1386 HydrophobicContact CD2-CD1 4.28Å; L1352-L1386 HydrophobicContact CD2-CD2 3.93Å; L1352-L1386 HydrophobicContact CD2-CG 4.15Å; L1372-L1386 HydrophobicContact CD2-CD1 3.73Å; F1373-L1386 HydrophobicContact CE1-CD2 4.17Å; G1382-L1386 WeakPolarHBondContact O-CB 3.4Å; G1382-L1386 PolarHBondContact O-N 3.16Å; L1383-L1386 WeakPolarHBondContact O-CB 3.44Å; L1383-L1386 PolarHBondContact O-N 3.43Å; T1384-L1386 VanDerWaalsContact C-N 3.32Å; T1384-L1386 PolarHBondContact O-N 2.94Å; L1386-N1388 VanDerWaalsContact C-N 3.33Å; L1386-N1388 PolarHBondContact O-N 3.4Å; L1386-A1389 PolarHBondContact O-N 3.29Å; L1386-A1389 VanDerWaalsContact O-N 3.17Å; L1386-M1390 VanDerWaalsContact C-CE 3.45Å; L1386-M1390 HydrophobicContact CB-CE 4.2Å; L1386-M1390 HydrophobicContact CD2-CE 3.97Å; L1386-M1390 HydrophobicContact CG-CE 3.68Å; L1386-M1390 WeakPolarHBondContact O-CE 3.47Å; L1386-M1390 PolarHBondContact O-N 3.1Å; L1386-M1390 VanDerWaalsContact O-N 3.15Å; L1386-L1400 HydrophobicContact CD2-CD1 3.5Å; L1386-L1400 HydrophobicContact CD2-CD2 3.8Å; L1386-L1400 HydrophobicContact CD2-CG 4.27Å |
| 1387 | V | 92.1 | Very high | 89.8 | Confident | 0 Ų | 0 | 33.1 Ų | 33.1 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -59.7 | -43.1 | -178.9 | 168.9 | 0 | 0 | 0 | 0 | 111.1 | L1383 T1384 M1390 G1391 G1392 G1396 M1397 L1400 A1429 | L1383-V1387 HydrophobicContact CD1-CG2 4.4Å; L1383-V1387 WeakPolarHBondContact O-CB 3.42Å; L1383-V1387 WeakPolarHBondContact O-CG2 3.48Å; L1383-V1387 PolarHBondContact O-N 3.12Å; T1384-V1387 PolarHBondContact O-N 3.01Å; V1387-M1390 PolarHBondContact O-N 3.35Å; V1387-G1391 PolarHBondContact O-N 3.45Å; V1387-G1392 WeakPolarHBondContact O-CA 3.47Å; V1387-G1392 PolarHBondContact O-N 2.94Å; V1387-G1396 WeakPolarHBondContact O-CA 3.47Å; V1387-M1397 HydrophobicContact CG2-CE 3.76Å; V1387-M1397 HydrophobicContact CG2-SD 4.24Å; V1387-L1400 HydrophobicContact CG2-CD2 4.03Å; V1387-A1429 WeakPolarHBondContact CG1-O 3.32Å; V1387-A1429 HydrophobicContact CG2-CB 4.14Å |
| 1388 | N | 91.2 | Very high | 90 | Very high | 78 Ų | 78 | 35.1 Ų | 35.1 | 42% | 0.417 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -62.3 | -44.1 | 175.5 | -72.8 | -20 | 0 | 0 | 0 | 112.2 | A1335 T1384 L1386 M1390 G1391 G1392 | A1335-N1388 HydrophobicContact CB-CB 4.12Å; T1384-N1388 VanDerWaalsContact O-CB 3.28Å; T1384-N1388 WeakPolarHBondContact O-CB 3.31Å; T1384-N1388 PolarHBondContact O-N 3.49Å; T1384-N1388 PolarHBondContact O-ND2 2.58Å; L1386-N1388 VanDerWaalsContact C-N 3.33Å; L1386-N1388 PolarHBondContact O-N 3.4Å; N1388-M1390 PolarHBondContact O-N 2.91Å; N1388-G1391 PolarHBondContact O-N 2.87Å; N1388-G1392 PolarHBondContact O-N 3.25Å |
| 1389 | A | 90.7 | Very high | 90 | Very high | 7 Ų | 7 | 39.7 Ų | 39.7 | 6% | 0.058 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -62.7 | -27.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | A1335 L1338 K1339 L1342 I1385 L1386 | A1335-A1389 WeakPolarHBondContact O-CB 3.29Å; L1338-A1389 HydrophobicContact CB-CB 3.93Å; L1338-A1389 HydrophobicContact CD2-CB 3.72Å; L1338-A1389 HydrophobicContact CG-CB 3.73Å; K1339-A1389 HydrophobicContact CB-CB 4.22Å; L1342-A1389 HydrophobicContact CD1-CB 4.12Å; I1385-A1389 WeakPolarHBondContact O-CB 3.34Å; I1385-A1389 PolarHBondContact O-N 3.37Å; L1386-A1389 PolarHBondContact O-N 3.29Å; L1386-A1389 VanDerWaalsContact O-N 3.17Å |
| 1390 | M | 90.2 | Very high | 90.1 | Very high | 16 Ų | 16 | 38.4 Ų | 38.4 | 8% | 0.079 | 21% | 0.214 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | -6.6 | 173.8 | -77.2 | 169.9 | -72.3 | 0 | 0 | 114.4 | L1342 L1352 L1386 V1387 N1388 R1399 L1400 | L1342-M1390 HydrophobicContact CD1-CG 4.06Å; L1352-M1390 HydrophobicContact CD2-CE 4.14Å; L1352-M1390 HydrophobicContact CD2-SD 3.96Å; L1386-M1390 VanDerWaalsContact C-CE 3.45Å; L1386-M1390 HydrophobicContact CB-CE 4.2Å; L1386-M1390 HydrophobicContact CD2-CE 3.97Å; L1386-M1390 HydrophobicContact CG-CE 3.68Å; L1386-M1390 WeakPolarHBondContact O-CE 3.47Å; L1386-M1390 PolarHBondContact O-N 3.1Å; L1386-M1390 VanDerWaalsContact O-N 3.15Å; V1387-M1390 PolarHBondContact O-N 3.35Å; N1388-M1390 PolarHBondContact O-N 2.91Å; M1390-R1399 HydrophobicContact CB-CB 4.22Å; M1390-R1399 WeakPolarHBondContact O-CD 3.48Å; M1390-R1399 PolarHBondContact O-NH1 3.31Å; M1390-R1399 HydrophobicContact SD-CB 4.47Å; M1390-L1400 HydrophobicContact CE-CB 3.61Å; M1390-L1400 HydrophobicContact CE-CD1 3.91Å; M1390-L1400 HydrophobicContact CE-CD2 4.17Å; M1390-L1400 HydrophobicContact CE-CG 4.07Å; M1390-L1400 HydrophobicContact SD-CB 3.82Å; M1390-L1400 HydrophobicContact SD-CD1 4.3Å |
| 1391 | G | 87.3 | Confident | 90.2 | Very high | 57 Ų | 57 | 36.8 Ų | 36.8 | 59% | 0.588 | 21% | 0.206 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 135.3 | -6.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | V1387 N1388 | V1387-G1391 PolarHBondContact O-N 3.45Å; N1388-G1391 PolarHBondContact O-N 2.87Å |
| 1392 | G | 87.3 | Confident | 90.2 | Very high | 19 Ų | 19 | 39.4 Ų | 39.4 | 20% | 0.196 | 21% | 0.211 | C | C | . | . | S | Bend | trans | 77.5 | 158.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | V1387 N1388 G1396 | V1387-G1392 WeakPolarHBondContact O-CA 3.47Å; V1387-G1392 PolarHBondContact O-N 2.94Å; N1388-G1392 PolarHBondContact O-N 3.25Å; G1392-G1396 PolarHBondContact O-N 2.84Å |
| 1393 | G | 88.6 | Confident | 90 | Very high | 26 Ų | 26 | 39.7 Ų | 39.7 | 27% | 0.268 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | 55.8 | -145.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | E1395 G1396 M1397 I1430 | G1393-E1395 PolarHBondContact O-N 2.75Å; G1393-G1396 PolarHBondContact O-N 3.37Å; G1393-M1397 PolarHBondContact O-N 2.97Å; G1393-M1397 VanDerWaalsContact O-N 3.07Å; G1393-I1430 WeakPolarHBondContact CA-O 3.5Å |
| 1394 | E | 89.2 | Confident | 89.8 | Confident | 94 Ų | 94 | 40.1 Ų | 40.1 | 44% | 0.439 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -57.7 | -44.6 | 178.6 | -68.3 | -177.2 | -168.5 | 0 | 0 | 112.8 | M1397 K1398 A1440 | E1394-M1397 PolarHBondContact O-N 2.88Å; E1394-K1398 WeakPolarHBondContact O-CB 3.36Å; E1394-K1398 PolarHBondContact O-N 3.2Å; E1394-A1440 HydrophobicContact CG-CB 3.94Å; E1394-A1440 WeakPolarHBondContact OE1-CA 3.4Å; E1394-A1440 VanDerWaalsContact OE1-CB 3.25Å; E1394-A1440 WeakPolarHBondContact OE1-CB 3.3Å |
| 1395 | E | 88.7 | Confident | 89.5 | Confident | 95 Ų | 95 | 39.5 Ų | 39.5 | 44% | 0.444 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -69.4 | -36.4 | -178.6 | -76.8 | -66.2 | 146.6 | 0 | 0 | 112.5 | G1393 K1398 R1399 | G1393-E1395 PolarHBondContact O-N 2.75Å; E1395-K1398 PolarHBondContact O-N 3.12Å; E1395-K1398 IonicContact OE1-NZ 3.48Å; E1395-K1398 PolarHBondContact OE1-NZ 2.9Å; E1395-K1398 IonicContact OE2-NZ 3.49Å; E1395-R1399 WeakPolarHBondContact O-CB 3.43Å; E1395-R1399 WeakPolarHBondContact O-CD 3.28Å; E1395-R1399 VanDerWaalsContact O-CG 3.24Å; E1395-R1399 WeakPolarHBondContact O-CG 3.46Å; E1395-R1399 PolarHBondContact O-N 3.11Å |
| 1396 | G | 89.9 | Confident | 89.2 | Confident | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -62.1 | -46.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | V1387 G1392 G1393 R1399 L1400 | V1387-G1396 WeakPolarHBondContact O-CA 3.47Å; G1392-G1396 PolarHBondContact O-N 2.84Å; G1393-G1396 PolarHBondContact O-N 3.37Å; G1396-R1399 PolarHBondContact O-N 3.23Å; G1396-L1400 WeakPolarHBondContact O-CB 3.25Å; G1396-L1400 PolarHBondContact O-N 3.12Å |
| 1397 | M | 92.1 | Very high | 88.8 | Confident | 0 Ų | 0 | 52.5 Ų | 52.5 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -67.2 | -38.1 | 176.2 | -173.5 | 64.9 | 75.7 | 0 | 0 | 112.3 | V1387 G1393 E1394 R1399 L1400 L1401 L1412 L1426 A1429 I1430 L1444 | V1387-M1397 HydrophobicContact CG2-CE 3.76Å; V1387-M1397 HydrophobicContact CG2-SD 4.24Å; G1393-M1397 PolarHBondContact O-N 2.97Å; G1393-M1397 VanDerWaalsContact O-N 3.07Å; E1394-M1397 PolarHBondContact O-N 2.88Å; M1397-R1399 PolarHBondContact O-N 2.79Å; M1397-L1400 WeakPolarHBondContact O-CB 3.37Å; M1397-L1400 PolarHBondContact O-N 3.24Å; M1397-L1400 HydrophobicContact SD-CD2 4.02Å; M1397-L1401 HydrophobicContact CG-CD1 4.14Å; M1397-L1401 HydrophobicContact CG-CG 4.43Å; M1397-L1401 WeakPolarHBondContact O-CG 3.49Å; M1397-L1401 PolarHBondContact O-N 2.85Å; M1397-L1401 HydrophobicContact SD-CG 4.49Å; M1397-L1412 HydrophobicContact SD-CD1 4.31Å; M1397-L1426 HydrophobicContact CE-CD2 3.56Å; M1397-L1426 HydrophobicContact SD-CD2 3.89Å; M1397-A1429 HydrophobicContact CE-CB 4.22Å; M1397-I1430 HydrophobicContact CB-CD1 3.89Å; M1397-I1430 HydrophobicContact CB-CG1 3.63Å; M1397-I1430 HydrophobicContact CE-CG1 4.08Å; M1397-I1430 HydrophobicContact CG-CD1 3.84Å; M1397-I1430 HydrophobicContact CG-CG1 3.93Å; M1397-L1444 HydrophobicContact CB-CD2 3.79Å; M1397-L1444 HydrophobicContact CG-CD2 3.64Å |
| 1398 | K | 91 | Very high | 88.6 | Confident | 99 Ų | 99 | 52.5 Ų | 52.5 | 43% | 0.43 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.1 | -44.9 | 175.7 | -175.7 | 173.3 | 166.3 | -170.1 | 0 | 112.1 | E1394 E1395 K1402 L1444 | E1394-K1398 WeakPolarHBondContact O-CB 3.36Å; E1394-K1398 PolarHBondContact O-N 3.2Å; E1395-K1398 PolarHBondContact O-N 3.12Å; E1395-K1398 IonicContact OE1-NZ 3.48Å; E1395-K1398 PolarHBondContact OE1-NZ 2.9Å; E1395-K1398 IonicContact OE2-NZ 3.49Å; K1398-K1402 WeakPolarHBondContact O-CB 3Å; K1398-K1402 PolarHBondContact O-N 2.93Å; K1398-L1444 HydrophobicContact CB-CD1 3.6Å; K1398-L1444 HydrophobicContact CD-CD1 4.01Å; K1398-L1444 HydrophobicContact CG-CD1 3.84Å |
| 1399 | R | 89.5 | Confident | 88.7 | Confident | 117 Ų | 117 | 49.4 Ų | 49.4 | 44% | 0.442 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65.8 | -40 | 174.7 | -72.5 | 165.2 | 172.7 | -146 | -9 | 111.7 | M1390 E1395 G1396 M1397 K1402 T1403 | M1390-R1399 HydrophobicContact CB-CB 4.22Å; M1390-R1399 WeakPolarHBondContact O-CD 3.48Å; M1390-R1399 PolarHBondContact O-NH1 3.31Å; M1390-R1399 HydrophobicContact SD-CB 4.47Å; E1395-R1399 WeakPolarHBondContact O-CB 3.43Å; E1395-R1399 WeakPolarHBondContact O-CD 3.28Å; E1395-R1399 VanDerWaalsContact O-CG 3.24Å; E1395-R1399 WeakPolarHBondContact O-CG 3.46Å; E1395-R1399 PolarHBondContact O-N 3.11Å; G1396-R1399 PolarHBondContact O-N 3.23Å; M1397-R1399 PolarHBondContact O-N 2.79Å; R1399-K1402 PolarHBondContact O-N 3.43Å; R1399-T1403 WeakPolarHBondContact O-CB 3.47Å; R1399-T1403 PolarHBondContact O-N 3.49Å; R1399-T1403 PolarHBondContact O-OG1 2.85Å |
| 1400 | L | 91.1 | Very high | 88.7 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.8 | -48.5 | 174.4 | 178 | 51.9 | 0 | 0 | 0 | 112.4 | L1352 L1383 L1386 V1387 M1390 G1396 M1397 K1402 T1403 L1404 L1412 | L1352-L1400 HydrophobicContact CD2-CD1 3.79Å; L1383-L1400 HydrophobicContact CD1-CD2 3.76Å; L1386-L1400 HydrophobicContact CD2-CD1 3.5Å; L1386-L1400 HydrophobicContact CD2-CD2 3.8Å; L1386-L1400 HydrophobicContact CD2-CG 4.27Å; V1387-L1400 HydrophobicContact CG2-CD2 4.03Å; M1390-L1400 HydrophobicContact CE-CB 3.61Å; M1390-L1400 HydrophobicContact CE-CD1 3.91Å; M1390-L1400 HydrophobicContact CE-CD2 4.17Å; M1390-L1400 HydrophobicContact CE-CG 4.07Å; M1390-L1400 HydrophobicContact SD-CB 3.82Å; M1390-L1400 HydrophobicContact SD-CD1 4.3Å; G1396-L1400 WeakPolarHBondContact O-CB 3.25Å; G1396-L1400 PolarHBondContact O-N 3.12Å; M1397-L1400 WeakPolarHBondContact O-CB 3.37Å; M1397-L1400 PolarHBondContact O-N 3.24Å; M1397-L1400 HydrophobicContact SD-CD2 4.02Å; L1400-K1402 VanDerWaalsContact C-N 3.34Å; L1400-K1402 PolarHBondContact O-N 2.94Å; L1400-T1403 VanDerWaalsContact O-CB 3.27Å; L1400-T1403 WeakPolarHBondContact O-CB 3.48Å; L1400-T1403 PolarHBondContact O-N 3.48Å; L1400-L1404 HydrophobicContact CD1-CD1 3.62Å; L1400-L1404 HydrophobicContact CD1-CG 3.95Å; L1400-L1404 HydrophobicContact CG-CD1 4.22Å; L1400-L1404 WeakPolarHBondContact O-CG 3.15Å; L1400-L1404 PolarHBondContact O-N 2.97Å; L1400-L1412 HydrophobicContact CD1-CD2 4.4Å; L1400-L1412 HydrophobicContact CD2-CD1 3.79Å; L1400-L1412 HydrophobicContact CD2-CD2 3.91Å; L1400-L1412 HydrophobicContact CG-CD1 3.94Å; L1400-L1412 HydrophobicContact CG-CD2 4.32Å |
| 1401 | L | 90.2 | Very high | 88.7 | Confident | 24 Ų | 24 | 51.2 Ų | 51.2 | 13% | 0.126 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 178.4 | -69.1 | 171.8 | 0 | 0 | 0 | 111.3 | M1397 T1403 L1404 G1405 L1409 L1412 L1444 L1445 | M1397-L1401 HydrophobicContact CG-CD1 4.14Å; M1397-L1401 HydrophobicContact CG-CG 4.43Å; M1397-L1401 WeakPolarHBondContact O-CG 3.49Å; M1397-L1401 PolarHBondContact O-N 2.85Å; M1397-L1401 HydrophobicContact SD-CG 4.49Å; L1401-T1403 VanDerWaalsContact C-N 3.33Å; L1401-T1403 PolarHBondContact O-N 3.22Å; L1401-L1404 PolarHBondContact O-N 3.09Å; L1401-G1405 PolarHBondContact O-N 3.24Å; L1401-L1409 HydrophobicContact CD2-CB 3.82Å; L1401-L1409 HydrophobicContact CD2-CD1 3.94Å; L1401-L1409 HydrophobicContact CD2-CG 4.48Å; L1401-L1412 HydrophobicContact CD2-CD1 3.78Å; L1401-L1444 HydrophobicContact CD1-CD2 4.19Å; L1401-L1445 HydrophobicContact CD1-CD2 3.8Å |
| 1402 | K | 88.2 | Confident | 89 | Confident | 132 Ų | 132 | 48.5 Ų | 48.5 | 57% | 0.574 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -69 | -29.9 | 176 | -167.2 | 161 | 174.4 | -119.3 | 0 | 113.4 | E1349 K1398 R1399 L1400 | E1349-K1402 HydrophobicContact CG-CG 4.45Å; E1349-K1402 WeakPolarHBondContact OE1-CD 2.84Å; E1349-K1402 IonicContact OE1-NZ 2.59Å; E1349-K1402 PolarHBondContact OE1-NZ 2.9Å; E1349-K1402 VanDerWaalsContact OE2-CE 3.22Å; E1349-K1402 WeakPolarHBondContact OE2-CE 3.47Å; E1349-K1402 IonicContact OE2-NZ 2.98Å; E1349-K1402 PolarHBondContact OE2-NZ 2.75Å; K1398-K1402 WeakPolarHBondContact O-CB 3Å; K1398-K1402 PolarHBondContact O-N 2.93Å; R1399-K1402 PolarHBondContact O-N 3.43Å; L1400-K1402 VanDerWaalsContact C-N 3.34Å; L1400-K1402 PolarHBondContact O-N 2.94Å |
| 1403 | T | 87.4 | Confident | 89.2 | Confident | 6 Ų | 6 | 47.7 Ų | 47.7 | 4% | 0.037 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.6 | -55 | 167.1 | -60.1 | 0 | 0 | 0 | 0 | 110.1 | E1349 L1352 R1353 R1399 L1400 L1401 G1405 | E1349-T1403 WeakPolarHBondContact O-CA 3.37Å; E1349-T1403 WeakPolarHBondContact O-CB 3.29Å; E1349-T1403 WeakPolarHBondContact O-CG2 3.49Å; E1349-T1403 PolarHBondContact O-OG1 3.02Å; E1349-T1403 VanDerWaalsContact O-OG1 3.12Å; L1352-T1403 HydrophobicContact CB-CG2 3.98Å; L1352-T1403 HydrophobicContact CD2-CG2 4.2Å; L1352-T1403 HydrophobicContact CG-CG2 4.27Å; R1353-T1403 HydrophobicContact CG-CG2 3.86Å; R1353-T1403 PolarHBondContact NE-O 3.41Å; R1353-T1403 PolarHBondContact NH2-O 3.07Å; R1399-T1403 WeakPolarHBondContact O-CB 3.47Å; R1399-T1403 PolarHBondContact O-N 3.49Å; R1399-T1403 PolarHBondContact O-OG1 2.85Å; L1400-T1403 VanDerWaalsContact O-CB 3.27Å; L1400-T1403 WeakPolarHBondContact O-CB 3.48Å; L1400-T1403 PolarHBondContact O-N 3.48Å; L1401-T1403 VanDerWaalsContact C-N 3.33Å; L1401-T1403 PolarHBondContact O-N 3.22Å; T1403-G1405 PolarHBondContact O-N 2.95Å |
| 1404 | L | 87.1 | Confident | 89.3 | Confident | 8 Ų | 8 | 50.1 Ų | 50.1 | 4% | 0.042 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -78 | -16.9 | -170.4 | -65.1 | 178 | 0 | 0 | 0 | 114.2 | R1353 L1369 L1400 L1401 L1412 | R1353-L1404 PolarHBondContact NH2-O 3.1Å; L1369-L1404 HydrophobicContact CD1-CD1 3.8Å; L1369-L1404 HydrophobicContact CD1-CD2 4.1Å; L1369-L1404 HydrophobicContact CD2-CD2 4.28Å; L1400-L1404 HydrophobicContact CD1-CD1 3.62Å; L1400-L1404 HydrophobicContact CD1-CG 3.95Å; L1400-L1404 HydrophobicContact CG-CD1 4.22Å; L1400-L1404 WeakPolarHBondContact O-CG 3.15Å; L1400-L1404 PolarHBondContact O-N 2.97Å; L1401-L1404 PolarHBondContact O-N 3.09Å; L1404-L1412 HydrophobicContact CD1-CD1 4.07Å; L1404-L1412 HydrophobicContact CD1-CD2 3.64Å; L1404-L1412 HydrophobicContact CD1-CG 3.64Å |
| 1405 | G | 86.2 | Confident | 89.4 | Confident | 31 Ų | 31 | 45.9 Ų | 45.9 | 32% | 0.32 | 24% | 0.238 | S | C | . | . | trans | 82.5 | -165.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | L1401 T1403 D1407 G1408 | L1401-G1405 PolarHBondContact O-N 3.24Å; T1403-G1405 PolarHBondContact O-N 2.95Å; G1405-D1407 PolarHBondContact O-N 2.92Å; G1405-G1408 WeakPolarHBondContact O-CA 3.22Å; G1405-G1408 PolarHBondContact O-N 2.94Å | ||
| 1406 | D | 82.9 | Confident | 89.5 | Confident | 172 Ų | 172 | 41.6 Ų | 41.6 | 92% | 0.92 | 22% | 0.219 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | -42.4 | -168.1 | -58.4 | -18.1 | 0 | 0 | 0 | 113.1 | G1408 | D1406-G1408 PolarHBondContact O-N 3.37Š|
| 1407 | D | 84.7 | Confident | 89.4 | Confident | 122 Ų | 122 | 44.2 Ų | 44.2 | 65% | 0.652 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | -5.2 | 174.3 | -62.2 | -54.8 | 0 | 0 | 0 | 113.4 | G1405 L1409 A1410 N1411 | G1405-D1407 PolarHBondContact O-N 2.92Å; D1407-L1409 VanDerWaalsContact C-N 3.34Å; D1407-L1409 PolarHBondContact O-N 2.95Å; D1407-A1410 PolarHBondContact O-N 3.28Å; D1407-A1410 VanDerWaalsContact O-N 3.1Å; D1407-N1411 PolarHBondContact O-N 2.75Å |
| 1408 | G | 88.1 | Confident | 89.2 | Confident | 0 Ų | 0 | 45.4 Ų | 45.4 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -58.3 | -38.5 | -168.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | G1405 D1406 N1411 L1412 | G1405-G1408 WeakPolarHBondContact O-CA 3.22Å; G1405-G1408 PolarHBondContact O-N 2.94Å; D1406-G1408 PolarHBondContact O-N 3.37Å; G1408-N1411 PolarHBondContact O-N 2.76Å; G1408-L1412 VanDerWaalsContact O-CG 3.29Å; G1408-L1412 WeakPolarHBondContact O-CG 3.37Å; G1408-L1412 PolarHBondContact O-N 2.96Å |
| 1409 | L | 92 | Very high | 89 | Confident | 12 Ų | 12 | 41.8 Ų | 41.8 | 6% | 0.063 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.8 | -43.9 | 176.8 | -176.1 | 65.6 | 0 | 0 | 0 | 111.9 | L1401 D1407 N1411 L1412 I1413 L1426 L1445 T1454 L1455 A1458 | L1401-L1409 HydrophobicContact CD2-CB 3.82Å; L1401-L1409 HydrophobicContact CD2-CD1 3.94Å; L1401-L1409 HydrophobicContact CD2-CG 4.48Å; D1407-L1409 VanDerWaalsContact C-N 3.34Å; D1407-L1409 PolarHBondContact O-N 2.95Å; L1409-N1411 VanDerWaalsContact C-N 3.34Å; L1409-L1412 PolarHBondContact O-N 3.47Å; L1409-I1413 HydrophobicContact CD1-CD1 4.4Å; L1409-I1413 HydrophobicContact CG-CD1 4.03Å; L1409-I1413 WeakPolarHBondContact O-CD1 3.41Å; L1409-I1413 VanDerWaalsContact O-CG1 3.3Å; L1409-I1413 WeakPolarHBondContact O-CG1 3.31Å; L1409-I1413 PolarHBondContact O-N 2.85Å; L1409-L1426 HydrophobicContact CD1-CD1 3.88Å; L1409-L1426 HydrophobicContact CD1-CD2 4.43Å; L1409-L1445 HydrophobicContact CD1-CD1 4.37Å; L1409-L1445 HydrophobicContact CD2-CD1 3.68Å; L1409-L1445 HydrophobicContact CD2-CD2 4.06Å; L1409-T1454 HydrophobicContact CD2-CG2 3.78Å; L1409-L1455 HydrophobicContact CD2-CD2 4.36Å; L1409-A1458 HydrophobicContact CB-CB 4.17Å; L1409-A1458 HydrophobicContact CD2-CB 3.65Å; L1409-A1458 HydrophobicContact CG-CB 3.71Å |
| 1410 | A | 91.2 | Very high | 89 | Confident | 31 Ų | 31 | 38.8 Ų | 38.8 | 26% | 0.256 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -67.4 | -38 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | D1407 I1413 T1414 A1458 | D1407-A1410 PolarHBondContact O-N 3.28Å; D1407-A1410 VanDerWaalsContact O-N 3.1Å; A1410-I1413 PolarHBondContact O-N 3.47Å; A1410-T1414 VanDerWaalsContact O-CB 3.32Å; A1410-T1414 WeakPolarHBondContact O-CB 3.36Å; A1410-T1414 PolarHBondContact O-N 3.48Å; A1410-T1414 PolarHBondContact O-OG1 3.37Å; A1410-A1458 HydrophobicContact CB-CB 4.11Å |
| 1411 | N | 90.6 | Very high | 88.9 | Confident | 30 Ų | 30 | 42.9 Ų | 42.9 | 16% | 0.16 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.4 | -41.5 | 173.7 | -81.4 | -12.9 | 0 | 0 | 0 | 112.3 | N1364 P1366 L1369 D1407 G1408 L1409 T1414 A1415 | N1364-N1411 PolarHBondContact O-ND2 3.41Å; P1366-N1411 HydrophobicContact CB-CB 4.25Å; L1369-N1411 HydrophobicContact CD1-CB 4.37Å; D1407-N1411 PolarHBondContact O-N 2.75Å; G1408-N1411 PolarHBondContact O-N 2.76Å; L1409-N1411 VanDerWaalsContact C-N 3.34Å; N1411-T1414 PolarHBondContact O-N 3.09Å; N1411-A1415 WeakPolarHBondContact O-CB 3.38Å; N1411-A1415 PolarHBondContact O-N 2.9Å |
| 1412 | L | 92.1 | Very high | 88.9 | Confident | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.6 | -48 | 173.6 | -73.7 | 171.8 | 0 | 0 | 0 | 112.5 | L1369 F1373 L1383 M1397 L1400 L1401 L1404 G1408 L1409 T1414 A1415 A1416 L1426 | L1369-L1412 HydrophobicContact CD1-CD2 4.42Å; F1373-L1412 HydrophobicContact CZ-CD2 3.96Å; L1383-L1412 HydrophobicContact CD1-CD2 3.91Å; M1397-L1412 HydrophobicContact SD-CD1 4.31Å; L1400-L1412 HydrophobicContact CD1-CD2 4.4Å; L1400-L1412 HydrophobicContact CD2-CD1 3.79Å; L1400-L1412 HydrophobicContact CD2-CD2 3.91Å; L1400-L1412 HydrophobicContact CG-CD1 3.94Å; L1400-L1412 HydrophobicContact CG-CD2 4.32Å; L1401-L1412 HydrophobicContact CD2-CD1 3.78Å; L1404-L1412 HydrophobicContact CD1-CD1 4.07Å; L1404-L1412 HydrophobicContact CD1-CD2 3.64Å; L1404-L1412 HydrophobicContact CD1-CG 3.64Å; G1408-L1412 VanDerWaalsContact O-CG 3.29Å; G1408-L1412 WeakPolarHBondContact O-CG 3.37Å; G1408-L1412 PolarHBondContact O-N 2.96Å; L1409-L1412 PolarHBondContact O-N 3.47Å; L1412-T1414 VanDerWaalsContact C-N 3.29Å; L1412-T1414 PolarHBondContact O-N 2.92Å; L1412-A1415 PolarHBondContact O-N 3.39Å; L1412-A1416 VanDerWaalsContact O-CB 3.25Å; L1412-A1416 WeakPolarHBondContact O-CB 3.38Å; L1412-A1416 PolarHBondContact O-N 3.48Å; L1412-L1426 HydrophobicContact CB-CD2 4.4Å; L1412-L1426 HydrophobicContact CD1-CD2 4.31Å |
| 1413 | I | 91.7 | Very high | 89 | Confident | 2 Ų | 2 | 35.4 Ų | 35.4 | 1% | 0.01 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -58.4 | -45.9 | 178.3 | -67.5 | 157.9 | 0 | 0 | 0 | 110 | L1409 A1410 A1416 G1417 G1418 M1423 L1426 A1458 | L1409-I1413 HydrophobicContact CD1-CD1 4.4Å; L1409-I1413 HydrophobicContact CG-CD1 4.03Å; L1409-I1413 WeakPolarHBondContact O-CD1 3.41Å; L1409-I1413 VanDerWaalsContact O-CG1 3.3Å; L1409-I1413 WeakPolarHBondContact O-CG1 3.31Å; L1409-I1413 PolarHBondContact O-N 2.85Å; A1410-I1413 PolarHBondContact O-N 3.47Å; I1413-A1416 PolarHBondContact O-N 3.31Å; I1413-G1417 PolarHBondContact O-N 3.15Å; I1413-G1418 VanDerWaalsContact O-CA 3.24Å; I1413-G1418 WeakPolarHBondContact O-CA 3.47Å; I1413-G1418 PolarHBondContact O-N 3.35Å; I1413-M1423 HydrophobicContact CD1-CE 3.5Å; I1413-M1423 HydrophobicContact CD1-SD 4.34Å; I1413-M1423 HydrophobicContact CG1-CE 4.23Å; I1413-M1423 HydrophobicContact CG1-SD 4.49Å; I1413-L1426 HydrophobicContact CD1-CD1 4.15Å; I1413-L1426 HydrophobicContact CG1-CD1 3.48Å; I1413-L1426 VanDerWaalsContact CG1-CD1 3.48Å; I1413-A1458 HydrophobicContact CD1-CB 3.52Å; I1413-A1458 WeakPolarHBondContact CD1-O 3.43Å |
| 1414 | T | 91.2 | Very high | 89.2 | Confident | 78 Ų | 78 | 36.9 Ų | 36.9 | 48% | 0.479 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.4 | -46.9 | 178.5 | -57.4 | 0 | 0 | 0 | 0 | 111.4 | P1366 A1410 N1411 L1412 A1416 G1417 | P1366-T1414 HydrophobicContact CB-CG2 3.9Å; P1366-T1414 HydrophobicContact CG-CG2 4.11Å; A1410-T1414 VanDerWaalsContact O-CB 3.32Å; A1410-T1414 WeakPolarHBondContact O-CB 3.36Å; A1410-T1414 PolarHBondContact O-N 3.48Å; A1410-T1414 PolarHBondContact O-OG1 3.37Å; N1411-T1414 PolarHBondContact O-N 3.09Å; L1412-T1414 VanDerWaalsContact C-N 3.29Å; L1412-T1414 PolarHBondContact O-N 2.92Å; T1414-A1416 VanDerWaalsContact C-N 3.32Å; T1414-A1416 PolarHBondContact O-N 2.88Å; T1414-G1417 PolarHBondContact O-N 3.27Å; T1414-G1417 VanDerWaalsContact O-N 3.15Å |
| 1415 | A | 90.8 | Very high | 89.4 | Confident | 5 Ų | 5 | 36.5 Ų | 36.5 | 4% | 0.041 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.5 | -37.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | P1366 L1369 K1370 F1373 N1411 L1412 G1417 | P1366-A1415 VanDerWaalsContact O-CB 3.29Å; P1366-A1415 WeakPolarHBondContact O-CB 3.27Å; L1369-A1415 HydrophobicContact CB-CB 3.65Å; K1370-A1415 HydrophobicContact CB-CB 4.22Å; K1370-A1415 WeakPolarHBondContact CG-O 3.29Å; F1373-A1415 HydrophobicContact CD2-CB 4.08Å; F1373-A1415 HydrophobicContact CE2-CB 3.71Å; N1411-A1415 WeakPolarHBondContact O-CB 3.38Å; N1411-A1415 PolarHBondContact O-N 2.9Å; L1412-A1415 PolarHBondContact O-N 3.39Å; A1415-G1417 PolarHBondContact O-N 3.05Å |
| 1416 | A | 91.2 | Very high | 89.6 | Confident | 5 Ų | 5 | 35 Ų | 35 | 4% | 0.041 | 22% | 0.217 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.4 | 12.5 | 177 | 0 | 0 | 0 | 0 | 0 | 114.2 | A1379 L1412 I1413 T1414 A1425 | A1379-A1416 HydrophobicContact CB-CB 3.98Å; L1412-A1416 VanDerWaalsContact O-CB 3.25Å; L1412-A1416 WeakPolarHBondContact O-CB 3.38Å; L1412-A1416 PolarHBondContact O-N 3.48Å; I1413-A1416 PolarHBondContact O-N 3.31Å; T1414-A1416 VanDerWaalsContact C-N 3.32Å; T1414-A1416 PolarHBondContact O-N 2.88Å; A1416-A1425 HydrophobicContact CB-CB 3.81Å |
| 1417 | G | 88.4 | Confident | 89.9 | Confident | 54 Ų | 54 | 27 Ų | 27 | 56% | 0.557 | 17% | 0.174 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 106.9 | 0.2 | 171.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | I1413 T1414 A1415 | I1413-G1417 PolarHBondContact O-N 3.15Å; T1414-G1417 PolarHBondContact O-N 3.27Å; T1414-G1417 VanDerWaalsContact O-N 3.15Å; A1415-G1417 PolarHBondContact O-N 3.05Å |
| 1418 | G | 87.1 | Confident | 90.1 | Very high | 26 Ų | 26 | 24.5 Ų | 24.5 | 27% | 0.268 | 16% | 0.157 | S | C | . | . | S | Bend | trans | 79.5 | 155.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | I1413 E1420 N1421 G1422 | I1413-G1418 VanDerWaalsContact O-CA 3.24Å; I1413-G1418 WeakPolarHBondContact O-CA 3.47Å; I1413-G1418 PolarHBondContact O-N 3.35Å; G1418-E1420 PolarHBondContact O-N 2.85Å; G1418-N1421 PolarHBondContact O-N 3.12Å; G1418-G1422 PolarHBondContact O-N 2.97Å; G1418-G1422 VanDerWaalsContact O-N 3.15Å |
| 1419 | G | 87.5 | Confident | 90.2 | Very high | 22 Ų | 22 | 24.7 Ų | 24.7 | 23% | 0.227 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | 47.1 | -122 | 172.2 | 0 | 0 | 0 | 0 | 0 | 114 | N1421 G1422 M1423 | G1419-N1421 PolarHBondContact O-N 3.15Å; G1419-G1422 PolarHBondContact O-N 2.83Å; G1419-M1423 WeakPolarHBondContact O-CB 3.27Å; G1419-M1423 WeakPolarHBondContact O-CG 3.2Å; G1419-M1423 PolarHBondContact O-N 3.08Å |
| 1420 | E | 89 | Confident | 90.1 | Very high | 55 Ų | 55 | 24.6 Ų | 24.6 | 26% | 0.257 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -58.2 | -45.6 | -177.5 | -177.4 | -171.6 | 143.2 | 0 | 0 | 113 | G1418 M1423 E1424 K1471 K1475 | G1418-E1420 PolarHBondContact O-N 2.85Å; E1420-M1423 PolarHBondContact O-N 3.4Å; E1420-E1424 WeakPolarHBondContact O-CB 3.34Å; E1420-E1424 PolarHBondContact O-N 3.43Å; E1420-K1471 HydrophobicContact CB-CB 4.44Å; E1420-K1471 HydrophobicContact CG-CB 3.72Å; E1420-K1471 WeakPolarHBondContact OE2-CD 3.38Å; E1420-K1475 WeakPolarHBondContact OE1-CE 3.5Å; E1420-K1475 IonicContact OE1-NZ 3.65Å; E1420-K1475 PolarHBondContact OE1-NZ 3.4Å |
| 1421 | N | 89.7 | Confident | 89.5 | Confident | 85 Ų | 85 | 24.6 Ų | 24.6 | 46% | 0.455 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -71.1 | -40.7 | -177.1 | -64.5 | -19.2 | 0 | 0 | 0 | 111.2 | G1418 G1419 M1423 E1424 A1425 | G1418-N1421 PolarHBondContact O-N 3.12Å; G1419-N1421 PolarHBondContact O-N 3.15Å; N1421-M1423 VanDerWaalsContact C-N 3.32Å; N1421-M1423 PolarHBondContact O-N 2.96Å; N1421-E1424 PolarHBondContact O-N 2.96Å; N1421-A1425 PolarHBondContact O-N 3.34Å |
| 1422 | G | 90.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.3 | -36.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | G1418 G1419 L1426 | G1418-G1422 PolarHBondContact O-N 2.97Å; G1418-G1422 VanDerWaalsContact O-N 3.15Å; G1419-G1422 PolarHBondContact O-N 2.83Å; G1422-L1426 WeakPolarHBondContact O-CG 3.42Å; G1422-L1426 PolarHBondContact O-N 2.67Å; G1422-L1426 VanDerWaalsContact O-N 3.15Å |
| 1423 | M | 90.7 | Very high | 87.7 | Confident | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -69.7 | -39.8 | 172.2 | -76.5 | -64.8 | -178.1 | 0 | 0 | 112.7 | I1413 G1419 E1420 N1421 A1425 L1426 I1427 L1455 A1459 L1469 A1472 | I1413-M1423 HydrophobicContact CD1-CE 3.5Å; I1413-M1423 HydrophobicContact CD1-SD 4.34Å; I1413-M1423 HydrophobicContact CG1-CE 4.23Å; I1413-M1423 HydrophobicContact CG1-SD 4.49Å; G1419-M1423 WeakPolarHBondContact O-CB 3.27Å; G1419-M1423 WeakPolarHBondContact O-CG 3.2Å; G1419-M1423 PolarHBondContact O-N 3.08Å; E1420-M1423 PolarHBondContact O-N 3.4Å; N1421-M1423 VanDerWaalsContact C-N 3.32Å; N1421-M1423 PolarHBondContact O-N 2.96Å; M1423-A1425 VanDerWaalsContact C-N 3.35Å; M1423-A1425 PolarHBondContact O-N 3.01Å; M1423-L1426 PolarHBondContact O-N 3.2Å; M1423-L1426 HydrophobicContact SD-CD1 4Å; M1423-I1427 WeakPolarHBondContact O-CD1 3.3Å; M1423-I1427 VanDerWaalsContact O-CG1 3.27Å; M1423-I1427 WeakPolarHBondContact O-CG1 3.26Å; M1423-I1427 PolarHBondContact O-N 3.3Å; M1423-L1455 HydrophobicContact CE-CB 3.8Å; M1423-L1455 HydrophobicContact CE-CD2 3.59Å; M1423-L1455 HydrophobicContact CE-CG 4.31Å; M1423-L1455 WeakPolarHBondContact CE-O 3.05Å; M1423-L1455 HydrophobicContact SD-CD2 3.81Å; M1423-A1459 HydrophobicContact CE-CB 3.75Å; M1423-L1469 HydrophobicContact CE-CD1 4.48Å; M1423-L1469 HydrophobicContact CG-CD1 4.48Å; M1423-L1469 HydrophobicContact SD-CD1 4.17Å; M1423-A1472 HydrophobicContact CB-CB 3.48Å; M1423-A1472 VanDerWaalsContact CB-CB 3.48Å |
| 1424 | E | 90.3 | Very high | 87.1 | Confident | 36 Ų | 36 | 35.9 Ų | 35.9 | 17% | 0.168 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.8 | -44.1 | 175 | -174.3 | -175.9 | 169.8 | 0 | 0 | 111.8 | E1420 N1421 I1427 K1428 K1475 F1476 | E1420-E1424 WeakPolarHBondContact O-CB 3.34Å; E1420-E1424 PolarHBondContact O-N 3.43Å; N1421-E1424 PolarHBondContact O-N 2.96Å; E1424-I1427 PolarHBondContact O-N 2.94Å; E1424-K1428 VanDerWaalsContact CD-NZ 3.3Å; E1424-K1428 HydrophobicContact CG-CD 4.34Å; E1424-K1428 WeakPolarHBondContact O-CG 3.37Å; E1424-K1428 PolarHBondContact O-N 2.88Å; E1424-K1428 WeakPolarHBondContact OE1-CE 3.16Å; E1424-K1428 IonicContact OE1-NZ 2.84Å; E1424-K1428 PolarHBondContact OE1-NZ 2.94Å; E1424-K1475 HydrophobicContact CG-CD 4.21Å; E1424-K1475 WeakPolarHBondContact OE2-CD 3.36Å; E1424-K1475 WeakPolarHBondContact OE2-CE 3.01Å; E1424-K1475 IonicContact OE2-NZ 2.71Å; E1424-K1475 PolarHBondContact OE2-NZ 3.48Å; E1424-F1476 HydrophobicContact CB-CE2 4.46Å; E1424-F1476 HydrophobicContact CG-CE2 4.1Å; E1424-F1476 HydrophobicContact CG-CZ 3.82Å |
| 1425 | A | 90.8 | Very high | 86.6 | Confident | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.3 | -43.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | A1379 L1383 A1416 N1421 M1423 I1427 K1428 A1429 | A1379-A1425 HydrophobicContact CB-CB 4.35Å; L1383-A1425 HydrophobicContact CD2-CB 4.14Å; A1416-A1425 HydrophobicContact CB-CB 3.81Å; N1421-A1425 PolarHBondContact O-N 3.34Å; M1423-A1425 VanDerWaalsContact C-N 3.35Å; M1423-A1425 PolarHBondContact O-N 3.01Å; A1425-I1427 PolarHBondContact O-N 3.5Å; A1425-K1428 PolarHBondContact O-N 2.95Å; A1425-A1429 WeakPolarHBondContact O-CB 3.46Å; A1425-A1429 PolarHBondContact O-N 3.46Å |
| 1426 | L | 91.9 | Very high | 86.4 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -58.5 | -46.6 | 176 | -80.4 | 171.9 | 0 | 0 | 0 | 112.4 | L1383 M1397 L1409 L1412 I1413 G1422 M1423 A1429 I1430 L1441 | L1383-L1426 HydrophobicContact CD2-CD2 4.16Å; L1383-L1426 HydrophobicContact CD2-CG 4.45Å; M1397-L1426 HydrophobicContact CE-CD2 3.56Å; M1397-L1426 HydrophobicContact SD-CD2 3.89Å; L1409-L1426 HydrophobicContact CD1-CD1 3.88Å; L1409-L1426 HydrophobicContact CD1-CD2 4.43Å; L1412-L1426 HydrophobicContact CB-CD2 4.4Å; L1412-L1426 HydrophobicContact CD1-CD2 4.31Å; I1413-L1426 HydrophobicContact CD1-CD1 4.15Å; I1413-L1426 HydrophobicContact CG1-CD1 3.48Å; I1413-L1426 VanDerWaalsContact CG1-CD1 3.48Å; G1422-L1426 WeakPolarHBondContact O-CG 3.42Å; G1422-L1426 PolarHBondContact O-N 2.67Å; G1422-L1426 VanDerWaalsContact O-N 3.15Å; M1423-L1426 PolarHBondContact O-N 3.2Å; M1423-L1426 HydrophobicContact SD-CD1 4Å; L1426-A1429 PolarHBondContact O-N 3.23Å; L1426-I1430 PolarHBondContact O-N 3.14Å; L1426-I1430 VanDerWaalsContact O-N 3.09Å; L1426-L1441 HydrophobicContact CB-CD2 4.08Å |
| 1427 | I | 89.2 | Confident | 86.1 | Confident | 3 Ų | 3 | 39.6 Ų | 39.6 | 2% | 0.015 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -65.7 | -40.5 | -178.8 | -65.1 | 161.3 | 0 | 0 | 0 | 110.5 | M1423 E1424 A1425 G1431 L1438 L1441 A1472 F1476 | M1423-I1427 WeakPolarHBondContact O-CD1 3.3Å; M1423-I1427 VanDerWaalsContact O-CG1 3.27Å; M1423-I1427 WeakPolarHBondContact O-CG1 3.26Å; M1423-I1427 PolarHBondContact O-N 3.3Å; E1424-I1427 PolarHBondContact O-N 2.94Å; A1425-I1427 PolarHBondContact O-N 3.5Å; I1427-G1431 PolarHBondContact O-N 3.5Å; I1427-L1438 HydrophobicContact CD1-CB 4.4Å; I1427-L1438 HydrophobicContact CD1-CD1 4.02Å; I1427-L1438 HydrophobicContact CG1-CB 4.46Å; I1427-L1438 HydrophobicContact CG1-CD1 4.36Å; I1427-L1441 HydrophobicContact CG1-CD2 4.06Å; I1427-A1472 HydrophobicContact CD1-CB 4.37Å; I1427-F1476 HydrophobicContact CB-CD2 4.32Å; I1427-F1476 HydrophobicContact CB-CE1 4.37Å; I1427-F1476 HydrophobicContact CB-CE2 3.7Å; I1427-F1476 HydrophobicContact CB-CZ 3.73Å; I1427-F1476 HydrophobicContact CD1-CD2 3.93Å; I1427-F1476 HydrophobicContact CD1-CE2 3.65Å; I1427-F1476 HydrophobicContact CG1-CE2 4.29Å; I1427-F1476 HydrophobicContact CG2-CD1 3.98Å; I1427-F1476 HydrophobicContact CG2-CD2 3.79Å; I1427-F1476 HydrophobicContact CG2-CE1 3.77Å; I1427-F1476 HydrophobicContact CG2-CE2 3.6Å; I1427-F1476 HydrophobicContact CG2-CG 4Å; I1427-F1476 HydrophobicContact CG2-CZ 3.59Å |
| 1428 | K | 89 | Confident | 86.2 | Confident | 71 Ų | 71 | 37 Ų | 37 | 31% | 0.309 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -62.5 | -43.2 | 173.1 | -74.2 | 168.4 | -175.9 | 164.6 | 0 | 112.6 | D1380 E1424 A1425 G1431 F1476 | D1380-K1428 HydrophobicContact CB-CD 4.31Å; D1380-K1428 IonicContact OD1-NZ 2.75Å; D1380-K1428 WeakPolarHBondContact OD2-CD 3.44Å; D1380-K1428 IonicContact OD2-NZ 3.17Å; D1380-K1428 PolarHBondContact OD2-NZ 2.73Å; E1424-K1428 VanDerWaalsContact CD-NZ 3.3Å; E1424-K1428 HydrophobicContact CG-CD 4.34Å; E1424-K1428 WeakPolarHBondContact O-CG 3.37Å; E1424-K1428 PolarHBondContact O-N 2.88Å; E1424-K1428 WeakPolarHBondContact OE1-CE 3.16Å; E1424-K1428 IonicContact OE1-NZ 2.84Å; E1424-K1428 PolarHBondContact OE1-NZ 2.94Å; A1425-K1428 PolarHBondContact O-N 2.95Å; K1428-G1431 WeakPolarHBondContact O-CA 3.29Å; K1428-G1431 PolarHBondContact O-N 3.38Å; K1428-G1431 VanDerWaalsContact O-N 3.12Å; K1428-F1476 HydrophobicContact CG-CE1 4.01Å; K1428-F1476 HydrophobicContact CG-CZ 4.02Å |
| 1429 | A | 90.5 | Very high | 86.4 | Confident | 3 Ų | 3 | 37.9 Ų | 37.9 | 3% | 0.025 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -73.9 | -29.8 | -174 | 0 | 0 | 0 | 0 | 0 | 113.9 | L1383 V1387 M1397 A1425 L1426 G1431 | L1383-A1429 HydrophobicContact CB-CB 4.23Å; L1383-A1429 HydrophobicContact CD2-CB 3.85Å; L1383-A1429 HydrophobicContact CG-CB 3.6Å; V1387-A1429 WeakPolarHBondContact CG1-O 3.32Å; V1387-A1429 HydrophobicContact CG2-CB 4.14Å; M1397-A1429 HydrophobicContact CE-CB 4.22Å; A1425-A1429 WeakPolarHBondContact O-CB 3.46Å; A1425-A1429 PolarHBondContact O-N 3.46Å; L1426-A1429 PolarHBondContact O-N 3.23Å; A1429-G1431 VanDerWaalsContact C-N 3.32Å |
| 1430 | I | 88.6 | Confident | 86.5 | Confident | 11 Ų | 11 | 37.5 Ų | 37.5 | 6% | 0.056 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -70.4 | -30.7 | 166.7 | -99.5 | -177 | 0 | 0 | 0 | 111.6 | G1393 M1397 L1426 G1437 A1440 L1441 L1444 | G1393-I1430 WeakPolarHBondContact CA-O 3.5Å; M1397-I1430 HydrophobicContact CB-CD1 3.89Å; M1397-I1430 HydrophobicContact CB-CG1 3.63Å; M1397-I1430 HydrophobicContact CE-CG1 4.08Å; M1397-I1430 HydrophobicContact CG-CD1 3.84Å; M1397-I1430 HydrophobicContact CG-CG1 3.93Å; L1426-I1430 PolarHBondContact O-N 3.14Å; L1426-I1430 VanDerWaalsContact O-N 3.09Å; I1430-G1437 WeakPolarHBondContact CG2-O 3.4Å; I1430-A1440 HydrophobicContact CG2-CB 3.7Å; I1430-L1441 HydrophobicContact CD1-CB 3.93Å; I1430-L1441 HydrophobicContact CD1-CD1 3.83Å; I1430-L1441 HydrophobicContact CD1-CG 4.47Å; I1430-L1444 HydrophobicContact CD1-CD2 3.9Å |
| 1431 | G | 78 | Confident | 86.6 | Confident | 31 Ų | 31 | 34.9 Ų | 34.9 | 32% | 0.32 | 20% | 0.204 | S | C | . | . | trans | 76.6 | 176.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | I1427 K1428 A1429 G1437 | I1427-G1431 PolarHBondContact O-N 3.5Å; K1428-G1431 WeakPolarHBondContact O-CA 3.29Å; K1428-G1431 PolarHBondContact O-N 3.38Å; K1428-G1431 VanDerWaalsContact O-N 3.12Å; A1429-G1431 VanDerWaalsContact C-N 3.32Å; G1431-G1437 WeakPolarHBondContact O-CA 3.44Å | ||
| 1432 | G | 73.7 | Confident | 86.7 | Confident | 58 Ų | 58 | 30.8 Ų | 30.8 | 60% | 0.598 | 18% | 0.183 | S | C | * | . | trans | 113.1 | 167.8 | -166.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 1433 | K | 73 | Confident | 86.7 | Confident | 176 Ų | 176 | 35.2 Ų | 35.2 | 77% | 0.765 | 21% | 0.206 | S | C | * | . | S | Bend | trans | -105.4 | 128 | 179.9 | -68.8 | 179.1 | -179.8 | 174.6 | 0 | 110.7 | V1435 E1436 | K1433-V1435 PolarHBondContact O-N 2.93Å; K1433-E1436 PolarHBondContact N-OE2 2.84Å; K1433-E1436 WeakPolarHBondContact O-CB 3.23Å; K1433-E1436 VanDerWaalsContact O-CG 3.28Å; K1433-E1436 WeakPolarHBondContact O-CG 3.48Å; K1433-E1436 PolarHBondContact O-N 3.36Å |
| 1434 | G | 77.5 | Confident | 86.7 | Confident | 34 Ų | 34 | 37.2 Ų | 37.2 | 35% | 0.351 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.1 | -128.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | E1436 F1476 | G1434-E1436 PolarHBondContact O-N 2.9Å; G1434-F1476 CarbonylContact C-O 3.44Å; G1434-F1476 WeakPolarHBondContact CA-O 3.42Å |
| 1435 | V | 82.2 | Confident | 86.8 | Confident | 48 Ų | 48 | 36.9 Ų | 36.9 | 29% | 0.291 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -69 | -8.3 | -176.8 | -58.9 | 0 | 0 | 0 | 0 | 115.1 | K1433 G1437 L1438 T1439 A1485 | K1433-V1435 PolarHBondContact O-N 2.93Å; V1435-G1437 PolarHBondContact O-N 2.86Å; V1435-L1438 PolarHBondContact O-N 3.45Å; V1435-T1439 PolarHBondContact O-N 2.72Å; V1435-T1439 PolarHBondContact O-OG1 3.16Å; V1435-A1485 HydrophobicContact CG1-CB 3.66Å |
| 1436 | E | 84.8 | Confident | 86.7 | Confident | 118 Ų | 118 | 39.3 Ų | 39.3 | 55% | 0.551 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -58.5 | -47.1 | 177.2 | -68 | 175.3 | 161.8 | 0 | 0 | 112 | K1433 G1434 L1438 T1439 A1440 | K1433-E1436 PolarHBondContact N-OE2 2.84Å; K1433-E1436 WeakPolarHBondContact O-CB 3.23Å; K1433-E1436 VanDerWaalsContact O-CG 3.28Å; K1433-E1436 WeakPolarHBondContact O-CG 3.48Å; K1433-E1436 PolarHBondContact O-N 3.36Å; G1434-E1436 PolarHBondContact O-N 2.9Å; E1436-L1438 VanDerWaalsContact C-N 3.33Å; E1436-L1438 PolarHBondContact O-N 2.89Å; E1436-T1439 WeakPolarHBondContact O-CB 3.27Å; E1436-T1439 PolarHBondContact O-N 3.03Å; E1436-T1439 VanDerWaalsContact O-N 3.12Å; E1436-A1440 PolarHBondContact O-N 3.01Å |
| 1437 | G | 86.6 | Confident | 86.4 | Confident | 1 Ų | 1 | 39.9 Ų | 39.9 | 1% | 0.01 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -67.7 | -32.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | I1430 G1431 V1435 L1441 | I1430-G1437 WeakPolarHBondContact CG2-O 3.4Å; G1431-G1437 WeakPolarHBondContact O-CA 3.44Å; V1435-G1437 PolarHBondContact O-N 2.86Å; G1437-L1441 WeakPolarHBondContact O-CB 3.25Å; G1437-L1441 PolarHBondContact O-N 3.14Å |
| 1438 | L | 89.9 | Confident | 86.3 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -68.2 | -38.6 | 171.2 | 177.2 | 60.1 | 0 | 0 | 0 | 111.3 | I1427 V1435 E1436 L1441 I1442 L1469 A1473 L1486 A1489 | I1427-L1438 HydrophobicContact CD1-CB 4.4Å; I1427-L1438 HydrophobicContact CD1-CD1 4.02Å; I1427-L1438 HydrophobicContact CG1-CB 4.46Å; I1427-L1438 HydrophobicContact CG1-CD1 4.36Å; V1435-L1438 PolarHBondContact O-N 3.45Å; E1436-L1438 VanDerWaalsContact C-N 3.33Å; E1436-L1438 PolarHBondContact O-N 2.89Å; L1438-L1441 PolarHBondContact O-N 3.41Å; L1438-I1442 HydrophobicContact CD1-CD1 4Å; L1438-I1442 HydrophobicContact CD1-CG1 4.3Å; L1438-I1442 HydrophobicContact CG-CD1 3.97Å; L1438-I1442 WeakPolarHBondContact O-CB 3.16Å; L1438-I1442 VanDerWaalsContact O-CG1 3.29Å; L1438-I1442 WeakPolarHBondContact O-CG1 3.21Å; L1438-I1442 PolarHBondContact O-N 3.27Å; L1438-L1469 HydrophobicContact CD1-CD1 4.18Å; L1438-A1473 HydrophobicContact CD2-CB 3.64Å; L1438-L1486 HydrophobicContact CD1-CD1 4.42Å; L1438-L1486 HydrophobicContact CD2-CD1 3.99Å; L1438-A1489 HydrophobicContact CB-CB 4.23Å; L1438-A1489 HydrophobicContact CD2-CB 3.81Å; L1438-A1489 HydrophobicContact CG-CB 3.71Å |
| 1439 | T | 90.7 | Very high | 86.3 | Confident | 44 Ų | 44 | 45.1 Ų | 45.1 | 27% | 0.27 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -65.2 | -44.5 | 176.4 | -52.5 | 0 | 0 | 0 | 0 | 111 | V1435 E1436 I1442 N1443 A1489 | V1435-T1439 PolarHBondContact O-N 2.72Å; V1435-T1439 PolarHBondContact O-OG1 3.16Å; E1436-T1439 WeakPolarHBondContact O-CB 3.27Å; E1436-T1439 PolarHBondContact O-N 3.03Å; E1436-T1439 VanDerWaalsContact O-N 3.12Å; T1439-I1442 PolarHBondContact O-N 2.95Å; T1439-N1443 WeakPolarHBondContact O-CB 3.46Å; T1439-N1443 VanDerWaalsContact O-CG 3.27Å; T1439-N1443 PolarHBondContact O-N 3.28Å; T1439-N1443 PolarHBondContact O-ND2 2.66Å; T1439-A1489 WeakPolarHBondContact OG1-CA 3.25Å; T1439-A1489 WeakPolarHBondContact OG1-CB 3.3Å |
| 1440 | A | 89.8 | Confident | 86.3 | Confident | 13 Ų | 13 | 50 Ų | 50 | 11% | 0.107 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -58.5 | -47.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | E1394 I1430 E1436 N1443 L1444 | E1394-A1440 HydrophobicContact CG-CB 3.94Å; E1394-A1440 WeakPolarHBondContact OE1-CA 3.4Å; E1394-A1440 VanDerWaalsContact OE1-CB 3.25Å; E1394-A1440 WeakPolarHBondContact OE1-CB 3.3Å; I1430-A1440 HydrophobicContact CG2-CB 3.7Å; E1436-A1440 PolarHBondContact O-N 3.01Å; A1440-N1443 PolarHBondContact O-N 3.15Å; A1440-L1444 WeakPolarHBondContact O-CB 3.4Å; A1440-L1444 PolarHBondContact O-N 2.66Å |
| 1441 | L | 91.3 | Very high | 86.5 | Confident | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.2 | -42.8 | 176.9 | -178.7 | 60.3 | 0 | 0 | 0 | 112.8 | L1426 I1427 I1430 G1437 L1438 L1445 L1455 | L1426-L1441 HydrophobicContact CB-CD2 4.08Å; I1427-L1441 HydrophobicContact CG1-CD2 4.06Å; I1430-L1441 HydrophobicContact CD1-CB 3.93Å; I1430-L1441 HydrophobicContact CD1-CD1 3.83Å; I1430-L1441 HydrophobicContact CD1-CG 4.47Å; G1437-L1441 WeakPolarHBondContact O-CB 3.25Å; G1437-L1441 PolarHBondContact O-N 3.14Å; L1438-L1441 PolarHBondContact O-N 3.41Å; L1441-L1445 HydrophobicContact CD1-CD1 3.92Å; L1441-L1445 HydrophobicContact CD1-CG 4.46Å; L1441-L1445 HydrophobicContact CG-CD1 4.26Å; L1441-L1445 WeakPolarHBondContact O-CG 3.31Å; L1441-L1445 PolarHBondContact O-N 2.71Å; L1441-L1455 HydrophobicContact CD1-CD2 4.39Å; L1441-L1455 HydrophobicContact CD2-CD1 4.46Å; L1441-L1455 HydrophobicContact CD2-CD2 3.78Å; L1441-L1455 HydrophobicContact CG-CD1 4.33Å; L1441-L1455 HydrophobicContact CG-CD2 3.94Å |
| 1442 | I | 91.9 | Very high | 87.2 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -63.4 | -43.8 | 175.8 | -72 | 165.2 | 0 | 0 | 0 | 110.8 | L1438 T1439 L1445 G1447 L1452 L1455 L1486 A1489 | L1438-I1442 HydrophobicContact CD1-CD1 4Å; L1438-I1442 HydrophobicContact CD1-CG1 4.3Å; L1438-I1442 HydrophobicContact CG-CD1 3.97Å; L1438-I1442 WeakPolarHBondContact O-CB 3.16Å; L1438-I1442 VanDerWaalsContact O-CG1 3.29Å; L1438-I1442 WeakPolarHBondContact O-CG1 3.21Å; L1438-I1442 PolarHBondContact O-N 3.27Å; T1439-I1442 PolarHBondContact O-N 2.95Å; I1442-L1445 PolarHBondContact O-N 3.17Å; I1442-G1447 VanDerWaalsContact O-CA 3.27Å; I1442-G1447 WeakPolarHBondContact O-CA 3.22Å; I1442-G1447 PolarHBondContact O-N 3Å; I1442-L1452 HydrophobicContact CD1-CD2 3.68Å; I1442-L1452 HydrophobicContact CD1-CG 4.42Å; I1442-L1452 HydrophobicContact CG1-CD2 4.11Å; I1442-L1455 HydrophobicContact CG1-CD1 3.71Å; I1442-L1486 HydrophobicContact CD1-CD1 4.32Å; I1442-A1489 HydrophobicContact CD1-CB 3.86Å |
| 1443 | N | 91.2 | Very high | 88.1 | Confident | 93 Ų | 93 | 47 Ų | 47 | 50% | 0.497 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -65 | -43.6 | 178.7 | -74 | -29.3 | 0 | 0 | 0 | 112.3 | T1439 A1440 L1445 G1446 G1447 | T1439-N1443 WeakPolarHBondContact O-CB 3.46Å; T1439-N1443 VanDerWaalsContact O-CG 3.27Å; T1439-N1443 PolarHBondContact O-N 3.28Å; T1439-N1443 PolarHBondContact O-ND2 2.66Å; A1440-N1443 PolarHBondContact O-N 3.15Å; N1443-L1445 PolarHBondContact O-N 3.13Å; N1443-G1446 PolarHBondContact O-N 2.87Å; N1443-G1446 VanDerWaalsContact O-N 3.12Å; N1443-G1447 PolarHBondContact O-N 3.34Å |
| 1444 | L | 90.7 | Very high | 88.9 | Confident | 42 Ų | 42 | 41.5 Ų | 41.5 | 22% | 0.22 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -56.7 | -38.5 | 175.8 | 174.7 | 60.9 | 0 | 0 | 0 | 112.2 | M1397 K1398 L1401 I1430 A1440 G1446 | M1397-L1444 HydrophobicContact CB-CD2 3.79Å; M1397-L1444 HydrophobicContact CG-CD2 3.64Å; K1398-L1444 HydrophobicContact CB-CD1 3.6Å; K1398-L1444 HydrophobicContact CD-CD1 4.01Å; K1398-L1444 HydrophobicContact CG-CD1 3.84Å; L1401-L1444 HydrophobicContact CD1-CD2 4.19Å; I1430-L1444 HydrophobicContact CD1-CD2 3.9Å; A1440-L1444 WeakPolarHBondContact O-CB 3.4Å; A1440-L1444 PolarHBondContact O-N 2.66Å; L1444-G1446 PolarHBondContact O-N 3.46Å |
| 1445 | L | 91.8 | Very high | 89.7 | Confident | 28 Ų | 28 | 39.9 Ų | 39.9 | 15% | 0.147 | 23% | 0.23 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -86.3 | 19.1 | -179.4 | -63.7 | 172 | 0 | 0 | 0 | 113.8 | L1401 L1409 L1441 I1442 N1443 G1451 T1454 L1455 | L1401-L1445 HydrophobicContact CD1-CD2 3.8Å; L1409-L1445 HydrophobicContact CD1-CD1 4.37Å; L1409-L1445 HydrophobicContact CD2-CD1 3.68Å; L1409-L1445 HydrophobicContact CD2-CD2 4.06Å; L1441-L1445 HydrophobicContact CD1-CD1 3.92Å; L1441-L1445 HydrophobicContact CD1-CG 4.46Å; L1441-L1445 HydrophobicContact CG-CD1 4.26Å; L1441-L1445 WeakPolarHBondContact O-CG 3.31Å; L1441-L1445 PolarHBondContact O-N 2.71Å; I1442-L1445 PolarHBondContact O-N 3.17Å; N1443-L1445 PolarHBondContact O-N 3.13Å; L1445-G1451 WeakPolarHBondContact O-CA 3.35Å; L1445-G1451 PolarHBondContact O-N 2.87Å; L1445-T1454 HydrophobicContact CB-CG2 4.44Å; L1445-T1454 HydrophobicContact CD1-CG2 4.48Å; L1445-T1454 HydrophobicContact CD2-CG2 4.2Å; L1445-L1455 HydrophobicContact CD1-CD1 4.3Å; L1445-L1455 HydrophobicContact CD1-CD2 3.43Å; L1445-L1455 VanDerWaalsContact CD1-CD2 3.43Å; L1445-L1455 HydrophobicContact CD1-CG 3.59Å |
| 1446 | G | 88.1 | Confident | 90.1 | Very high | 52 Ų | 52 | 37.9 Ų | 37.9 | 54% | 0.536 | 22% | 0.217 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 103.8 | 0 | 173.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | N1443 L1444 | N1443-G1446 PolarHBondContact O-N 2.87Å; N1443-G1446 VanDerWaalsContact O-N 3.12Å; L1444-G1446 PolarHBondContact O-N 3.46Å |
| 1447 | G | 86.7 | Confident | 90.4 | Very high | 12 Ų | 12 | 35.3 Ų | 35.3 | 12% | 0.124 | 22% | 0.216 | C | C | . | . | S | Bend | trans | 75.2 | 157.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | I1442 N1443 E1449 N1450 G1451 | I1442-G1447 VanDerWaalsContact O-CA 3.27Å; I1442-G1447 WeakPolarHBondContact O-CA 3.22Å; I1442-G1447 PolarHBondContact O-N 3Å; N1443-G1447 PolarHBondContact O-N 3.34Å; G1447-E1449 PolarHBondContact O-N 3.02Å; G1447-N1450 PolarHBondContact O-N 3.47Å; G1447-N1450 VanDerWaalsContact O-N 3.1Å; G1447-G1451 PolarHBondContact O-N 2.92Å; G1447-G1451 VanDerWaalsContact O-N 3.12Å |
| 1448 | K | 86.6 | Confident | 90.6 | Very high | 99 Ų | 99 | 36.1 Ų | 36.1 | 43% | 0.43 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | 42.9 | -124.1 | 175.2 | -56.4 | -167.8 | -178.4 | -175.8 | 0 | 112.2 | N1450 G1451 L1452 E1495 A1499 | K1448-N1450 PolarHBondContact O-N 2.73Å; K1448-G1451 PolarHBondContact O-N 3.41Å; K1448-L1452 WeakPolarHBondContact O-CB 3.24Å; K1448-L1452 WeakPolarHBondContact O-CG 3.31Å; K1448-L1452 PolarHBondContact O-N 3.35Å; K1448-L1452 VanDerWaalsContact O-N 3.09Å; K1448-E1495 IonicContact NZ-OE2 3.61Å; K1448-E1495 PolarHBondContact NZ-OE2 2.85Å; K1448-A1499 HydrophobicContact CB-CB 3.97Å |
| 1449 | E | 89.9 | Confident | 90.5 | Very high | 84 Ų | 84 | 36.6 Ų | 36.6 | 39% | 0.393 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -56.9 | -45 | -179.1 | -176.1 | 177.9 | 147.1 | 0 | 0 | 113 | G1447 L1452 A1453 A1499 N1502 | G1447-E1449 PolarHBondContact O-N 3.02Å; E1449-L1452 PolarHBondContact O-N 3.46Å; E1449-A1453 WeakPolarHBondContact O-CB 3.44Å; E1449-A1453 PolarHBondContact O-N 3.45Å; E1449-A1499 HydrophobicContact CB-CB 4.42Å; E1449-N1502 HydrophobicContact CG-CB 3.72Å; E1449-N1502 VanDerWaalsContact OE2-CB 3.24Å; E1449-N1502 WeakPolarHBondContact OE2-CB 3.11Å; E1449-N1502 PolarHBondContact OE2-ND2 2.83Å |
| 1450 | N | 90.3 | Very high | 90.3 | Very high | 105 Ų | 105 | 37.4 Ų | 37.4 | 56% | 0.561 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -66.9 | -44.7 | -176.8 | -66.1 | -40.9 | 0 | 0 | 0 | 111.7 | G1447 K1448 A1453 T1454 | G1447-N1450 PolarHBondContact O-N 3.47Å; G1447-N1450 VanDerWaalsContact O-N 3.1Å; K1448-N1450 PolarHBondContact O-N 2.73Å; N1450-A1453 PolarHBondContact O-N 3.24Å; N1450-T1454 VanDerWaalsContact O-CB 3.32Å; N1450-T1454 WeakPolarHBondContact O-CB 3.1Å; N1450-T1454 PolarHBondContact O-N 2.83Å; N1450-T1454 PolarHBondContact O-OG1 3.12Å |
| 1451 | G | 91.8 | Very high | 90 | Very high | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -63.3 | -45.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L1445 G1447 K1448 T1454 L1455 | L1445-G1451 WeakPolarHBondContact O-CA 3.35Å; L1445-G1451 PolarHBondContact O-N 2.87Å; G1447-G1451 PolarHBondContact O-N 2.92Å; G1447-G1451 VanDerWaalsContact O-N 3.12Å; K1448-G1451 PolarHBondContact O-N 3.41Å; G1451-T1454 PolarHBondContact O-N 2.81Å; G1451-L1455 WeakPolarHBondContact O-CG 3.22Å; G1451-L1455 PolarHBondContact O-N 3Å |
| 1452 | L | 92.8 | Very high | 89.6 | Confident | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.2 | -46.8 | 175 | -71.9 | 177.3 | 0 | 0 | 0 | 112.6 | I1442 K1448 E1449 T1454 L1455 I1456 L1469 L1486 A1490 A1499 L1500 A1503 | I1442-L1452 HydrophobicContact CD1-CD2 3.68Å; I1442-L1452 HydrophobicContact CD1-CG 4.42Å; I1442-L1452 HydrophobicContact CG1-CD2 4.11Å; K1448-L1452 WeakPolarHBondContact O-CB 3.24Å; K1448-L1452 WeakPolarHBondContact O-CG 3.31Å; K1448-L1452 PolarHBondContact O-N 3.35Å; K1448-L1452 VanDerWaalsContact O-N 3.09Å; E1449-L1452 PolarHBondContact O-N 3.46Å; L1452-T1454 VanDerWaalsContact C-N 3.28Å; L1452-T1454 PolarHBondContact O-N 3.45Å; L1452-L1455 PolarHBondContact O-N 2.91Å; L1452-I1456 WeakPolarHBondContact O-CB 3.32Å; L1452-I1456 WeakPolarHBondContact O-CD1 3.44Å; L1452-I1456 VanDerWaalsContact O-CG1 3.22Å; L1452-I1456 WeakPolarHBondContact O-CG1 3.47Å; L1452-I1456 PolarHBondContact O-N 3.47Å; L1452-L1469 HydrophobicContact CD2-CD2 4.12Å; L1452-L1486 HydrophobicContact CD2-CD1 3.57Å; L1452-L1486 HydrophobicContact CD2-CG 4.09Å; L1452-A1490 HydrophobicContact CD1-CB 3.8Å; L1452-A1499 HydrophobicContact CD1-CB 4.22Å; L1452-L1500 HydrophobicContact CD1-CB 4.08Å; L1452-L1500 HydrophobicContact CD1-CD1 4.03Å; L1452-A1503 HydrophobicContact CB-CB 3.5Å; L1452-A1503 VanDerWaalsContact CB-CB 3.5Å; L1452-A1503 HydrophobicContact CD1-CB 4.42Å |
| 1453 | A | 91.8 | Very high | 89.3 | Confident | 39 Ų | 39 | 43.5 Ų | 43.5 | 32% | 0.322 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61.7 | -39.5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | E1449 N1450 I1456 A1457 A1503 | E1449-A1453 WeakPolarHBondContact O-CB 3.44Å; E1449-A1453 PolarHBondContact O-N 3.45Å; N1450-A1453 PolarHBondContact O-N 3.24Å; A1453-I1456 PolarHBondContact O-N 3.42Å; A1453-A1457 VanDerWaalsContact O-CB 3.26Å; A1453-A1457 WeakPolarHBondContact O-CB 3.39Å; A1453-A1457 PolarHBondContact O-N 3.27Å; A1453-A1503 HydrophobicContact CB-CB 4.07Å |
| 1454 | T | 91.7 | Very high | 89.1 | Confident | 59 Ų | 59 | 43.9 Ų | 43.9 | 36% | 0.362 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -64.5 | -44.3 | 176 | -55.7 | 0 | 0 | 0 | 0 | 111.6 | L1409 L1445 N1450 G1451 L1452 A1458 | L1409-T1454 HydrophobicContact CD2-CG2 3.78Å; L1445-T1454 HydrophobicContact CB-CG2 4.44Å; L1445-T1454 HydrophobicContact CD1-CG2 4.48Å; L1445-T1454 HydrophobicContact CD2-CG2 4.2Å; N1450-T1454 VanDerWaalsContact O-CB 3.32Å; N1450-T1454 WeakPolarHBondContact O-CB 3.1Å; N1450-T1454 PolarHBondContact O-N 2.83Å; N1450-T1454 PolarHBondContact O-OG1 3.12Å; G1451-T1454 PolarHBondContact O-N 2.81Å; L1452-T1454 VanDerWaalsContact C-N 3.28Å; L1452-T1454 PolarHBondContact O-N 3.45Å; T1454-A1458 VanDerWaalsContact O-CB 3.3Å; T1454-A1458 WeakPolarHBondContact O-CB 3.35Å; T1454-A1458 PolarHBondContact O-N 2.9Å |
| 1455 | L | 92.5 | Very high | 89.1 | Confident | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -64.9 | -45.1 | 174.8 | -71.6 | 167.4 | 0 | 0 | 0 | 112.5 | L1409 M1423 L1441 I1442 L1445 G1451 L1452 A1458 A1459 L1469 | L1409-L1455 HydrophobicContact CD2-CD2 4.36Å; M1423-L1455 HydrophobicContact CE-CB 3.8Å; M1423-L1455 HydrophobicContact CE-CD2 3.59Å; M1423-L1455 HydrophobicContact CE-CG 4.31Å; M1423-L1455 WeakPolarHBondContact CE-O 3.05Å; M1423-L1455 HydrophobicContact SD-CD2 3.81Å; L1441-L1455 HydrophobicContact CD1-CD2 4.39Å; L1441-L1455 HydrophobicContact CD2-CD1 4.46Å; L1441-L1455 HydrophobicContact CD2-CD2 3.78Å; L1441-L1455 HydrophobicContact CG-CD1 4.33Å; L1441-L1455 HydrophobicContact CG-CD2 3.94Å; I1442-L1455 HydrophobicContact CG1-CD1 3.71Å; L1445-L1455 HydrophobicContact CD1-CD1 4.3Å; L1445-L1455 HydrophobicContact CD1-CD2 3.43Å; L1445-L1455 VanDerWaalsContact CD1-CD2 3.43Å; L1445-L1455 HydrophobicContact CD1-CG 3.59Å; G1451-L1455 WeakPolarHBondContact O-CG 3.22Å; G1451-L1455 PolarHBondContact O-N 3Å; L1452-L1455 PolarHBondContact O-N 2.91Å; L1455-A1458 PolarHBondContact O-N 3.02Å; L1455-A1459 VanDerWaalsContact O-CB 3.25Å; L1455-A1459 WeakPolarHBondContact O-CB 3.13Å; L1455-A1459 PolarHBondContact O-N 3.42Å; L1455-L1469 HydrophobicContact CB-CD1 4.44Å; L1455-L1469 HydrophobicContact CB-CD2 3.97Å; L1455-L1469 HydrophobicContact CD1-CD1 4.35Å |
| 1456 | I | 91.7 | Very high | 89.1 | Confident | 6 Ų | 6 | 40.6 Ų | 40.6 | 3% | 0.031 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62.4 | -45.6 | 178.8 | -69.1 | 163.3 | 0 | 0 | 0 | 110.2 | L1452 A1453 A1459 G1461 G1465 L1466 L1469 A1503 | L1452-I1456 WeakPolarHBondContact O-CB 3.32Å; L1452-I1456 WeakPolarHBondContact O-CD1 3.44Å; L1452-I1456 VanDerWaalsContact O-CG1 3.22Å; L1452-I1456 WeakPolarHBondContact O-CG1 3.47Å; L1452-I1456 PolarHBondContact O-N 3.47Å; A1453-I1456 PolarHBondContact O-N 3.42Å; I1456-A1459 PolarHBondContact O-N 3.48Å; I1456-G1461 VanDerWaalsContact O-CA 3.27Å; I1456-G1461 WeakPolarHBondContact O-CA 3.43Å; I1456-G1461 PolarHBondContact O-N 3.16Å; I1456-G1465 WeakPolarHBondContact O-CA 3.32Å; I1456-L1466 HydrophobicContact CD1-CD1 3.89Å; I1456-L1466 HydrophobicContact CG1-CB 4.36Å; I1456-L1466 HydrophobicContact CG1-CD1 4.23Å; I1456-L1466 HydrophobicContact CG2-CB 4.33Å; I1456-L1469 HydrophobicContact CG1-CD2 3.92Å; I1456-A1503 HydrophobicContact CD1-CB 3.97Å |
| 1457 | A | 90.7 | Very high | 89.3 | Confident | 64 Ų | 64 | 39 Ų | 39 | 53% | 0.529 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -59.8 | -51.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | A1453 A1459 G1460 G1461 | A1453-A1457 VanDerWaalsContact O-CB 3.26Å; A1453-A1457 WeakPolarHBondContact O-CB 3.39Å; A1453-A1457 PolarHBondContact O-N 3.27Å; A1457-A1459 VanDerWaalsContact C-N 3.26Å; A1457-A1459 PolarHBondContact O-N 2.93Å; A1457-G1460 PolarHBondContact O-N 3.46Å; A1457-G1461 PolarHBondContact O-N 3.24Å |
| 1458 | A | 90.3 | Very high | 89.5 | Confident | 18 Ų | 18 | 38.9 Ų | 38.9 | 15% | 0.149 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -68.6 | -21.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | L1409 A1410 I1413 T1454 L1455 G1460 | L1409-A1458 HydrophobicContact CB-CB 4.17Å; L1409-A1458 HydrophobicContact CD2-CB 3.65Å; L1409-A1458 HydrophobicContact CG-CB 3.71Å; A1410-A1458 HydrophobicContact CB-CB 4.11Å; I1413-A1458 HydrophobicContact CD1-CB 3.52Å; I1413-A1458 WeakPolarHBondContact CD1-O 3.43Å; T1454-A1458 VanDerWaalsContact O-CB 3.3Å; T1454-A1458 WeakPolarHBondContact O-CB 3.35Å; T1454-A1458 PolarHBondContact O-N 2.9Å; L1455-A1458 PolarHBondContact O-N 3.02Å; A1458-G1460 VanDerWaalsContact C-N 3.28Å; A1458-G1460 PolarHBondContact O-N 3.45Å |
| 1459 | A | 88.9 | Confident | 89.8 | Confident | 11 Ų | 11 | 34.1 Ų | 34.1 | 9% | 0.091 | 23% | 0.234 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | -1.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | M1423 L1455 I1456 A1457 G1465 A1468 | M1423-A1459 HydrophobicContact CE-CB 3.75Å; L1455-A1459 VanDerWaalsContact O-CB 3.25Å; L1455-A1459 WeakPolarHBondContact O-CB 3.13Å; L1455-A1459 PolarHBondContact O-N 3.42Å; I1456-A1459 PolarHBondContact O-N 3.48Å; A1457-A1459 VanDerWaalsContact C-N 3.26Å; A1457-A1459 PolarHBondContact O-N 2.93Å; A1459-G1465 VanDerWaalsContact CB-CA 3.48Å; A1459-A1468 HydrophobicContact CB-CB 4.25Å |
| 1460 | G | 85.1 | Confident | 90 | Very high | 60 Ų | 60 | 30.6 Ų | 30.6 | 62% | 0.619 | 22% | 0.217 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 119 | 0.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | A1457 A1458 | A1457-G1460 PolarHBondContact O-N 3.46Å; A1458-G1460 VanDerWaalsContact C-N 3.28Å; A1458-G1460 PolarHBondContact O-N 3.45Å |
| 1461 | G | 83.7 | Confident | 90 | Very high | 24 Ų | 24 | 31.4 Ų | 31.4 | 25% | 0.247 | 22% | 0.216 | C | C | . | . | S | Bend | trans | 77.9 | 161.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | I1456 A1457 V1464 G1465 | I1456-G1461 VanDerWaalsContact O-CA 3.27Å; I1456-G1461 WeakPolarHBondContact O-CA 3.43Å; I1456-G1461 PolarHBondContact O-N 3.16Å; A1457-G1461 PolarHBondContact O-N 3.24Å; G1461-V1464 PolarHBondContact O-N 3.46Å; G1461-G1465 PolarHBondContact O-N 2.98Å |
| 1462 | G | 83.8 | Confident | 90 | Very high | 37 Ų | 37 | 31.4 Ų | 31.4 | 38% | 0.381 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | 48.1 | -138.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114 | V1464 L1466 | G1462-V1464 VanDerWaalsContact C-N 3.29Å; G1462-V1464 PolarHBondContact O-N 3.25Å; G1462-L1466 VanDerWaalsContact O-CB 3.25Å; G1462-L1466 WeakPolarHBondContact O-CB 3.02Å; G1462-L1466 PolarHBondContact O-N 3.28Å; G1462-L1466 VanDerWaalsContact O-N 3.13Å |
| 1463 | Q | 85.8 | Confident | 89.9 | Confident | 81 Ų | 81 | 31.4 Ų | 31.4 | 38% | 0.379 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -57.7 | -37.4 | 176.9 | -170.1 | -157.7 | -3.7 | 0 | 0 | 113 | A1467 Q1516 A1517 | Q1463-A1467 WeakPolarHBondContact O-CB 3.4Å; Q1463-A1467 PolarHBondContact O-N 3.28Å; Q1463-Q1516 HydrophobicContact CG-CB 3.95Å; Q1463-Q1516 PolarHBondContact NE2-O 3.48Å; Q1463-Q1516 VanDerWaalsContact NE2-O 3.08Å; Q1463-A1517 HydrophobicContact CG-CB 4.14Å |
| 1464 | V | 86.6 | Confident | 89.9 | Confident | 101 Ų | 101 | 30.2 Ų | 30.2 | 61% | 0.612 | 21% | 0.207 | S | C | * | . | H | α-helix | trans | -69.2 | -50.7 | -173.5 | 178.8 | 0 | 0 | 0 | 0 | 110.7 | G1461 G1462 L1466 A1467 A1468 | G1461-V1464 PolarHBondContact O-N 3.46Å; G1462-V1464 VanDerWaalsContact C-N 3.29Å; G1462-V1464 PolarHBondContact O-N 3.25Å; V1464-L1466 VanDerWaalsContact C-N 3.34Å; V1464-L1466 PolarHBondContact O-N 3.3Å; V1464-A1467 PolarHBondContact O-N 3.22Å; V1464-A1468 PolarHBondContact O-N 3.34Å |
| 1465 | G | 90.5 | Very high | 89.7 | Confident | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -65.3 | -37.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | I1456 A1459 G1461 A1468 L1469 | I1456-G1465 WeakPolarHBondContact O-CA 3.32Å; A1459-G1465 VanDerWaalsContact CB-CA 3.48Å; G1461-G1465 PolarHBondContact O-N 2.98Å; G1465-A1468 PolarHBondContact O-N 3.44Å; G1465-L1469 WeakPolarHBondContact O-CB 3.47Å; G1465-L1469 PolarHBondContact O-N 2.89Å |
| 1466 | L | 92.7 | Very high | 89.4 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -67.6 | -40.2 | 175.4 | -177.6 | 55.7 | 0 | 0 | 0 | 112.3 | I1456 G1462 V1464 A1468 L1469 L1470 L1486 L1500 A1504 N1513 L1514 A1517 | I1456-L1466 HydrophobicContact CD1-CD1 3.89Å; I1456-L1466 HydrophobicContact CG1-CB 4.36Å; I1456-L1466 HydrophobicContact CG1-CD1 4.23Å; I1456-L1466 HydrophobicContact CG2-CB 4.33Å; G1462-L1466 VanDerWaalsContact O-CB 3.25Å; G1462-L1466 WeakPolarHBondContact O-CB 3.02Å; G1462-L1466 PolarHBondContact O-N 3.28Å; G1462-L1466 VanDerWaalsContact O-N 3.13Å; V1464-L1466 VanDerWaalsContact C-N 3.34Å; V1464-L1466 PolarHBondContact O-N 3.3Å; L1466-A1468 VanDerWaalsContact C-N 3.34Å; L1466-L1469 PolarHBondContact O-N 2.86Å; L1466-L1470 HydrophobicContact CD1-CD1 4.31Å; L1466-L1470 HydrophobicContact CD1-CG 4.27Å; L1466-L1470 HydrophobicContact CG-CD1 4.16Å; L1466-L1470 WeakPolarHBondContact O-CB 3.48Å; L1466-L1470 VanDerWaalsContact O-CG 3.27Å; L1466-L1470 WeakPolarHBondContact O-CG 3.33Å; L1466-L1470 PolarHBondContact O-N 2.63Å; L1466-L1486 HydrophobicContact CD1-CD2 4.29Å; L1466-L1500 HydrophobicContact CD1-CD1 3.9Å; L1466-A1504 HydrophobicContact CD2-CB 3.62Å; L1466-N1513 HydrophobicContact CD2-CB 4.49Å; L1466-L1514 HydrophobicContact CD1-CD1 4.26Å; L1466-L1514 HydrophobicContact CD2-CB 4.16Å; L1466-L1514 HydrophobicContact CD2-CD1 3.98Å; L1466-L1514 HydrophobicContact CG-CD1 4.39Å; L1466-A1517 HydrophobicContact CB-CB 3.91Å; L1466-A1517 HydrophobicContact CD2-CB 3.9Å; L1466-A1517 HydrophobicContact CG-CB 3.62Å |
| 1467 | A | 92 | Very high | 89.2 | Confident | 19 Ų | 19 | 34.2 Ų | 34.2 | 16% | 0.157 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -67.1 | -35.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q1463 V1464 K1471 A1517 | Q1463-A1467 WeakPolarHBondContact O-CB 3.4Å; Q1463-A1467 PolarHBondContact O-N 3.28Å; V1464-A1467 PolarHBondContact O-N 3.22Å; A1467-K1471 VanDerWaalsContact O-CG 3.3Å; A1467-K1471 WeakPolarHBondContact O-CG 3.24Å; A1467-K1471 PolarHBondContact O-N 2.97Å; A1467-A1517 HydrophobicContact CB-CB 3.99Å |
| 1468 | A | 91.3 | Very high | 88.8 | Confident | 9 Ų | 9 | 41.4 Ų | 41.4 | 7% | 0.074 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -63.3 | -47.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A1459 V1464 G1465 L1466 K1471 A1472 | A1459-A1468 HydrophobicContact CB-CB 4.25Å; V1464-A1468 PolarHBondContact O-N 3.34Å; G1465-A1468 PolarHBondContact O-N 3.44Å; L1466-A1468 VanDerWaalsContact C-N 3.34Å; A1468-K1471 PolarHBondContact O-N 2.95Å; A1468-A1472 WeakPolarHBondContact O-CB 2.99Å; A1468-A1472 PolarHBondContact O-N 3.17Å |
| 1469 | L | 92.7 | Very high | 88.5 | Confident | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65.5 | -41.6 | -179.3 | -174.8 | 58.8 | 0 | 0 | 0 | 112.5 | M1423 L1438 L1452 L1455 I1456 G1465 L1466 A1472 A1473 L1486 | M1423-L1469 HydrophobicContact CE-CD1 4.48Å; M1423-L1469 HydrophobicContact CG-CD1 4.48Å; M1423-L1469 HydrophobicContact SD-CD1 4.17Å; L1438-L1469 HydrophobicContact CD1-CD1 4.18Å; L1452-L1469 HydrophobicContact CD2-CD2 4.12Å; L1455-L1469 HydrophobicContact CB-CD1 4.44Å; L1455-L1469 HydrophobicContact CB-CD2 3.97Å; L1455-L1469 HydrophobicContact CD1-CD1 4.35Å; I1456-L1469 HydrophobicContact CG1-CD2 3.92Å; G1465-L1469 WeakPolarHBondContact O-CB 3.47Å; G1465-L1469 PolarHBondContact O-N 2.89Å; L1466-L1469 PolarHBondContact O-N 2.86Å; L1469-A1472 PolarHBondContact O-N 3.48Å; L1469-A1473 WeakPolarHBondContact O-CB 3.43Å; L1469-A1473 PolarHBondContact O-N 2.93Å; L1469-L1486 HydrophobicContact CD1-CD1 4.33Å; L1469-L1486 HydrophobicContact CD2-CD1 3.93Å; L1469-L1486 HydrophobicContact CD2-CD2 4.07Å; L1469-L1486 HydrophobicContact CG-CD1 3.84Å; L1469-L1486 HydrophobicContact CG-CD2 4.02Å |
| 1470 | L | 92.7 | Very high | 88.3 | Confident | 10 Ų | 10 | 48.1 Ų | 48.1 | 5% | 0.052 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.8 | -46.9 | 175.1 | -74.8 | 167.8 | 0 | 0 | 0 | 112 | L1466 A1473 G1474 G1482 L1483 L1486 L1514 A1517 A1518 | L1466-L1470 HydrophobicContact CD1-CD1 4.31Å; L1466-L1470 HydrophobicContact CD1-CG 4.27Å; L1466-L1470 HydrophobicContact CG-CD1 4.16Å; L1466-L1470 WeakPolarHBondContact O-CB 3.48Å; L1466-L1470 VanDerWaalsContact O-CG 3.27Å; L1466-L1470 WeakPolarHBondContact O-CG 3.33Å; L1466-L1470 PolarHBondContact O-N 2.63Å; L1470-A1473 PolarHBondContact O-N 3.4Å; L1470-G1474 PolarHBondContact O-N 3.26Å; L1470-G1482 VanDerWaalsContact O-CA 3.32Å; L1470-G1482 WeakPolarHBondContact O-CA 3.03Å; L1470-L1483 HydrophobicContact CD2-CB 4.04Å; L1470-L1483 HydrophobicContact CD2-CD1 3.85Å; L1470-L1486 HydrophobicContact CD2-CB 4.31Å; L1470-L1486 HydrophobicContact CD2-CD2 3.72Å; L1470-L1486 HydrophobicContact CG-CD2 4.16Å; L1470-L1514 HydrophobicContact CD1-CD1 4.29Å; L1470-A1517 HydrophobicContact CD1-CB 3.87Å; L1470-A1518 HydrophobicContact CD1-CB 4.15Å |
| 1471 | K | 91.9 | Very high | 88.4 | Confident | 122 Ų | 122 | 47.9 Ų | 47.9 | 53% | 0.53 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.4 | -39.5 | 178.3 | -68.9 | 178.4 | -167.1 | 175.8 | 0 | 112.5 | E1420 A1467 A1468 G1474 K1475 | E1420-K1471 HydrophobicContact CB-CB 4.44Å; E1420-K1471 HydrophobicContact CG-CB 3.72Å; E1420-K1471 WeakPolarHBondContact OE2-CD 3.38Å; A1467-K1471 VanDerWaalsContact O-CG 3.3Å; A1467-K1471 WeakPolarHBondContact O-CG 3.24Å; A1467-K1471 PolarHBondContact O-N 2.97Å; A1468-K1471 PolarHBondContact O-N 2.95Å; K1471-G1474 PolarHBondContact O-N 3.29Å; K1471-K1475 PolarHBondContact O-N 3.43Å |
| 1472 | A | 90.4 | Very high | 88.6 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -61.4 | -49 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | M1423 I1427 A1468 L1469 G1474 K1475 F1476 | M1423-A1472 HydrophobicContact CB-CB 3.48Å; M1423-A1472 VanDerWaalsContact CB-CB 3.48Å; I1427-A1472 HydrophobicContact CD1-CB 4.37Å; A1468-A1472 WeakPolarHBondContact O-CB 2.99Å; A1468-A1472 PolarHBondContact O-N 3.17Å; L1469-A1472 PolarHBondContact O-N 3.48Å; A1472-G1474 VanDerWaalsContact C-N 3.27Å; A1472-G1474 PolarHBondContact O-N 3.05Å; A1472-K1475 WeakPolarHBondContact O-CB 3.47Å; A1472-K1475 PolarHBondContact O-N 3.29Å; A1472-K1475 VanDerWaalsContact O-N 3.08Å; A1472-F1476 WeakPolarHBondContact O-CD2 3.22Å |
| 1473 | A | 91.1 | Very high | 89 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -56.3 | -39.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L1438 L1469 L1470 K1475 F1476 A1477 A1485 L1486 | L1438-A1473 HydrophobicContact CD2-CB 3.64Å; L1469-A1473 WeakPolarHBondContact O-CB 3.43Å; L1469-A1473 PolarHBondContact O-N 2.93Å; L1470-A1473 PolarHBondContact O-N 3.4Å; A1473-K1475 VanDerWaalsContact C-N 3.27Å; A1473-K1475 PolarHBondContact O-N 3.01Å; A1473-F1476 PolarHBondContact O-N 3.35Å; A1473-A1477 PolarHBondContact O-N 2.86Å; A1473-A1485 HydrophobicContact CB-CB 4.22Å; A1473-L1486 HydrophobicContact CB-CB 4.25Å |
| 1474 | G | 90.8 | Very high | 89.1 | Confident | 13 Ų | 13 | 43.7 Ų | 43.7 | 13% | 0.134 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.4 | -28.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | L1470 K1471 A1472 F1476 A1477 G1480 G1482 | L1470-G1474 PolarHBondContact O-N 3.26Å; K1471-G1474 PolarHBondContact O-N 3.29Å; A1472-G1474 VanDerWaalsContact C-N 3.27Å; A1472-G1474 PolarHBondContact O-N 3.05Å; G1474-F1476 PolarHBondContact O-N 3.02Å; G1474-A1477 PolarHBondContact O-N 3.49Å; G1474-G1480 WeakPolarHBondContact O-CA 3.42Å; G1474-G1482 VanDerWaalsContact CA-CA 3.43Å; G1474-G1482 VanDerWaalsContact N-CA 3.31Å |
| 1475 | K | 88.7 | Confident | 89.2 | Confident | 93 Ų | 93 | 39.1 Ų | 39.1 | 40% | 0.404 | 22% | 0.218 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -71.5 | -16.4 | 174.3 | -72.4 | 175.6 | 167.1 | 164.3 | 0 | 113.9 | E1420 E1424 K1471 A1472 A1473 | E1420-K1475 WeakPolarHBondContact OE1-CE 3.5Å; E1420-K1475 IonicContact OE1-NZ 3.65Å; E1420-K1475 PolarHBondContact OE1-NZ 3.4Å; E1424-K1475 HydrophobicContact CG-CD 4.21Å; E1424-K1475 WeakPolarHBondContact OE2-CD 3.36Å; E1424-K1475 WeakPolarHBondContact OE2-CE 3.01Å; E1424-K1475 IonicContact OE2-NZ 2.71Å; E1424-K1475 PolarHBondContact OE2-NZ 3.48Å; K1471-K1475 PolarHBondContact O-N 3.43Å; A1472-K1475 WeakPolarHBondContact O-CB 3.47Å; A1472-K1475 PolarHBondContact O-N 3.29Å; A1472-K1475 VanDerWaalsContact O-N 3.08Å; A1473-K1475 VanDerWaalsContact C-N 3.27Å; A1473-K1475 PolarHBondContact O-N 3.01Å |
| 1476 | F | 85.7 | Confident | 89.2 | Confident | 38 Ų | 38 | 39.1 Ų | 39.1 | 17% | 0.167 | 22% | 0.218 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -107.8 | 2.3 | 176.4 | -57 | -82.9 | 0 | 0 | 0 | 113 | E1424 I1427 K1428 G1434 A1472 A1473 G1474 | E1424-F1476 HydrophobicContact CB-CE2 4.46Å; E1424-F1476 HydrophobicContact CG-CE2 4.1Å; E1424-F1476 HydrophobicContact CG-CZ 3.82Å; I1427-F1476 HydrophobicContact CB-CD2 4.32Å; I1427-F1476 HydrophobicContact CB-CE1 4.37Å; I1427-F1476 HydrophobicContact CB-CE2 3.7Å; I1427-F1476 HydrophobicContact CB-CZ 3.73Å; I1427-F1476 HydrophobicContact CD1-CD2 3.93Å; I1427-F1476 HydrophobicContact CD1-CE2 3.65Å; I1427-F1476 HydrophobicContact CG1-CE2 4.29Å; I1427-F1476 HydrophobicContact CG2-CD1 3.98Å; I1427-F1476 HydrophobicContact CG2-CD2 3.79Å; I1427-F1476 HydrophobicContact CG2-CE1 3.77Å; I1427-F1476 HydrophobicContact CG2-CE2 3.6Å; I1427-F1476 HydrophobicContact CG2-CG 4Å; I1427-F1476 HydrophobicContact CG2-CZ 3.59Å; K1428-F1476 HydrophobicContact CG-CE1 4.01Å; K1428-F1476 HydrophobicContact CG-CZ 4.02Å; G1434-F1476 CarbonylContact C-O 3.44Å; G1434-F1476 WeakPolarHBondContact CA-O 3.42Å; A1472-F1476 WeakPolarHBondContact O-CD2 3.22Å; A1473-F1476 PolarHBondContact O-N 3.35Å; G1474-F1476 PolarHBondContact O-N 3.02Å |
| 1477 | A | 87.2 | Confident | 89.1 | Confident | 19 Ų | 19 | 39.3 Ų | 39.3 | 16% | 0.157 | 22% | 0.219 | C | C | . | . | S | Bend | trans | -87.5 | 137.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | A1473 G1474 D1479 G1480 A1485 | A1473-A1477 PolarHBondContact O-N 2.86Å; G1474-A1477 PolarHBondContact O-N 3.49Å; A1477-D1479 PolarHBondContact O-N 3.23Å; A1477-G1480 PolarHBondContact O-N 3.04Å; A1477-A1485 HydrophobicContact CB-CB 3.91Å |
| 1478 | E | 82.2 | Confident | 88.9 | Confident | 214 Ų | 214 | 40.9 Ų | 40.9 | 100% | 1 | 23% | 0.232 | S | C | * | . | S | Bend | trans | -67.5 | -24.7 | 179 | -62.9 | -168.2 | 156.3 | 0 | 0 | 113.1 | ||
| 1479 | D | 84.4 | Confident | 88.8 | Confident | 125 Ų | 125 | 40.6 Ų | 40.6 | 67% | 0.668 | 23% | 0.23 | S | C | * | . | S | Bend | trans | -103.2 | -9 | 178.9 | 59.3 | 3.6 | 0 | 0 | 0 | 113.8 | A1477 D1481 | A1477-D1479 PolarHBondContact O-N 3.23Å; D1479-D1481 PolarHBondContact OD1-N 2.86Å |
| 1480 | G | 85.1 | Confident | 88.7 | Confident | 46 Ų | 46 | 40.8 Ų | 40.8 | 47% | 0.474 | 23% | 0.231 | S | C | . | . | trans | 82.7 | 0.6 | -173.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | G1474 A1477 G1482 | G1474-G1480 WeakPolarHBondContact O-CA 3.42Å; A1477-G1480 PolarHBondContact O-N 3.04Å; G1480-G1482 PolarHBondContact O-N 3.15Å | ||
| 1481 | D | 86.8 | Confident | 88.3 | Confident | 54 Ų | 54 | 43 Ų | 43 | 29% | 0.289 | 26% | 0.257 | S | S | . | . | trans | -79.6 | 89.4 | 179.9 | -169.5 | -21.5 | 0 | 0 | 0 | 111.1 | D1479 L1483 A1484 A1485 | D1479-D1481 PolarHBondContact OD1-N 2.86Å; D1481-L1483 PolarHBondContact O-N 3.19Å; D1481-L1483 WeakPolarHBondContact OD1-CA 3.33Å; D1481-L1483 WeakPolarHBondContact OD1-CB 3.31Å; D1481-L1483 PolarHBondContact OD1-N 3.25Å; D1481-A1484 HydrophobicContact CB-CB 3.94Å; D1481-A1484 PolarHBondContact O-N 3.45Å; D1481-A1484 PolarHBondContact OD1-N 3.44Å; D1481-A1485 VanDerWaalsContact O-CB 3.3Å; D1481-A1485 WeakPolarHBondContact O-CB 3.39Å; D1481-A1485 PolarHBondContact O-N 3.24Å | ||
| 1482 | G | 89.1 | Confident | 88 | Confident | 7 Ų | 7 | 38.1 Ų | 38.1 | 7% | 0.072 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -62 | -20.6 | 176 | 0 | 0 | 0 | 0 | 0 | 115.2 | L1470 G1474 G1480 L1486 | L1470-G1482 VanDerWaalsContact O-CA 3.32Å; L1470-G1482 WeakPolarHBondContact O-CA 3.03Å; G1474-G1482 VanDerWaalsContact CA-CA 3.43Å; G1474-G1482 VanDerWaalsContact N-CA 3.31Å; G1480-G1482 PolarHBondContact O-N 3.15Å; G1482-L1486 WeakPolarHBondContact O-CB 3.25Å; G1482-L1486 PolarHBondContact O-N 3.06Å; G1482-L1486 VanDerWaalsContact O-N 3.1Å |
| 1483 | L | 90.8 | Very high | 87.9 | Confident | 11 Ų | 11 | 40 Ų | 40 | 6% | 0.058 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -79.4 | -46.4 | 175.3 | 178 | 60.9 | 0 | 0 | 0 | 110.7 | L1470 D1481 A1485 L1486 I1487 L1500 L1514 I1529 T1532 L1533 | L1470-L1483 HydrophobicContact CD2-CB 4.04Å; L1470-L1483 HydrophobicContact CD2-CD1 3.85Å; D1481-L1483 PolarHBondContact O-N 3.19Å; D1481-L1483 WeakPolarHBondContact OD1-CA 3.33Å; D1481-L1483 WeakPolarHBondContact OD1-CB 3.31Å; D1481-L1483 PolarHBondContact OD1-N 3.25Å; L1483-A1485 VanDerWaalsContact C-N 3.34Å; L1483-L1486 PolarHBondContact O-N 2.8Å; L1483-I1487 HydrophobicContact CD1-CD1 3.93Å; L1483-I1487 HydrophobicContact CD1-CG1 4.39Å; L1483-I1487 HydrophobicContact CG-CD1 4.1Å; L1483-I1487 VanDerWaalsContact O-CG1 3.31Å; L1483-I1487 WeakPolarHBondContact O-CG1 3.41Å; L1483-I1487 PolarHBondContact O-N 3.46Å; L1483-L1500 HydrophobicContact CD1-CD2 3.85Å; L1483-L1514 HydrophobicContact CD1-CD1 3.87Å; L1483-L1514 HydrophobicContact CD1-CG 4.47Å; L1483-I1529 HydrophobicContact CD2-CG2 3.84Å; L1483-T1532 HydrophobicContact CD2-CG2 3.91Å; L1483-T1532 HydrophobicContact CG-CG2 4.13Å; L1483-L1533 HydrophobicContact CD1-CD2 3.99Å; L1483-L1533 HydrophobicContact CD2-CD2 3.91Å; L1483-L1533 HydrophobicContact CD2-CG 4.43Å; L1483-L1533 HydrophobicContact CG-CD2 4.27Å |
| 1484 | A | 88.2 | Confident | 87.6 | Confident | 36 Ų | 36 | 41.4 Ų | 41.4 | 30% | 0.298 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | D1481 I1487 A1488 | D1481-A1484 HydrophobicContact CB-CB 3.94Å; D1481-A1484 PolarHBondContact O-N 3.45Å; D1481-A1484 PolarHBondContact OD1-N 3.44Å; A1484-I1487 PolarHBondContact O-N 3.43Å; A1484-A1488 WeakPolarHBondContact O-CB 3.19Å; A1484-A1488 PolarHBondContact O-N 2.79Å |
| 1485 | A | 88.9 | Confident | 87.4 | Confident | 6 Ų | 6 | 46.1 Ų | 46.1 | 5% | 0.05 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -60.8 | -44 | 177 | 0 | 0 | 0 | 0 | 0 | 113.2 | V1435 A1473 A1477 D1481 L1483 A1488 A1489 | V1435-A1485 HydrophobicContact CG1-CB 3.66Å; A1473-A1485 HydrophobicContact CB-CB 4.22Å; A1477-A1485 HydrophobicContact CB-CB 3.91Å; D1481-A1485 VanDerWaalsContact O-CB 3.3Å; D1481-A1485 WeakPolarHBondContact O-CB 3.39Å; D1481-A1485 PolarHBondContact O-N 3.24Å; L1483-A1485 VanDerWaalsContact C-N 3.34Å; A1485-A1488 PolarHBondContact O-N 3.28Å; A1485-A1489 WeakPolarHBondContact O-CB 3.18Å; A1485-A1489 PolarHBondContact O-N 3.39Å |
| 1486 | L | 91.6 | Very high | 87.4 | Confident | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -69.1 | -39.6 | 179.5 | -171.1 | 61.7 | 0 | 0 | 0 | 112.1 | L1438 I1442 L1452 L1466 L1469 L1470 A1473 G1482 L1483 A1489 A1490 L1500 | L1438-L1486 HydrophobicContact CD1-CD1 4.42Å; L1438-L1486 HydrophobicContact CD2-CD1 3.99Å; I1442-L1486 HydrophobicContact CD1-CD1 4.32Å; L1452-L1486 HydrophobicContact CD2-CD1 3.57Å; L1452-L1486 HydrophobicContact CD2-CG 4.09Å; L1466-L1486 HydrophobicContact CD1-CD2 4.29Å; L1469-L1486 HydrophobicContact CD1-CD1 4.33Å; L1469-L1486 HydrophobicContact CD2-CD1 3.93Å; L1469-L1486 HydrophobicContact CD2-CD2 4.07Å; L1469-L1486 HydrophobicContact CG-CD1 3.84Å; L1469-L1486 HydrophobicContact CG-CD2 4.02Å; L1470-L1486 HydrophobicContact CD2-CB 4.31Å; L1470-L1486 HydrophobicContact CD2-CD2 3.72Å; L1470-L1486 HydrophobicContact CG-CD2 4.16Å; A1473-L1486 HydrophobicContact CB-CB 4.25Å; G1482-L1486 WeakPolarHBondContact O-CB 3.25Å; G1482-L1486 PolarHBondContact O-N 3.06Å; G1482-L1486 VanDerWaalsContact O-N 3.1Å; L1483-L1486 PolarHBondContact O-N 2.8Å; L1486-A1489 PolarHBondContact O-N 3.01Å; L1486-A1490 WeakPolarHBondContact O-CB 3.44Å; L1486-A1490 PolarHBondContact O-N 2.92Å; L1486-L1500 HydrophobicContact CD2-CD1 3.57Å; L1486-L1500 HydrophobicContact CD2-CD2 4.27Å; L1486-L1500 HydrophobicContact CG-CD1 4.09Å; L1486-L1500 HydrophobicContact CG-CD2 4.46Å |
| 1487 | I | 90.1 | Very high | 87.6 | Confident | 3 Ų | 3 | 39.9 Ų | 39.9 | 2% | 0.015 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.2 | -39.8 | 175 | -64.8 | 165.9 | 0 | 0 | 0 | 110.9 | L1483 A1484 A1490 G1492 L1497 L1500 L1533 A1536 | L1483-I1487 HydrophobicContact CD1-CD1 3.93Å; L1483-I1487 HydrophobicContact CD1-CG1 4.39Å; L1483-I1487 HydrophobicContact CG-CD1 4.1Å; L1483-I1487 VanDerWaalsContact O-CG1 3.31Å; L1483-I1487 WeakPolarHBondContact O-CG1 3.41Å; L1483-I1487 PolarHBondContact O-N 3.46Å; A1484-I1487 PolarHBondContact O-N 3.43Å; I1487-A1490 PolarHBondContact O-N 2.99Å; I1487-G1492 VanDerWaalsContact O-CA 3.29Å; I1487-G1492 WeakPolarHBondContact O-CA 3.44Å; I1487-G1492 PolarHBondContact O-N 3.01Å; I1487-L1497 HydrophobicContact CD1-CD1 4.21Å; I1487-L1500 HydrophobicContact CD1-CD2 4.22Å; I1487-L1500 HydrophobicContact CG1-CD2 3.53Å; I1487-L1533 HydrophobicContact CD1-CD2 3.94Å; I1487-A1536 HydrophobicContact CD1-CB 3.85Å; I1487-A1536 HydrophobicContact CG2-CB 3.97Å |
| 1488 | A | 88 | Confident | 87.7 | Confident | 53 Ų | 53 | 43.5 Ų | 43.5 | 44% | 0.438 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.9 | -49.3 | 175 | 0 | 0 | 0 | 0 | 0 | 111.7 | A1484 A1485 A1490 G1491 G1492 | A1484-A1488 WeakPolarHBondContact O-CB 3.19Å; A1484-A1488 PolarHBondContact O-N 2.79Å; A1485-A1488 PolarHBondContact O-N 3.28Å; A1488-A1490 PolarHBondContact O-N 3.28Å; A1488-G1491 PolarHBondContact O-N 3.42Å; A1488-G1492 PolarHBondContact O-N 3.4Å |
| 1489 | A | 89.3 | Confident | 88.1 | Confident | 3 Ų | 3 | 33.5 Ų | 33.5 | 3% | 0.025 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65.8 | -24.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | L1438 T1439 I1442 A1485 L1486 G1491 | L1438-A1489 HydrophobicContact CB-CB 4.23Å; L1438-A1489 HydrophobicContact CD2-CB 3.81Å; L1438-A1489 HydrophobicContact CG-CB 3.71Å; T1439-A1489 WeakPolarHBondContact OG1-CA 3.25Å; T1439-A1489 WeakPolarHBondContact OG1-CB 3.3Å; I1442-A1489 HydrophobicContact CD1-CB 3.86Å; A1485-A1489 WeakPolarHBondContact O-CB 3.18Å; A1485-A1489 PolarHBondContact O-N 3.39Å; L1486-A1489 PolarHBondContact O-N 3.01Å; A1489-G1491 PolarHBondContact O-N 3.16Å |
| 1490 | A | 89.6 | Confident | 88.4 | Confident | 3 Ų | 3 | 27.5 Ų | 27.5 | 3% | 0.025 | 20% | 0.199 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.6 | -6 | 173 | 0 | 0 | 0 | 0 | 0 | 114.4 | L1452 L1486 I1487 A1488 A1499 | L1452-A1490 HydrophobicContact CD1-CB 3.8Å; L1486-A1490 WeakPolarHBondContact O-CB 3.44Å; L1486-A1490 PolarHBondContact O-N 2.92Å; I1487-A1490 PolarHBondContact O-N 2.99Å; A1488-A1490 PolarHBondContact O-N 3.28Å; A1490-A1499 HydrophobicContact CB-CB 4.37Å |
| 1491 | G | 85.3 | Confident | 88.7 | Confident | 57 Ų | 57 | 25.3 Ų | 25.3 | 59% | 0.588 | 18% | 0.176 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 122.4 | -9 | -178 | 0 | 0 | 0 | 0 | 0 | 114.4 | A1488 A1489 | A1488-G1491 PolarHBondContact O-N 3.42Å; A1489-G1491 PolarHBondContact O-N 3.16Å |
| 1492 | G | 85.1 | Confident | 88.8 | Confident | 20 Ų | 20 | 24.7 Ų | 24.7 | 21% | 0.206 | 17% | 0.173 | C | C | . | . | S | Bend | trans | 70 | 175.9 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | I1487 A1488 E1495 G1496 | I1487-G1492 VanDerWaalsContact O-CA 3.29Å; I1487-G1492 WeakPolarHBondContact O-CA 3.44Å; I1487-G1492 PolarHBondContact O-N 3.01Å; A1488-G1492 PolarHBondContact O-N 3.4Å; G1492-E1495 PolarHBondContact O-N 3.01Å; G1492-G1496 PolarHBondContact O-N 2.87Å |
| 1493 | G | 87.8 | Confident | 88.9 | Confident | 38 Ų | 38 | 25 Ų | 25 | 39% | 0.392 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | 60.9 | -152.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | E1495 L1497 A1536 | G1493-E1495 VanDerWaalsContact C-N 3.33Å; G1493-E1495 PolarHBondContact O-N 2.71Å; G1493-L1497 WeakPolarHBondContact O-CB 3.14Å; G1493-L1497 PolarHBondContact O-N 3.14Å; G1493-A1536 CarbonylContact C-O 3.56Å; G1493-A1536 WeakPolarHBondContact CA-O 3.45Å |
| 1494 | A | 85.3 | Confident | 88.8 | Confident | 30 Ų | 30 | 24.7 Ų | 24.7 | 25% | 0.248 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64.9 | -32.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L1497 E1498 N1546 | A1494-L1497 PolarHBondContact O-N 3.26Å; A1494-E1498 WeakPolarHBondContact O-CB 3.48Å; A1494-E1498 PolarHBondContact O-N 3.45Å; A1494-N1546 HydrophobicContact CB-CB 4.04Å |
| 1495 | E | 85.6 | Confident | 88.7 | Confident | 113 Ų | 113 | 24 Ų | 24 | 53% | 0.528 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -69 | -42.3 | -178 | -64.9 | -169.9 | -157.6 | 0 | 0 | 112.5 | K1448 G1492 G1493 L1497 E1498 A1499 | K1448-E1495 IonicContact NZ-OE2 3.61Å; K1448-E1495 PolarHBondContact NZ-OE2 2.85Å; G1492-E1495 PolarHBondContact O-N 3.01Å; G1493-E1495 VanDerWaalsContact C-N 3.33Å; G1493-E1495 PolarHBondContact O-N 2.71Å; E1495-L1497 VanDerWaalsContact C-N 3.34Å; E1495-E1498 PolarHBondContact O-N 2.73Å; E1495-A1499 WeakPolarHBondContact O-CB 3.32Å; E1495-A1499 PolarHBondContact O-N 3.43Å |
| 1496 | G | 89 | Confident | 88.5 | Confident | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -68 | -34.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | G1492 L1500 | G1492-G1496 PolarHBondContact O-N 2.87Å; G1496-L1500 WeakPolarHBondContact O-CB 3.42Å; G1496-L1500 PolarHBondContact O-N 3.27Å |
| 1497 | L | 90.4 | Very high | 88.1 | Confident | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -67.6 | -41.9 | 174.1 | 179.4 | 64.7 | 0 | 0 | 0 | 111.9 | I1487 G1493 A1494 E1495 L1500 I1501 L1533 L1547 I1550 | I1487-L1497 HydrophobicContact CD1-CD1 4.21Å; G1493-L1497 WeakPolarHBondContact O-CB 3.14Å; G1493-L1497 PolarHBondContact O-N 3.14Å; A1494-L1497 PolarHBondContact O-N 3.26Å; E1495-L1497 VanDerWaalsContact C-N 3.34Å; L1497-L1500 PolarHBondContact O-N 3.12Å; L1497-I1501 HydrophobicContact CD1-CD1 3.85Å; L1497-I1501 HydrophobicContact CD1-CG1 4.39Å; L1497-I1501 HydrophobicContact CG-CD1 4.13Å; L1497-I1501 WeakPolarHBondContact O-CG1 3.43Å; L1497-I1501 PolarHBondContact O-N 3.06Å; L1497-L1533 HydrophobicContact CD1-CB 4.05Å; L1497-L1533 HydrophobicContact CD1-CD2 3.66Å; L1497-L1533 HydrophobicContact CD1-CG 4.36Å; L1497-L1533 WeakPolarHBondContact CD2-O 3.38Å; L1497-L1547 HydrophobicContact CD2-CB 4.48Å; L1497-L1547 HydrophobicContact CD2-CD1 4.43Å; L1497-I1550 HydrophobicContact CB-CD1 4.17Å; L1497-I1550 HydrophobicContact CD2-CD1 3.86Å; L1497-I1550 HydrophobicContact CG-CD1 3.82Å |
| 1498 | E | 89.5 | Confident | 87.9 | Confident | 94 Ų | 94 | 27.5 Ų | 27.5 | 44% | 0.439 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -62.6 | -50.5 | 175.4 | -175 | 171.3 | -168.9 | 0 | 0 | 110.9 | A1494 E1495 L1500 I1501 N1502 I1550 | A1494-E1498 WeakPolarHBondContact O-CB 3.48Å; A1494-E1498 PolarHBondContact O-N 3.45Å; E1495-E1498 PolarHBondContact O-N 2.73Å; E1498-L1500 VanDerWaalsContact C-N 3.28Å; E1498-L1500 PolarHBondContact O-N 2.99Å; E1498-I1501 PolarHBondContact O-N 3.07Å; E1498-N1502 WeakPolarHBondContact O-CB 3.3Å; E1498-N1502 VanDerWaalsContact O-CG 3.26Å; E1498-N1502 PolarHBondContact O-N 3.02Å; E1498-I1550 HydrophobicContact CB-CD1 3.88Å; E1498-I1550 HydrophobicContact CB-CG1 3.83Å; E1498-I1550 HydrophobicContact CB-CG2 4.36Å; E1498-I1550 HydrophobicContact CG-CG1 4.07Å; E1498-I1550 HydrophobicContact CG-CG2 4.36Å |
| 1499 | A | 90.1 | Very high | 87.8 | Confident | 4 Ų | 4 | 30.5 Ų | 30.5 | 3% | 0.033 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -54.7 | -42.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | K1448 E1449 L1452 A1490 E1495 A1503 | K1448-A1499 HydrophobicContact CB-CB 3.97Å; E1449-A1499 HydrophobicContact CB-CB 4.42Å; L1452-A1499 HydrophobicContact CD1-CB 4.22Å; A1490-A1499 HydrophobicContact CB-CB 4.37Å; E1495-A1499 WeakPolarHBondContact O-CB 3.32Å; E1495-A1499 PolarHBondContact O-N 3.43Å; A1499-A1503 WeakPolarHBondContact O-CB 3.18Å; A1499-A1503 PolarHBondContact O-N 3.03Å |
| 1500 | L | 92 | Very high | 87.8 | Confident | 0 Ų | 0 | 30.3 Ų | 30.3 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -72.3 | -43.2 | -179.3 | -176.2 | 59.3 | 0 | 0 | 0 | 113.1 | L1452 L1466 L1483 L1486 I1487 G1496 L1497 E1498 A1504 L1514 | L1452-L1500 HydrophobicContact CD1-CB 4.08Å; L1452-L1500 HydrophobicContact CD1-CD1 4.03Å; L1466-L1500 HydrophobicContact CD1-CD1 3.9Å; L1483-L1500 HydrophobicContact CD1-CD2 3.85Å; L1486-L1500 HydrophobicContact CD2-CD1 3.57Å; L1486-L1500 HydrophobicContact CD2-CD2 4.27Å; L1486-L1500 HydrophobicContact CG-CD1 4.09Å; L1486-L1500 HydrophobicContact CG-CD2 4.46Å; I1487-L1500 HydrophobicContact CD1-CD2 4.22Å; I1487-L1500 HydrophobicContact CG1-CD2 3.53Å; G1496-L1500 WeakPolarHBondContact O-CB 3.42Å; G1496-L1500 PolarHBondContact O-N 3.27Å; L1497-L1500 PolarHBondContact O-N 3.12Å; E1498-L1500 VanDerWaalsContact C-N 3.28Å; E1498-L1500 PolarHBondContact O-N 2.99Å; L1500-A1504 VanDerWaalsContact O-CB 3.3Å; L1500-A1504 WeakPolarHBondContact O-CB 3.31Å; L1500-A1504 PolarHBondContact O-N 3.17Å; L1500-L1514 HydrophobicContact CD2-CD1 3.87Å; L1500-L1514 HydrophobicContact CD2-CD2 4.16Å; L1500-L1514 HydrophobicContact CG-CD1 4.07Å; L1500-L1514 HydrophobicContact CG-CD2 4.22Å |
| 1501 | I | 90.5 | Very high | 87.9 | Confident | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -68.1 | -40.1 | 178.4 | -70.6 | 172.9 | 0 | 0 | 0 | 110.6 | L1497 E1498 A1504 G1505 G1506 G1510 L1511 L1514 L1547 I1550 L1551 | L1497-I1501 HydrophobicContact CD1-CD1 3.85Å; L1497-I1501 HydrophobicContact CD1-CG1 4.39Å; L1497-I1501 HydrophobicContact CG-CD1 4.13Å; L1497-I1501 WeakPolarHBondContact O-CG1 3.43Å; L1497-I1501 PolarHBondContact O-N 3.06Å; E1498-I1501 PolarHBondContact O-N 3.07Å; I1501-A1504 PolarHBondContact O-N 2.83Å; I1501-G1505 PolarHBondContact O-N 2.73Å; I1501-G1506 WeakPolarHBondContact O-CA 3.41Å; I1501-G1506 PolarHBondContact O-N 2.71Å; I1501-G1510 WeakPolarHBondContact O-CA 3.36Å; I1501-L1511 HydrophobicContact CD1-CD1 4.49Å; I1501-L1514 HydrophobicContact CG1-CD2 3.88Å; I1501-L1547 HydrophobicContact CD1-CD1 3.58Å; I1501-I1550 HydrophobicContact CB-CG2 3.8Å; I1501-I1550 HydrophobicContact CD1-CG2 3.89Å; I1501-I1550 HydrophobicContact CG1-CG2 4.4Å; I1501-I1550 HydrophobicContact CG2-CG2 3.86Å; I1501-L1551 HydrophobicContact CG2-CD2 4.2Å |
| 1502 | N | 89.1 | Confident | 88.1 | Confident | 40 Ų | 40 | 30.1 Ų | 30.1 | 21% | 0.214 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.4 | -47.7 | 175.8 | -68.4 | -7.3 | 0 | 0 | 0 | 111.6 | E1449 E1498 A1504 G1505 G1506 | E1449-N1502 HydrophobicContact CG-CB 3.72Å; E1449-N1502 VanDerWaalsContact OE2-CB 3.24Å; E1449-N1502 WeakPolarHBondContact OE2-CB 3.11Å; E1449-N1502 PolarHBondContact OE2-ND2 2.83Å; E1498-N1502 WeakPolarHBondContact O-CB 3.3Å; E1498-N1502 VanDerWaalsContact O-CG 3.26Å; E1498-N1502 PolarHBondContact O-N 3.02Å; N1502-A1504 PolarHBondContact O-N 3.48Å; N1502-G1505 CarbonylContact O-C 3.4Å; N1502-G1505 PolarHBondContact O-N 3.23Å; N1502-G1506 PolarHBondContact O-N 2.98Å |
| 1503 | A | 90.4 | Very high | 88.3 | Confident | 14 Ų | 14 | 30.4 Ų | 30.4 | 12% | 0.116 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.7 | -26.8 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | L1452 A1453 I1456 A1499 G1505 | L1452-A1503 HydrophobicContact CB-CB 3.5Å; L1452-A1503 VanDerWaalsContact CB-CB 3.5Å; L1452-A1503 HydrophobicContact CD1-CB 4.42Å; A1453-A1503 HydrophobicContact CB-CB 4.07Å; I1456-A1503 HydrophobicContact CD1-CB 3.97Å; A1499-A1503 WeakPolarHBondContact O-CB 3.18Å; A1499-A1503 PolarHBondContact O-N 3.03Å; A1503-G1505 VanDerWaalsContact C-N 3.3Å |
| 1504 | A | 89.5 | Confident | 88.5 | Confident | 5 Ų | 5 | 28.6 Ų | 28.6 | 4% | 0.041 | 15% | 0.153 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | -9.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | L1466 L1500 I1501 N1502 G1510 N1513 | L1466-A1504 HydrophobicContact CD2-CB 3.62Å; L1500-A1504 VanDerWaalsContact O-CB 3.3Å; L1500-A1504 WeakPolarHBondContact O-CB 3.31Å; L1500-A1504 PolarHBondContact O-N 3.17Å; I1501-A1504 PolarHBondContact O-N 2.83Å; N1502-A1504 PolarHBondContact O-N 3.48Å; A1504-G1510 WeakPolarHBondContact CB-O 3.24Å; A1504-N1513 HydrophobicContact CB-CB 4.41Å; A1504-N1513 PolarHBondContact O-ND2 2.72Å |
| 1505 | G | 85.9 | Confident | 88.8 | Confident | 22 Ų | 22 | 27.4 Ų | 27.4 | 23% | 0.227 | 14% | 0.143 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 136.9 | -15.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | I1501 N1502 A1503 R1553 | I1501-G1505 PolarHBondContact O-N 2.73Å; N1502-G1505 CarbonylContact O-C 3.4Å; N1502-G1505 PolarHBondContact O-N 3.23Å; A1503-G1505 VanDerWaalsContact C-N 3.3Å; G1505-R1553 PolarHBondContact O-NH1 3.42Å; G1505-R1553 PolarHBondContact O-NH2 3.28Å |
| 1506 | G | 84.7 | Confident | 89 | Confident | 0 Ų | 0 | 26.1 Ų | 26.1 | 0% | 0 | 14% | 0.137 | C | C | . | . | S | Bend | trans | 72.1 | 162.2 | -176 | 0 | 0 | 0 | 0 | 0 | 114.3 | I1501 N1502 E1509 G1510 | I1501-G1506 WeakPolarHBondContact O-CA 3.41Å; I1501-G1506 PolarHBondContact O-N 2.71Å; N1502-G1506 PolarHBondContact O-N 2.98Å; G1506-E1509 PolarHBondContact O-N 3.5Å; G1506-G1510 PolarHBondContact O-N 2.82Å |
| 1507 | D | 83.3 | Confident | 89 | Confident | 24 Ų | 24 | 26.7 Ų | 26.7 | 13% | 0.128 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | 50.9 | -145.7 | -177.6 | -57.3 | -56.9 | 0 | 0 | 0 | 113.6 | E1509 L1511 L1551 R1553 | D1507-E1509 VanDerWaalsContact C-N 3.29Å; D1507-E1509 PolarHBondContact O-N 3.47Å; D1507-L1511 PolarHBondContact O-N 3.45Å; D1507-L1551 WeakPolarHBondContact O-CD2 3.49Å; D1507-R1553 PolarHBondContact OD1-N 3.13Å; D1507-R1553 WeakPolarHBondContact OD2-CB 3.41Å; D1507-R1553 WeakPolarHBondContact OD2-CD 3.32Å; D1507-R1553 WeakPolarHBondContact OD2-CG 3.38Å; D1507-R1553 IonicContact OD2-CZ 3.76Å; D1507-R1553 IonicContact OD2-NE 2.65Å; D1507-R1553 IonicContact OD2-NH1 3.44Å; D1507-R1553 PolarHBondContact OD2-NH1 3.26Å |
| 1508 | E | 86 | Confident | 89 | Confident | 58 Ų | 58 | 28.4 Ų | 28.4 | 27% | 0.271 | 16% | 0.155 | S | C | . | . | H | α-helix | trans | -52.2 | -38.3 | 168.8 | 44.4 | 170.5 | -101.3 | 0 | 0 | 114 | N1512 N1565 K1568 V1569 | E1508-N1512 WeakPolarHBondContact O-CB 3.35Å; E1508-N1512 PolarHBondContact O-N 3.01Å; E1508-N1565 HydrophobicContact CB-CB 4.29Å; E1508-K1568 IonicContact OE1-NZ 2.68Å; E1508-K1568 PolarHBondContact OE1-NZ 3.3Å; E1508-K1568 WeakPolarHBondContact OE2-CD 3.25Å; E1508-K1568 WeakPolarHBondContact OE2-CE 3.03Å; E1508-K1568 IonicContact OE2-NZ 3.64Å; E1508-K1568 PolarHBondContact OE2-NZ 3.36Å; E1508-V1569 HydrophobicContact CB-CG2 3.58Å; E1508-V1569 WeakPolarHBondContact O-CG2 3.14Å |
| 1509 | E | 86 | Confident | 88.9 | Confident | 115 Ų | 115 | 25.7 Ų | 25.7 | 54% | 0.537 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -70.2 | -47.2 | -176 | -173.4 | 176.5 | 173.8 | 0 | 0 | 111.1 | G1506 D1507 L1511 N1512 N1513 | G1506-E1509 PolarHBondContact O-N 3.5Å; D1507-E1509 VanDerWaalsContact C-N 3.29Å; D1507-E1509 PolarHBondContact O-N 3.47Å; E1509-L1511 PolarHBondContact O-N 2.99Å; E1509-N1512 PolarHBondContact O-N 3.44Å; E1509-N1513 WeakPolarHBondContact O-CB 3.13Å; E1509-N1513 VanDerWaalsContact O-CG 3.29Å; E1509-N1513 PolarHBondContact O-N 3.23Å; E1509-N1513 PolarHBondContact O-ND2 3.41Å |
| 1510 | G | 89.4 | Confident | 88.8 | Confident | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -60.4 | -42.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | I1501 A1504 G1506 L1514 | I1501-G1510 WeakPolarHBondContact O-CA 3.36Å; A1504-G1510 WeakPolarHBondContact CB-O 3.24Å; G1506-G1510 PolarHBondContact O-N 2.82Å; G1510-L1514 VanDerWaalsContact O-CB 3.23Å; G1510-L1514 WeakPolarHBondContact O-CB 3.38Å; G1510-L1514 PolarHBondContact O-N 3.42Å |
| 1511 | L | 90.7 | Very high | 88.4 | Confident | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -67.1 | -41 | 175.5 | -178.9 | 65.6 | 0 | 0 | 0 | 112.5 | I1501 D1507 E1509 L1514 L1515 L1533 L1551 L1566 V1569 | I1501-L1511 HydrophobicContact CD1-CD1 4.49Å; D1507-L1511 PolarHBondContact O-N 3.45Å; E1509-L1511 PolarHBondContact O-N 2.99Å; L1511-L1514 PolarHBondContact O-N 2.74Å; L1511-L1515 HydrophobicContact CD1-CD1 4.3Å; L1511-L1515 HydrophobicContact CD1-CG 4.26Å; L1511-L1515 HydrophobicContact CG-CD1 4Å; L1511-L1515 HydrophobicContact CG-CG 4.4Å; L1511-L1515 WeakPolarHBondContact O-CB 3.35Å; L1511-L1515 WeakPolarHBondContact O-CG 3.49Å; L1511-L1515 PolarHBondContact O-N 2.62Å; L1511-L1533 HydrophobicContact CD1-CD1 3.63Å; L1511-L1551 HydrophobicContact CB-CD2 3.67Å; L1511-L1551 HydrophobicContact CD2-CD1 3.89Å; L1511-L1551 HydrophobicContact CD2-CD2 3.86Å; L1511-L1551 HydrophobicContact CG-CD2 4.28Å; L1511-L1566 HydrophobicContact CD2-CD1 3.46Å; L1511-L1566 VanDerWaalsContact CD2-CD1 3.46Å; L1511-V1569 HydrophobicContact CD2-CB 4.41Å; L1511-V1569 HydrophobicContact CD2-CG1 4.25Å; L1511-V1569 HydrophobicContact CD2-CG2 4.49Å; L1511-V1569 HydrophobicContact CG-CG1 4.24Å |
| 1512 | N | 89.8 | Confident | 88.2 | Confident | 56 Ų | 56 | 36.3 Ų | 36.3 | 30% | 0.299 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -62 | -48.1 | 177.1 | -179.1 | 44.1 | 0 | 0 | 0 | 110.9 | E1508 E1509 L1514 L1515 Q1516 V1569 | E1508-N1512 WeakPolarHBondContact O-CB 3.35Å; E1508-N1512 PolarHBondContact O-N 3.01Å; E1509-N1512 PolarHBondContact O-N 3.44Å; N1512-L1514 VanDerWaalsContact C-N 3.32Å; N1512-L1514 PolarHBondContact O-N 2.85Å; N1512-L1515 PolarHBondContact O-N 3.43Å; N1512-Q1516 PolarHBondContact ND2-NE2 2.88Å; N1512-Q1516 WeakPolarHBondContact O-CB 3.27Å; N1512-Q1516 VanDerWaalsContact O-CG 3.31Å; N1512-Q1516 WeakPolarHBondContact O-CG 3.38Å; N1512-Q1516 PolarHBondContact O-N 3.25Å; N1512-Q1516 PolarHBondContact OD1-NE2 2.87Å; N1512-V1569 HydrophobicContact CB-CG1 3.93Å; N1512-V1569 HydrophobicContact CB-CG2 4.34Å |
| 1513 | N | 90.3 | Very high | 88 | Confident | 26 Ų | 26 | 36.7 Ų | 36.7 | 14% | 0.139 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -58.9 | -42.6 | 174.8 | -72.1 | -20.7 | 0 | 0 | 0 | 111.4 | L1466 A1504 E1509 Q1516 A1517 | L1466-N1513 HydrophobicContact CD2-CB 4.49Å; A1504-N1513 HydrophobicContact CB-CB 4.41Å; A1504-N1513 PolarHBondContact O-ND2 2.72Å; E1509-N1513 WeakPolarHBondContact O-CB 3.13Å; E1509-N1513 VanDerWaalsContact O-CG 3.29Å; E1509-N1513 PolarHBondContact O-N 3.23Å; E1509-N1513 PolarHBondContact O-ND2 3.41Å; N1513-Q1516 PolarHBondContact O-N 2.97Å; N1513-A1517 WeakPolarHBondContact O-CB 3.49Å; N1513-A1517 PolarHBondContact O-N 2.83Å |
| 1514 | L | 92.2 | Very high | 87.7 | Confident | 0 Ų | 0 | 40.5 Ų | 40.5 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.9 | -45.1 | 178.7 | -175.6 | 59.5 | 0 | 0 | 0 | 113 | L1466 L1470 L1483 L1500 I1501 G1510 L1511 N1512 A1517 A1518 L1533 | L1466-L1514 HydrophobicContact CD1-CD1 4.26Å; L1466-L1514 HydrophobicContact CD2-CB 4.16Å; L1466-L1514 HydrophobicContact CD2-CD1 3.98Å; L1466-L1514 HydrophobicContact CG-CD1 4.39Å; L1470-L1514 HydrophobicContact CD1-CD1 4.29Å; L1483-L1514 HydrophobicContact CD1-CD1 3.87Å; L1483-L1514 HydrophobicContact CD1-CG 4.47Å; L1500-L1514 HydrophobicContact CD2-CD1 3.87Å; L1500-L1514 HydrophobicContact CD2-CD2 4.16Å; L1500-L1514 HydrophobicContact CG-CD1 4.07Å; L1500-L1514 HydrophobicContact CG-CD2 4.22Å; I1501-L1514 HydrophobicContact CG1-CD2 3.88Å; G1510-L1514 VanDerWaalsContact O-CB 3.23Å; G1510-L1514 WeakPolarHBondContact O-CB 3.38Å; G1510-L1514 PolarHBondContact O-N 3.42Å; L1511-L1514 PolarHBondContact O-N 2.74Å; N1512-L1514 VanDerWaalsContact C-N 3.32Å; N1512-L1514 PolarHBondContact O-N 2.85Å; L1514-A1517 PolarHBondContact O-N 3.23Å; L1514-A1518 VanDerWaalsContact O-CB 3.26Å; L1514-A1518 WeakPolarHBondContact O-CB 3.42Å; L1514-A1518 PolarHBondContact O-N 3.37Å; L1514-L1533 HydrophobicContact CD2-CD1 4.17Å; L1514-L1533 HydrophobicContact CD2-CD2 3.72Å |
| 1515 | L | 90.8 | Very high | 87.6 | Confident | 4 Ų | 4 | 41.4 Ų | 41.4 | 2% | 0.021 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.8 | -47.7 | 174.9 | -74.4 | 167.8 | 0 | 0 | 0 | 111.2 | L1511 N1512 A1517 A1518 G1519 A1520 I1529 L1530 V1569 L1570 | L1511-L1515 HydrophobicContact CD1-CD1 4.3Å; L1511-L1515 HydrophobicContact CD1-CG 4.26Å; L1511-L1515 HydrophobicContact CG-CD1 4Å; L1511-L1515 HydrophobicContact CG-CG 4.4Å; L1511-L1515 WeakPolarHBondContact O-CB 3.35Å; L1511-L1515 WeakPolarHBondContact O-CG 3.49Å; L1511-L1515 PolarHBondContact O-N 2.62Å; N1512-L1515 PolarHBondContact O-N 3.43Å; L1515-A1517 VanDerWaalsContact C-N 3.35Å; L1515-A1517 PolarHBondContact O-N 3.03Å; L1515-A1518 PolarHBondContact O-N 3.48Å; L1515-G1519 PolarHBondContact O-N 3.26Å; L1515-A1520 HydrophobicContact CB-CB 3.97Å; L1515-A1520 HydrophobicContact CD2-CB 4.36Å; L1515-A1520 WeakPolarHBondContact O-CB 3.34Å; L1515-A1520 PolarHBondContact O-N 3.32Å; L1515-I1529 HydrophobicContact CD2-CB 4.08Å; L1515-I1529 HydrophobicContact CD2-CG2 3.72Å; L1515-L1530 HydrophobicContact CD2-CG 4.34Å; L1515-V1569 HydrophobicContact CD1-CG1 3.66Å; L1515-L1570 HydrophobicContact CD1-CD2 4.04Å |
| 1516 | Q | 89 | Confident | 87.8 | Confident | 86 Ų | 86 | 42.9 Ų | 42.9 | 40% | 0.402 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -69 | -31.4 | 180 | -67.4 | -171.2 | 42 | 0 | 0 | 113 | Q1463 N1512 N1513 | Q1463-Q1516 HydrophobicContact CG-CB 3.95Å; Q1463-Q1516 PolarHBondContact NE2-O 3.48Å; Q1463-Q1516 VanDerWaalsContact NE2-O 3.08Å; N1512-Q1516 PolarHBondContact ND2-NE2 2.88Å; N1512-Q1516 WeakPolarHBondContact O-CB 3.27Å; N1512-Q1516 VanDerWaalsContact O-CG 3.31Å; N1512-Q1516 WeakPolarHBondContact O-CG 3.38Å; N1512-Q1516 PolarHBondContact O-N 3.25Å; N1512-Q1516 PolarHBondContact OD1-NE2 2.87Å; N1513-Q1516 PolarHBondContact O-N 2.97Å |
| 1517 | A | 90.6 | Very high | 87.9 | Confident | 12 Ų | 12 | 42.9 Ų | 42.9 | 10% | 0.099 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -74.2 | -35.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q1463 L1466 A1467 L1470 N1513 L1514 L1515 G1519 | Q1463-A1517 HydrophobicContact CG-CB 4.14Å; L1466-A1517 HydrophobicContact CB-CB 3.91Å; L1466-A1517 HydrophobicContact CD2-CB 3.9Å; L1466-A1517 HydrophobicContact CG-CB 3.62Å; A1467-A1517 HydrophobicContact CB-CB 3.99Å; L1470-A1517 HydrophobicContact CD1-CB 3.87Å; N1513-A1517 WeakPolarHBondContact O-CB 3.49Å; N1513-A1517 PolarHBondContact O-N 2.83Å; L1514-A1517 PolarHBondContact O-N 3.23Å; L1515-A1517 VanDerWaalsContact C-N 3.35Å; L1515-A1517 PolarHBondContact O-N 3.03Å; A1517-G1519 PolarHBondContact O-N 3.15Å |
| 1518 | A | 89.6 | Confident | 88.2 | Confident | 36 Ų | 36 | 45.9 Ų | 45.9 | 30% | 0.298 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.2 | 1.5 | 174 | 0 | 0 | 0 | 0 | 0 | 113.9 | L1470 L1514 L1515 I1529 | L1470-A1518 HydrophobicContact CD1-CB 4.15Å; L1514-A1518 VanDerWaalsContact O-CB 3.26Å; L1514-A1518 WeakPolarHBondContact O-CB 3.42Å; L1514-A1518 PolarHBondContact O-N 3.37Å; L1515-A1518 PolarHBondContact O-N 3.48Å; A1518-I1529 HydrophobicContact CB-CD1 3.81Å; A1518-I1529 HydrophobicContact CB-CG1 4.18Å; A1518-I1529 HydrophobicContact CB-CG2 4.02Å; A1518-I1529 WeakPolarHBondContact O-CD1 3.44Å |
| 1519 | G | 87.1 | Confident | 88.4 | Confident | 38 Ų | 38 | 44 Ų | 44 | 39% | 0.392 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 86.7 | 26.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | L1515 A1517 T1521 | L1515-G1519 PolarHBondContact O-N 3.26Å; A1517-G1519 PolarHBondContact O-N 3.15Å; G1519-T1521 VanDerWaalsContact C-N 3.28Å; G1519-T1521 PolarHBondContact O-N 3.26Å; G1519-T1521 PolarHBondContact O-OG1 2.9Å |
| 1520 | A | 87.3 | Confident | 88.6 | Confident | 16 Ų | 16 | 38.5 Ų | 38.5 | 13% | 0.132 | 23% | 0.229 | C | C | . | . | trans | -66.5 | 79.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L1515 K1526 I1529 | L1515-A1520 HydrophobicContact CB-CB 3.97Å; L1515-A1520 HydrophobicContact CD2-CB 4.36Å; L1515-A1520 WeakPolarHBondContact O-CB 3.34Å; L1515-A1520 PolarHBondContact O-N 3.32Å; A1520-K1526 HydrophobicContact CB-CG 3.78Å; A1520-I1529 HydrophobicContact CB-CD1 3.71Å | ||
| 1521 | T | 83.7 | Confident | 88.7 | Confident | 131 Ų | 131 | 42.4 Ų | 42.4 | 80% | 0.804 | 25% | 0.246 | S | C | * | . | trans | -92 | -18 | -173.8 | 44.4 | 0 | 0 | 0 | 0 | 113.8 | G1519 S1525 | G1519-T1521 VanDerWaalsContact C-N 3.28Å; G1519-T1521 PolarHBondContact O-N 3.26Å; G1519-T1521 PolarHBondContact O-OG1 2.9Å; T1521-S1525 PolarHBondContact N-OG 3.49Å | ||
| 1522 | D | 87.5 | Confident | 88.5 | Confident | 80 Ų | 80 | 44.2 Ų | 44.2 | 43% | 0.428 | 26% | 0.257 | S | S | . | . | S | Bend | trans | -145.8 | 178.6 | 179.2 | 72.1 | -0 | 0 | 0 | 0 | 111.8 | N1524 S1525 K1526 | D1522-N1524 VanDerWaalsContact C-N 3.3Å; D1522-N1524 PolarHBondContact O-N 3.17Å; D1522-N1524 PolarHBondContact OD1-N 2.89Å; D1522-S1525 PolarHBondContact N-OG 3.39Å; D1522-S1525 PolarHBondContact O-OG 2.94Å; D1522-S1525 VanDerWaalsContact O-OG 3.04Å; D1522-S1525 VanDerWaalsContact OD1-CB 3.3Å; D1522-S1525 WeakPolarHBondContact OD1-CB 3.3Å; D1522-S1525 PolarHBondContact OD1-N 3.46Å; D1522-S1525 PolarHBondContact OD1-OG 2.95Å; D1522-K1526 WeakPolarHBondContact O-CB 3.38Å; D1522-K1526 WeakPolarHBondContact O-CG 3.35Å; D1522-K1526 PolarHBondContact O-N 2.86Å |
| 1523 | S | 83.7 | Confident | 88.6 | Confident | 48 Ų | 48 | 41.5 Ų | 41.5 | 34% | 0.336 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.2 | -36.2 | 179.7 | -56.1 | 0 | 0 | 0 | 0 | 112.9 | A1527 | S1523-A1527 WeakPolarHBondContact O-CB 3.37Å; S1523-A1527 PolarHBondContact O-N 3.47Å |
| 1524 | N | 84.9 | Confident | 88.6 | Confident | 94 Ų | 94 | 40.4 Ų | 40.4 | 50% | 0.503 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -71.6 | -42.3 | -177 | -61 | -9.1 | 0 | 0 | 0 | 111.3 | D1522 A1527 N1528 | D1522-N1524 VanDerWaalsContact C-N 3.3Å; D1522-N1524 PolarHBondContact O-N 3.17Å; D1522-N1524 PolarHBondContact OD1-N 2.89Å; N1524-A1527 PolarHBondContact O-N 3.06Å; N1524-N1528 WeakPolarHBondContact O-CB 3.4Å; N1524-N1528 PolarHBondContact O-N 3.42Å; N1524-N1528 PolarHBondContact O-ND2 3.37Å |
| 1525 | S | 87.9 | Confident | 88.3 | Confident | 24 Ų | 24 | 44.9 Ų | 44.9 | 17% | 0.168 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -67.8 | -41.1 | 174.1 | 51 | 0 | 0 | 0 | 0 | 111.4 | T1521 D1522 A1527 N1528 I1529 | T1521-S1525 PolarHBondContact N-OG 3.49Å; D1522-S1525 PolarHBondContact N-OG 3.39Å; D1522-S1525 PolarHBondContact O-OG 2.94Å; D1522-S1525 VanDerWaalsContact O-OG 3.04Å; D1522-S1525 VanDerWaalsContact OD1-CB 3.3Å; D1522-S1525 WeakPolarHBondContact OD1-CB 3.3Å; D1522-S1525 PolarHBondContact OD1-N 3.46Å; D1522-S1525 PolarHBondContact OD1-OG 2.95Å; S1525-A1527 VanDerWaalsContact C-N 3.33Å; S1525-A1527 PolarHBondContact O-N 3.48Å; S1525-N1528 PolarHBondContact O-N 3.02Å; S1525-I1529 WeakPolarHBondContact O-CB 3.47Å; S1525-I1529 WeakPolarHBondContact O-CD1 3.29Å; S1525-I1529 VanDerWaalsContact O-CG1 3.27Å; S1525-I1529 WeakPolarHBondContact O-CG1 3.14Å; S1525-I1529 PolarHBondContact O-N 2.87Å |
| 1526 | K | 89.1 | Confident | 88 | Confident | 53 Ų | 53 | 46 Ų | 46 | 23% | 0.23 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -53.8 | -47.5 | 168.3 | -78.5 | -178.1 | 173.5 | -170.8 | 0 | 111.9 | A1520 D1522 L1530 L1570 I1579 | A1520-K1526 HydrophobicContact CB-CG 3.78Å; D1522-K1526 WeakPolarHBondContact O-CB 3.38Å; D1522-K1526 WeakPolarHBondContact O-CG 3.35Å; D1522-K1526 PolarHBondContact O-N 2.86Å; K1526-L1530 WeakPolarHBondContact O-CB 3.37Å; K1526-L1530 VanDerWaalsContact O-CG 3.3Å; K1526-L1530 WeakPolarHBondContact O-CG 3.44Å; K1526-L1530 PolarHBondContact O-N 3.13Å; K1526-L1570 HydrophobicContact CD-CD2 4.17Å; K1526-L1570 PolarHBondContact NZ-O 3.4Å; K1526-I1579 HydrophobicContact CB-CD1 4.13Å; K1526-I1579 HydrophobicContact CB-CG2 3.94Å; K1526-I1579 HydrophobicContact CD-CD1 3.94Å |
| 1527 | A | 87.7 | Confident | 87.7 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.1 | -44.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S1523 N1524 S1525 K1531 I1579 E1582 A1583 | S1523-A1527 WeakPolarHBondContact O-CB 3.37Å; S1523-A1527 PolarHBondContact O-N 3.47Å; N1524-A1527 PolarHBondContact O-N 3.06Å; S1525-A1527 VanDerWaalsContact C-N 3.33Å; S1525-A1527 PolarHBondContact O-N 3.48Å; A1527-K1531 WeakPolarHBondContact O-CB 3.44Å; A1527-K1531 PolarHBondContact O-N 3.44Å; A1527-I1579 HydrophobicContact CB-CG2 4.18Å; A1527-E1582 HydrophobicContact CB-CB 4.19Å; A1527-E1582 HydrophobicContact CB-CG 4.14Å; A1527-A1583 WeakPolarHBondContact O-CB 3.32Å |
| 1528 | N | 88 | Confident | 87.4 | Confident | 86 Ų | 86 | 44 Ų | 44 | 46% | 0.46 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -66.3 | -41.3 | 178.3 | -74.6 | -50.9 | 0 | 0 | 0 | 112.6 | N1524 S1525 K1531 T1532 | N1524-N1528 WeakPolarHBondContact O-CB 3.4Å; N1524-N1528 PolarHBondContact O-N 3.42Å; N1524-N1528 PolarHBondContact O-ND2 3.37Å; S1525-N1528 PolarHBondContact O-N 3.02Å; N1528-K1531 WeakPolarHBondContact O-CB 3.18Å; N1528-K1531 PolarHBondContact O-N 2.98Å; N1528-T1532 PolarHBondContact O-N 3.33Å; N1528-T1532 PolarHBondContact O-OG1 3.34Å |
| 1529 | I | 90.7 | Very high | 87 | Confident | 18 Ų | 18 | 43.2 Ų | 43.2 | 9% | 0.092 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -66.7 | -45.6 | 177.4 | -66.6 | 158.8 | 0 | 0 | 0 | 110.2 | L1483 L1515 A1518 A1520 S1525 K1531 T1532 L1533 | L1483-I1529 HydrophobicContact CD2-CG2 3.84Å; L1515-I1529 HydrophobicContact CD2-CB 4.08Å; L1515-I1529 HydrophobicContact CD2-CG2 3.72Å; A1518-I1529 HydrophobicContact CB-CD1 3.81Å; A1518-I1529 HydrophobicContact CB-CG1 4.18Å; A1518-I1529 HydrophobicContact CB-CG2 4.02Å; A1518-I1529 WeakPolarHBondContact O-CD1 3.44Å; A1520-I1529 HydrophobicContact CB-CD1 3.71Å; S1525-I1529 WeakPolarHBondContact O-CB 3.47Å; S1525-I1529 WeakPolarHBondContact O-CD1 3.29Å; S1525-I1529 VanDerWaalsContact O-CG1 3.27Å; S1525-I1529 WeakPolarHBondContact O-CG1 3.14Å; S1525-I1529 PolarHBondContact O-N 2.87Å; I1529-K1531 PolarHBondContact O-N 3.35Å; I1529-T1532 PolarHBondContact O-N 3.26Å; I1529-T1532 VanDerWaalsContact O-N 3.12Å; I1529-L1533 WeakPolarHBondContact O-CG 3.45Å; I1529-L1533 PolarHBondContact O-N 3.46Å |
| 1530 | L | 91.1 | Very high | 86.8 | Confident | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.005 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -56.5 | -39.3 | 172.6 | -77.2 | 170 | 0 | 0 | 0 | 112.4 | L1515 K1526 L1533 I1534 L1547 L1566 L1570 I1579 L1580 A1583 | L1515-L1530 HydrophobicContact CD2-CG 4.34Å; K1526-L1530 WeakPolarHBondContact O-CB 3.37Å; K1526-L1530 VanDerWaalsContact O-CG 3.3Å; K1526-L1530 WeakPolarHBondContact O-CG 3.44Å; K1526-L1530 PolarHBondContact O-N 3.13Å; L1530-L1533 PolarHBondContact O-N 3.49Å; L1530-I1534 HydrophobicContact CB-CD1 4.5Å; L1530-I1534 WeakPolarHBondContact O-CB 3.23Å; L1530-I1534 WeakPolarHBondContact O-CD1 3.27Å; L1530-I1534 VanDerWaalsContact O-CG1 3.22Å; L1530-I1534 WeakPolarHBondContact O-CG1 3.42Å; L1530-I1534 PolarHBondContact O-N 3.46Å; L1530-L1547 HydrophobicContact CD2-CD2 4.29Å; L1530-L1566 HydrophobicContact CD2-CD1 3.98Å; L1530-L1570 HydrophobicContact CD1-CD1 3.79Å; L1530-L1570 HydrophobicContact CD1-CD2 3.9Å; L1530-L1570 HydrophobicContact CD1-CG 4.47Å; L1530-I1579 HydrophobicContact CD1-CG2 3.63Å; L1530-L1580 HydrophobicContact CD1-CD2 4.38Å; L1530-A1583 HydrophobicContact CB-CB 3.69Å; L1530-A1583 HydrophobicContact CD1-CB 4.47Å |
| 1531 | K | 90.4 | Very high | 86.6 | Confident | 82 Ų | 82 | 46.1 Ų | 46.1 | 36% | 0.357 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.8 | -42.5 | 176.2 | -170.4 | 165.5 | -174.9 | 167.2 | 0 | 112 | A1527 N1528 I1529 I1534 N1535 A1583 | A1527-K1531 WeakPolarHBondContact O-CB 3.44Å; A1527-K1531 PolarHBondContact O-N 3.44Å; N1528-K1531 WeakPolarHBondContact O-CB 3.18Å; N1528-K1531 PolarHBondContact O-N 2.98Å; I1529-K1531 PolarHBondContact O-N 3.35Å; K1531-I1534 PolarHBondContact O-N 2.85Å; K1531-N1535 VanDerWaalsContact O-CB 3.3Å; K1531-N1535 WeakPolarHBondContact O-CB 3.34Å; K1531-N1535 PolarHBondContact O-N 3.24Å; K1531-N1535 PolarHBondContact O-ND2 3.15Å; K1531-A1583 HydrophobicContact CB-CB 4.41Å; K1531-A1583 WeakPolarHBondContact CG-O 3.42Å |
| 1532 | T | 87.8 | Confident | 86.6 | Confident | 37 Ų | 37 | 46.4 Ų | 46.4 | 23% | 0.227 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.9 | -44.9 | 172.1 | -61.4 | 0 | 0 | 0 | 0 | 111.4 | L1483 N1528 I1529 I1534 N1535 A1536 | L1483-T1532 HydrophobicContact CD2-CG2 3.91Å; L1483-T1532 HydrophobicContact CG-CG2 4.13Å; N1528-T1532 PolarHBondContact O-N 3.33Å; N1528-T1532 PolarHBondContact O-OG1 3.34Å; I1529-T1532 PolarHBondContact O-N 3.26Å; I1529-T1532 VanDerWaalsContact O-N 3.12Å; T1532-I1534 PolarHBondContact O-N 3.25Å; T1532-N1535 PolarHBondContact O-N 3.3Å; T1532-A1536 WeakPolarHBondContact O-CB 3.33Å; T1532-A1536 PolarHBondContact O-N 3.38Å |
| 1533 | L | 91.2 | Very high | 86.6 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.4 | -44.6 | 176.2 | -60.4 | 178.5 | 0 | 0 | 0 | 112.4 | L1483 I1487 L1497 L1511 L1514 I1529 L1530 A1536 G1537 | L1483-L1533 HydrophobicContact CD1-CD2 3.99Å; L1483-L1533 HydrophobicContact CD2-CD2 3.91Å; L1483-L1533 HydrophobicContact CD2-CG 4.43Å; L1483-L1533 HydrophobicContact CG-CD2 4.27Å; I1487-L1533 HydrophobicContact CD1-CD2 3.94Å; L1497-L1533 HydrophobicContact CD1-CB 4.05Å; L1497-L1533 HydrophobicContact CD1-CD2 3.66Å; L1497-L1533 HydrophobicContact CD1-CG 4.36Å; L1497-L1533 WeakPolarHBondContact CD2-O 3.38Å; L1511-L1533 HydrophobicContact CD1-CD1 3.63Å; L1514-L1533 HydrophobicContact CD2-CD1 4.17Å; L1514-L1533 HydrophobicContact CD2-CD2 3.72Å; I1529-L1533 WeakPolarHBondContact O-CG 3.45Å; I1529-L1533 PolarHBondContact O-N 3.46Å; L1530-L1533 PolarHBondContact O-N 3.49Å; L1533-A1536 PolarHBondContact O-N 2.97Å; L1533-G1537 PolarHBondContact O-N 3.47Å |
| 1534 | I | 89.4 | Confident | 86.9 | Confident | 2 Ų | 2 | 40.3 Ų | 40.3 | 1% | 0.01 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.7 | -45.6 | 177.8 | -72.1 | 159.6 | 0 | 0 | 0 | 110.7 | L1530 K1531 T1532 G1537 G1538 G1539 G1543 F1544 L1547 A1583 I1584 | L1530-I1534 HydrophobicContact CB-CD1 4.5Å; L1530-I1534 WeakPolarHBondContact O-CB 3.23Å; L1530-I1534 WeakPolarHBondContact O-CD1 3.27Å; L1530-I1534 VanDerWaalsContact O-CG1 3.22Å; L1530-I1534 WeakPolarHBondContact O-CG1 3.42Å; L1530-I1534 PolarHBondContact O-N 3.46Å; K1531-I1534 PolarHBondContact O-N 2.85Å; T1532-I1534 PolarHBondContact O-N 3.25Å; I1534-G1537 PolarHBondContact O-N 3.15Å; I1534-G1538 PolarHBondContact O-N 3.3Å; I1534-G1539 WeakPolarHBondContact O-CA 3.37Å; I1534-G1539 PolarHBondContact O-N 2.97Å; I1534-G1543 WeakPolarHBondContact O-CA 3.28Å; I1534-F1544 HydrophobicContact CD1-CD2 3.83Å; I1534-F1544 HydrophobicContact CG1-CB 4.39Å; I1534-F1544 HydrophobicContact CG1-CD2 4Å; I1534-F1544 HydrophobicContact CG2-CB 4.37Å; I1534-L1547 HydrophobicContact CG1-CD2 4.06Å; I1534-A1583 HydrophobicContact CD1-CB 3.93Å; I1534-I1584 HydrophobicContact CD1-CG1 3.67Å |
| 1535 | N | 87.8 | Confident | 87 | Confident | 94 Ų | 94 | 37.7 Ų | 37.7 | 50% | 0.503 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.7 | -45.4 | 176.6 | -71.9 | -20.9 | 0 | 0 | 0 | 111.4 | K1531 T1532 G1537 G1538 G1539 | K1531-N1535 VanDerWaalsContact O-CB 3.3Å; K1531-N1535 WeakPolarHBondContact O-CB 3.34Å; K1531-N1535 PolarHBondContact O-N 3.24Å; K1531-N1535 PolarHBondContact O-ND2 3.15Å; T1532-N1535 PolarHBondContact O-N 3.3Å; N1535-G1537 VanDerWaalsContact C-N 3.3Å; N1535-G1537 PolarHBondContact O-N 3.15Å; N1535-G1538 PolarHBondContact O-N 2.84Å; N1535-G1538 VanDerWaalsContact O-N 3.07Å; N1535-G1539 PolarHBondContact O-N 3.4Å |
| 1536 | A | 84.2 | Confident | 87 | Confident | 27 Ų | 27 | 37.6 Ų | 37.6 | 22% | 0.223 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.8 | -37.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | I1487 G1493 T1532 L1533 G1538 | I1487-A1536 HydrophobicContact CD1-CB 3.85Å; I1487-A1536 HydrophobicContact CG2-CB 3.97Å; G1493-A1536 CarbonylContact C-O 3.56Å; G1493-A1536 WeakPolarHBondContact CA-O 3.45Å; T1532-A1536 WeakPolarHBondContact O-CB 3.33Å; T1532-A1536 PolarHBondContact O-N 3.38Å; L1533-A1536 PolarHBondContact O-N 2.97Å; A1536-G1538 PolarHBondContact O-N 3.27Å |
| 1537 | G | 82.9 | Confident | 87.1 | Confident | 2 Ų | 2 | 35.1 Ų | 35.1 | 2% | 0.021 | 21% | 0.206 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.8 | -5.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | L1533 I1534 N1535 G1543 N1546 | L1533-G1537 PolarHBondContact O-N 3.47Å; I1534-G1537 PolarHBondContact O-N 3.15Å; N1535-G1537 VanDerWaalsContact C-N 3.3Å; N1535-G1537 PolarHBondContact O-N 3.15Å; G1537-G1543 WeakPolarHBondContact O-CA 3.5Å; G1537-N1546 PolarHBondContact O-ND2 3.04Å |
| 1538 | G | 83 | Confident | 87.2 | Confident | 55 Ų | 55 | 35.1 Ų | 35.1 | 57% | 0.567 | 21% | 0.206 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 130.2 | -11.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | I1534 N1535 A1536 | I1534-G1538 PolarHBondContact O-N 3.3Å; N1535-G1538 PolarHBondContact O-N 2.84Å; N1535-G1538 VanDerWaalsContact O-N 3.07Å; A1536-G1538 PolarHBondContact O-N 3.27Å |
| 1539 | G | 82.4 | Confident | 87.2 | Confident | 20 Ų | 20 | 34.8 Ų | 34.8 | 21% | 0.206 | 20% | 0.201 | C | C | . | . | S | Bend | trans | 80.1 | 154.9 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | I1534 N1535 E1542 G1543 | I1534-G1539 WeakPolarHBondContact O-CA 3.37Å; I1534-G1539 PolarHBondContact O-N 2.97Å; N1535-G1539 PolarHBondContact O-N 3.4Å; G1539-E1542 PolarHBondContact O-N 2.85Å; G1539-G1543 PolarHBondContact O-N 3.49Å |
| 1540 | G | 82.6 | Confident | 87 | Confident | 27 Ų | 27 | 34.6 Ų | 34.6 | 28% | 0.278 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | 51.8 | -142.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | E1542 F1544 | G1540-E1542 VanDerWaalsContact C-N 3.3Å; G1540-E1542 PolarHBondContact O-N 3.4Å; G1540-F1544 WeakPolarHBondContact O-CB 3.26Å; G1540-F1544 PolarHBondContact O-N 3.02Å |
| 1541 | Q | 82.5 | Confident | 86.9 | Confident | 87 Ų | 87 | 34.6 Ų | 34.6 | 41% | 0.407 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -55.5 | -39.1 | 177.9 | -163.6 | -159.4 | -15.1 | 0 | 0 | 113.6 | N1545 D1593 A1596 A1597 | Q1541-N1545 WeakPolarHBondContact O-CB 3.47Å; Q1541-N1545 PolarHBondContact O-N 2.86Å; Q1541-D1593 HydrophobicContact CB-CB 4.19Å; Q1541-D1593 HydrophobicContact CG-CB 4.35Å; Q1541-A1596 HydrophobicContact CG-CB 4.46Å; Q1541-A1596 VanDerWaalsContact NE2-CB 3.31Å; Q1541-A1597 HydrophobicContact CG-CB 4.09Å |
| 1542 | E | 83.7 | Confident | 86.6 | Confident | 137 Ų | 137 | 31.6 Ų | 31.6 | 64% | 0.64 | 19% | 0.188 | S | C | * | . | H | α-helix | trans | -73.4 | -48.2 | -176.3 | -178.2 | 162.8 | -168.8 | 0 | 0 | 111.6 | G1539 G1540 F1544 N1545 N1546 | G1539-E1542 PolarHBondContact O-N 2.85Å; G1540-E1542 VanDerWaalsContact C-N 3.3Å; G1540-E1542 PolarHBondContact O-N 3.4Å; E1542-F1544 VanDerWaalsContact C-N 3.3Å; E1542-F1544 PolarHBondContact O-N 3.49Å; E1542-N1545 PolarHBondContact O-N 3.33Å; E1542-N1546 VanDerWaalsContact O-CG 3.28Å; E1542-N1546 PolarHBondContact O-N 3.43Å; E1542-N1546 PolarHBondContact O-ND2 3.46Å |
| 1543 | G | 87.7 | Confident | 85.4 | Confident | 0 Ų | 0 | 38 Ų | 38 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.4 | -39.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | I1534 G1537 G1539 N1546 L1547 | I1534-G1543 WeakPolarHBondContact O-CA 3.28Å; G1537-G1543 WeakPolarHBondContact O-CA 3.5Å; G1539-G1543 PolarHBondContact O-N 3.49Å; G1543-N1546 PolarHBondContact O-N 3.45Å; G1543-L1547 PolarHBondContact O-N 3.47Å |
| 1544 | F | 90 | Very high | 83.9 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -67.9 | -42.9 | 173.8 | -171 | -120.8 | 0 | 0 | 0 | 111.9 | I1534 G1540 E1542 N1546 L1547 L1548 L1563 L1566 L1580 I1584 I1594 A1597 | I1534-F1544 HydrophobicContact CD1-CD2 3.83Å; I1534-F1544 HydrophobicContact CG1-CB 4.39Å; I1534-F1544 HydrophobicContact CG1-CD2 4Å; I1534-F1544 HydrophobicContact CG2-CB 4.37Å; G1540-F1544 WeakPolarHBondContact O-CB 3.26Å; G1540-F1544 PolarHBondContact O-N 3.02Å; E1542-F1544 VanDerWaalsContact C-N 3.3Å; E1542-F1544 PolarHBondContact O-N 3.49Å; F1544-N1546 VanDerWaalsContact C-N 3.27Å; F1544-N1546 PolarHBondContact O-N 3.22Å; F1544-L1547 HydrophobicContact CD2-CD2 4.47Å; F1544-L1547 PolarHBondContact O-N 3.35Å; F1544-L1548 HydrophobicContact CD1-CD1 4.08Å; F1544-L1548 HydrophobicContact CD1-CG 4.36Å; F1544-L1548 HydrophobicContact CE1-CD1 3.66Å; F1544-L1548 HydrophobicContact CE1-CD2 4.29Å; F1544-L1548 HydrophobicContact CE1-CG 4.06Å; F1544-L1548 HydrophobicContact CE2-CD2 4.12Å; F1544-L1548 HydrophobicContact CE2-CG 4.34Å; F1544-L1548 HydrophobicContact CZ-CD1 4.07Å; F1544-L1548 HydrophobicContact CZ-CD2 3.83Å; F1544-L1548 HydrophobicContact CZ-CG 4.06Å; F1544-L1548 WeakPolarHBondContact O-CG 3.3Å; F1544-L1548 PolarHBondContact O-N 2.92Å; F1544-L1563 HydrophobicContact CZ-CD1 4.37Å; F1544-L1566 HydrophobicContact CE2-CD2 3.47Å; F1544-L1566 VanDerWaalsContact CE2-CD2 3.47Å; F1544-L1566 HydrophobicContact CZ-CD2 3.75Å; F1544-L1580 HydrophobicContact CE2-CD2 4.37Å; F1544-L1580 HydrophobicContact CZ-CD2 4.49Å; F1544-I1584 HydrophobicContact CB-CD1 4.32Å; F1544-I1584 HydrophobicContact CB-CG1 4.37Å; F1544-I1584 HydrophobicContact CD1-CD1 3.6Å; F1544-I1584 HydrophobicContact CD2-CD1 3.64Å; F1544-I1584 HydrophobicContact CD2-CG1 4.09Å; F1544-I1584 HydrophobicContact CE1-CD1 3.73Å; F1544-I1584 HydrophobicContact CE2-CD1 3.74Å; F1544-I1584 HydrophobicContact CG-CD1 3.57Å; F1544-I1584 HydrophobicContact CG-CG1 4.07Å; F1544-I1584 HydrophobicContact CZ-CD1 3.79Å; F1544-I1594 HydrophobicContact CD1-CG1 4.46Å; F1544-I1594 HydrophobicContact CE1-CB 4.11Å; F1544-I1594 HydrophobicContact CE1-CG1 3.9Å; F1544-I1594 HydrophobicContact CE1-CG2 4.07Å; F1544-I1594 HydrophobicContact CZ-CG1 4.35Å; F1544-A1597 HydrophobicContact CD1-CB 3.59Å; F1544-A1597 HydrophobicContact CE1-CB 4.29Å; F1544-A1597 HydrophobicContact CG-CB 4.48Å |
| 1545 | N | 87.7 | Confident | 82.1 | Confident | 39 Ų | 39 | 49.8 Ų | 49.8 | 21% | 0.209 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61.6 | -33.1 | 174.7 | 178.4 | -110.2 | 0 | 0 | 0 | 112.8 | Q1541 E1542 K1549 P1559 A1597 | Q1541-N1545 WeakPolarHBondContact O-CB 3.47Å; Q1541-N1545 PolarHBondContact O-N 2.86Å; E1542-N1545 PolarHBondContact O-N 3.33Å; N1545-K1549 WeakPolarHBondContact O-CG 3.26Å; N1545-K1549 PolarHBondContact O-N 2.98Å; N1545-K1549 WeakPolarHBondContact OD1-CE 3.27Å; N1545-K1549 PolarHBondContact OD1-NZ 3.49Å; N1545-P1559 WeakPolarHBondContact ND2-CG 3.36Å; N1545-A1597 HydrophobicContact CB-CB 3.92Å; N1545-A1597 PolarHBondContact ND2-O 2.99Å |
| 1546 | N | 88.2 | Confident | 80.7 | Confident | 23 Ų | 23 | 51.5 Ų | 51.5 | 12% | 0.123 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -70.8 | -46.9 | 174.7 | -69.5 | -23.7 | 0 | 0 | 0 | 111.4 | A1494 G1537 E1542 G1543 F1544 L1548 K1549 I1550 | A1494-N1546 HydrophobicContact CB-CB 4.04Å; G1537-N1546 PolarHBondContact O-ND2 3.04Å; E1542-N1546 VanDerWaalsContact O-CG 3.28Å; E1542-N1546 PolarHBondContact O-N 3.43Å; E1542-N1546 PolarHBondContact O-ND2 3.46Å; G1543-N1546 PolarHBondContact O-N 3.45Å; F1544-N1546 VanDerWaalsContact C-N 3.27Å; F1544-N1546 PolarHBondContact O-N 3.22Å; N1546-L1548 VanDerWaalsContact C-N 3.29Å; N1546-L1548 PolarHBondContact O-N 3.48Å; N1546-K1549 PolarHBondContact O-N 3.47Å; N1546-K1549 PolarHBondContact OD1-NZ 2.66Å; N1546-I1550 WeakPolarHBondContact O-CG1 3.42Å; N1546-I1550 PolarHBondContact O-N 3.41Å; N1546-I1550 VanDerWaalsContact O-N 3.14Å |
| 1547 | L | 90.4 | Very high | 80 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -53.9 | -45.1 | 171 | 179.1 | 61.1 | 0 | 0 | 0 | 111.5 | L1497 I1501 L1530 I1534 G1543 F1544 K1549 I1550 L1551 | L1497-L1547 HydrophobicContact CD2-CB 4.48Å; L1497-L1547 HydrophobicContact CD2-CD1 4.43Å; I1501-L1547 HydrophobicContact CD1-CD1 3.58Å; L1530-L1547 HydrophobicContact CD2-CD2 4.29Å; I1534-L1547 HydrophobicContact CG1-CD2 4.06Å; G1543-L1547 PolarHBondContact O-N 3.47Å; F1544-L1547 HydrophobicContact CD2-CD2 4.47Å; F1544-L1547 PolarHBondContact O-N 3.35Å; L1547-K1549 VanDerWaalsContact C-N 3.28Å; L1547-K1549 PolarHBondContact O-N 3.25Å; L1547-I1550 PolarHBondContact O-N 3.4Å; L1547-L1551 HydrophobicContact CD1-CD1 4.17Å; L1547-L1551 HydrophobicContact CD1-CG 4.3Å; L1547-L1551 HydrophobicContact CG-CD1 4.13Å; L1547-L1551 VanDerWaalsContact O-CG 3.3Å; L1547-L1551 WeakPolarHBondContact O-CG 3.32Å; L1547-L1551 PolarHBondContact O-N 2.83Å |
| 1548 | L | 89.7 | Confident | 79.7 | Confident | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -65.1 | -21.8 | 177.7 | -66.8 | -172.7 | 0 | 0 | 0 | 114.7 | F1544 N1546 P1559 G1562 L1563 L1566 A1597 A1598 | F1544-L1548 HydrophobicContact CD1-CD1 4.08Å; F1544-L1548 HydrophobicContact CD1-CG 4.36Å; F1544-L1548 HydrophobicContact CE1-CD1 3.66Å; F1544-L1548 HydrophobicContact CE1-CD2 4.29Å; F1544-L1548 HydrophobicContact CE1-CG 4.06Å; F1544-L1548 HydrophobicContact CE2-CD2 4.12Å; F1544-L1548 HydrophobicContact CE2-CG 4.34Å; F1544-L1548 HydrophobicContact CZ-CD1 4.07Å; F1544-L1548 HydrophobicContact CZ-CD2 3.83Å; F1544-L1548 HydrophobicContact CZ-CG 4.06Å; F1544-L1548 WeakPolarHBondContact O-CG 3.3Å; F1544-L1548 PolarHBondContact O-N 2.92Å; N1546-L1548 VanDerWaalsContact C-N 3.29Å; N1546-L1548 PolarHBondContact O-N 3.48Å; L1548-P1559 HydrophobicContact CB-CB 3.92Å; L1548-P1559 HydrophobicContact CD1-CB 4.22Å; L1548-G1562 WeakPolarHBondContact O-CA 3.42Å; L1548-L1563 HydrophobicContact CD1-CB 4.35Å; L1548-L1563 HydrophobicContact CD2-CB 4.12Å; L1548-L1563 HydrophobicContact CD2-CD1 4.4Å; L1548-L1566 HydrophobicContact CD2-CB 4.46Å; L1548-L1566 HydrophobicContact CD2-CD2 3.85Å; L1548-A1597 HydrophobicContact CD1-CB 4.27Å; L1548-A1598 HydrophobicContact CD1-CB 4.1Å |
| 1549 | K | 86.9 | Confident | 79.7 | Confident | 80 Ų | 80 | 59 Ų | 59 | 35% | 0.348 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -78.5 | -46.4 | 172.1 | -67.4 | 162.5 | -159.5 | 152.8 | 0 | 111.1 | N1545 N1546 L1547 L1551 T1552 P1559 | N1545-K1549 WeakPolarHBondContact O-CG 3.26Å; N1545-K1549 PolarHBondContact O-N 2.98Å; N1545-K1549 WeakPolarHBondContact OD1-CE 3.27Å; N1545-K1549 PolarHBondContact OD1-NZ 3.49Å; N1546-K1549 PolarHBondContact O-N 3.47Å; N1546-K1549 PolarHBondContact OD1-NZ 2.66Å; L1547-K1549 VanDerWaalsContact C-N 3.28Å; L1547-K1549 PolarHBondContact O-N 3.25Å; K1549-L1551 PolarHBondContact O-N 2.97Å; K1549-T1552 PolarHBondContact O-N 3.3Å; K1549-T1552 VanDerWaalsContact O-N 3.08Å; K1549-T1552 PolarHBondContact O-OG1 3.08Å; K1549-P1559 HydrophobicContact CG-CG 4.26Å |
| 1550 | I | 87 | Confident | 79.8 | Confident | 14 Ų | 14 | 58.8 Ų | 58.8 | 7% | 0.072 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.5 | -35.8 | -177 | -66.8 | 163.9 | 0 | 0 | 0 | 110.9 | L1497 E1498 I1501 N1546 L1547 T1552 | L1497-I1550 HydrophobicContact CB-CD1 4.17Å; L1497-I1550 HydrophobicContact CD2-CD1 3.86Å; L1497-I1550 HydrophobicContact CG-CD1 3.82Å; E1498-I1550 HydrophobicContact CB-CD1 3.88Å; E1498-I1550 HydrophobicContact CB-CG1 3.83Å; E1498-I1550 HydrophobicContact CB-CG2 4.36Å; E1498-I1550 HydrophobicContact CG-CG1 4.07Å; E1498-I1550 HydrophobicContact CG-CG2 4.36Å; I1501-I1550 HydrophobicContact CB-CG2 3.8Å; I1501-I1550 HydrophobicContact CD1-CG2 3.89Å; I1501-I1550 HydrophobicContact CG1-CG2 4.4Å; I1501-I1550 HydrophobicContact CG2-CG2 3.86Å; N1546-I1550 WeakPolarHBondContact O-CG1 3.42Å; N1546-I1550 PolarHBondContact O-N 3.41Å; N1546-I1550 VanDerWaalsContact O-N 3.14Å; L1547-I1550 PolarHBondContact O-N 3.4Å; I1550-T1552 PolarHBondContact O-N 3.06Å |
| 1551 | L | 89 | Confident | 79.9 | Confident | 0 Ų | 0 | 59.9 Ų | 59.9 | 0% | 0 | 29% | 0.286 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.8 | 23.1 | 176.7 | -57.9 | 171.2 | 0 | 0 | 0 | 114.3 | I1501 D1507 L1511 L1547 K1549 N1565 L1566 | I1501-L1551 HydrophobicContact CG2-CD2 4.2Å; D1507-L1551 WeakPolarHBondContact O-CD2 3.49Å; L1511-L1551 HydrophobicContact CB-CD2 3.67Å; L1511-L1551 HydrophobicContact CD2-CD1 3.89Å; L1511-L1551 HydrophobicContact CD2-CD2 3.86Å; L1511-L1551 HydrophobicContact CG-CD2 4.28Å; L1547-L1551 HydrophobicContact CD1-CD1 4.17Å; L1547-L1551 HydrophobicContact CD1-CG 4.3Å; L1547-L1551 HydrophobicContact CG-CD1 4.13Å; L1547-L1551 VanDerWaalsContact O-CG 3.3Å; L1547-L1551 WeakPolarHBondContact O-CG 3.32Å; L1547-L1551 PolarHBondContact O-N 2.83Å; K1549-L1551 PolarHBondContact O-N 2.97Å; L1551-N1565 HydrophobicContact CB-CB 4.48Å; L1551-N1565 PolarHBondContact O-ND2 3.48Å; L1551-L1566 HydrophobicContact CD1-CB 3.87Å; L1551-L1566 HydrophobicContact CD1-CD1 4.33Å |
| 1552 | T | 84.6 | Confident | 80.1 | Confident | 20 Ų | 20 | 55.8 Ų | 55.8 | 12% | 0.123 | 27% | 0.267 | C | S | . | . | trans | -138.7 | 96.1 | -179.2 | 62.9 | 0 | 0 | 0 | 0 | 115.9 | K1549 I1550 G1554 D1561 G1562 | K1549-T1552 PolarHBondContact O-N 3.3Å; K1549-T1552 VanDerWaalsContact O-N 3.08Å; K1549-T1552 PolarHBondContact O-OG1 3.08Å; I1550-T1552 PolarHBondContact O-N 3.06Å; T1552-G1554 PolarHBondContact O-N 3.04Å; T1552-D1561 HydrophobicContact CG2-CB 3.95Å; T1552-G1562 VanDerWaalsContact CG2-CA 3.44Å | ||
| 1553 | R | 62.9 | Low | 80.4 | Confident | 172 Ų | 172 | 49.2 Ų | 49.2 | 65% | 0.649 | 24% | 0.236 | S | C | * | . | trans | -63.7 | 114.8 | 165.9 | -84.8 | -173.7 | -177.5 | 109.5 | -7.1 | 111.7 | G1505 D1507 | G1505-R1553 PolarHBondContact O-NH1 3.42Å; G1505-R1553 PolarHBondContact O-NH2 3.28Å; D1507-R1553 PolarHBondContact OD1-N 3.13Å; D1507-R1553 WeakPolarHBondContact OD2-CB 3.41Å; D1507-R1553 WeakPolarHBondContact OD2-CD 3.32Å; D1507-R1553 WeakPolarHBondContact OD2-CG 3.38Å; D1507-R1553 IonicContact OD2-CZ 3.76Å; D1507-R1553 IonicContact OD2-NE 2.65Å; D1507-R1553 IonicContact OD2-NH1 3.44Å; D1507-R1553 PolarHBondContact OD2-NH1 3.26Å | ||
| 1554 | G | 58.8 | Low | 80.4 | Confident | 50 Ų | 50 | 51 Ų | 51 | 52% | 0.515 | 25% | 0.251 | S | S | . | . | S | Bend | trans | 139 | 171.9 | 160 | 0 | 0 | 0 | 0 | 0 | 114.7 | T1552 H1556 E1557 | T1552-G1554 PolarHBondContact O-N 3.04Å; G1554-H1556 PolarHBondContact O-N 3.45Å; G1554-E1557 PolarHBondContact O-N 3.45Å |
| 1555 | K | 52.2 | Low | 80.4 | Confident | 199 Ų | 199 | 52.9 Ų | 52.9 | 87% | 0.865 | 26% | 0.261 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60 | 7 | -168.9 | -63.4 | 175.6 | 178.9 | 166.4 | 0 | 116.8 | ||
| 1556 | H | 59.3 | Low | 80.6 | Confident | 129 Ų | 129 | 51 Ų | 51 | 60% | 0.597 | 25% | 0.251 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -132.7 | -5 | -168.1 | -71.3 | -17.9 | 0 | 0 | 0 | 115.4 | G1554 R1558 | G1554-H1556 PolarHBondContact O-N 3.45Å; H1556-R1558 VanDerWaalsContact O-CG 3.25Å; H1556-R1558 WeakPolarHBondContact O-CG 3.37Å; H1556-R1558 PolarHBondContact O-N 3.09Å; H1556-R1558 VanDerWaalsContact O-N 3.12Å |
| 1557 | E | 68.4 | Low | 80.6 | Confident | 139 Ų | 139 | 50.1 Ų | 50.1 | 65% | 0.65 | 25% | 0.246 | S | C | * | . | trans | 33.2 | 65 | 160.4 | -67.6 | 153.3 | -128.5 | 0 | 0 | 114.4 | G1554 | G1554-E1557 PolarHBondContact O-N 3.45Š| ||
| 1558 | R | 77 | Confident | 80.5 | Confident | 76 Ų | 76 | 55.9 Ų | 55.9 | 29% | 0.287 | 27% | 0.271 | S | S | . | . | trans | -112.9 | 112.6 | -165.2 | -98.2 | 155.9 | -171.4 | -161.3 | -3.2 | 110.9 | H1556 I1560 D1561 G1562 R1674 | H1556-R1558 VanDerWaalsContact O-CG 3.25Å; H1556-R1558 WeakPolarHBondContact O-CG 3.37Å; H1556-R1558 PolarHBondContact O-N 3.09Å; H1556-R1558 VanDerWaalsContact O-N 3.12Å; R1558-I1560 HydrophobicContact CB-CG2 4.15Å; R1558-I1560 PolarHBondContact O-N 2.88Å; R1558-D1561 HydrophobicContact CB-CB 4.29Å; R1558-D1561 WeakPolarHBondContact CB-OD2 3.35Å; R1558-D1561 WeakPolarHBondContact CD-OD2 3.13Å; R1558-D1561 PolarHBondContact O-N 2.71Å; R1558-G1562 PolarHBondContact O-N 2.99Å; R1558-R1674 VanDerWaalsContact NH1-CG 3.26Å; R1558-R1674 PolarHBondContact NH1-O 3.02Å; R1558-R1674 PolarHBondContact NH2-O 3.23Å | ||
| 1559 | P | 82.9 | Confident | 80.4 | Confident | 26 Ų | 26 | 56.8 Ų | 56.8 | 17% | 0.169 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -55.5 | -26 | 179.5 | -29.8 | 36.5 | 0 | 0 | 0 | 115.3 | N1545 L1548 K1549 L1563 A1597 | N1545-P1559 WeakPolarHBondContact ND2-CG 3.36Å; L1548-P1559 HydrophobicContact CB-CB 3.92Å; L1548-P1559 HydrophobicContact CD1-CB 4.22Å; K1549-P1559 HydrophobicContact CG-CG 4.26Å; P1559-L1563 WeakPolarHBondContact O-CB 3.08Å; P1559-L1563 PolarHBondContact O-N 3.45Å; P1559-A1597 WeakPolarHBondContact CB-O 3.47Å |
| 1560 | I | 83.7 | Confident | 80.5 | Confident | 17 Ų | 17 | 53.2 Ų | 53.2 | 9% | 0.087 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -67.7 | -37.7 | 174.4 | -175.2 | 63.5 | 0 | 0 | 0 | 113.2 | R1558 L1563 A1564 E1603 A1604 L1607 | R1558-I1560 HydrophobicContact CB-CG2 4.15Å; R1558-I1560 PolarHBondContact O-N 2.88Å; I1560-L1563 PolarHBondContact O-N 3.22Å; I1560-A1564 PolarHBondContact O-N 2.62Å; I1560-E1603 HydrophobicContact CD1-CB 4.14Å; I1560-E1603 HydrophobicContact CD1-CG 4.04Å; I1560-E1603 HydrophobicContact CG1-CB 4.32Å; I1560-E1603 HydrophobicContact CG1-CG 3.94Å; I1560-A1604 VanDerWaalsContact CD1-CA 3.43Å; I1560-A1604 HydrophobicContact CD1-CB 3.79Å; I1560-L1607 HydrophobicContact CD1-CD1 3.62Å; I1560-L1607 HydrophobicContact CD1-CG 4.47Å; I1560-L1607 HydrophobicContact CG1-CD1 4.31Å |
| 1561 | D | 84.6 | Confident | 80.3 | Confident | 50 Ų | 50 | 53.5 Ų | 53.5 | 27% | 0.267 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -73.7 | -37.1 | 177.4 | -65.5 | -70.8 | 0 | 0 | 0 | 109.8 | T1552 R1558 L1563 A1564 N1565 R1674 | T1552-D1561 HydrophobicContact CG2-CB 3.95Å; R1558-D1561 HydrophobicContact CB-CB 4.29Å; R1558-D1561 WeakPolarHBondContact CB-OD2 3.35Å; R1558-D1561 WeakPolarHBondContact CD-OD2 3.13Å; R1558-D1561 PolarHBondContact O-N 2.71Å; D1561-L1563 VanDerWaalsContact C-N 3.35Å; D1561-L1563 PolarHBondContact O-N 3.1Å; D1561-A1564 WeakPolarHBondContact O-CB 3.47Å; D1561-A1564 PolarHBondContact O-N 2.84Å; D1561-N1565 PolarHBondContact O-N 3.28Å; D1561-N1565 VanDerWaalsContact O-N 3.11Å; D1561-R1674 IonicContact OD1-CZ 3.8Å; D1561-R1674 IonicContact OD1-NH1 3.61Å; D1561-R1674 PolarHBondContact OD1-NH1 2.61Å; D1561-R1674 IonicContact OD1-NH2 2.67Å; D1561-R1674 PolarHBondContact OD1-NH2 2.9Å; D1561-R1674 IonicContact OD2-CZ 2.68Å; D1561-R1674 IonicContact OD2-NH1 2.71Å; D1561-R1674 PolarHBondContact OD2-NH1 2.76Å |
| 1562 | G | 88.4 | Confident | 79.8 | Confident | 0 Ų | 0 | 59.1 Ų | 59.1 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -66.9 | -31.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | L1548 T1552 R1558 A1564 N1565 L1566 | L1548-G1562 WeakPolarHBondContact O-CA 3.42Å; T1552-G1562 VanDerWaalsContact CG2-CA 3.44Å; R1558-G1562 PolarHBondContact O-N 2.99Å; G1562-A1564 VanDerWaalsContact C-N 3.33Å; G1562-N1565 PolarHBondContact O-N 3.09Å; G1562-L1566 WeakPolarHBondContact O-CB 3.42Å; G1562-L1566 PolarHBondContact O-N 2.82Å |
| 1563 | L | 89.3 | Confident | 79.6 | Confident | 0 Ų | 0 | 60.8 Ų | 60.8 | 0% | 0 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -65.6 | -38.2 | 172.5 | 179 | 63.5 | 0 | 0 | 0 | 111 | F1544 L1548 P1559 I1560 D1561 L1566 L1567 I1594 A1598 A1604 L1607 L1608 | F1544-L1563 HydrophobicContact CZ-CD1 4.37Å; L1548-L1563 HydrophobicContact CD1-CB 4.35Å; L1548-L1563 HydrophobicContact CD2-CB 4.12Å; L1548-L1563 HydrophobicContact CD2-CD1 4.4Å; P1559-L1563 WeakPolarHBondContact O-CB 3.08Å; P1559-L1563 PolarHBondContact O-N 3.45Å; I1560-L1563 PolarHBondContact O-N 3.22Å; D1561-L1563 VanDerWaalsContact C-N 3.35Å; D1561-L1563 PolarHBondContact O-N 3.1Å; L1563-L1566 PolarHBondContact O-N 3.12Å; L1563-L1567 HydrophobicContact CD1-CD1 4.19Å; L1563-L1567 HydrophobicContact CD1-CG 4.24Å; L1563-L1567 HydrophobicContact CG-CD1 4Å; L1563-L1567 HydrophobicContact CG-CG 4.5Å; L1563-L1567 WeakPolarHBondContact O-CB 3.16Å; L1563-L1567 WeakPolarHBondContact O-CD1 3.48Å; L1563-L1567 VanDerWaalsContact O-CG 3.23Å; L1563-L1567 WeakPolarHBondContact O-CG 3.36Å; L1563-L1567 PolarHBondContact O-N 3.5Å; L1563-I1594 HydrophobicContact CD1-CG2 4.44Å; L1563-A1598 HydrophobicContact CB-CB 4.34Å; L1563-A1598 HydrophobicContact CD2-CB 3.69Å; L1563-A1604 HydrophobicContact CD2-CB 4.32Å; L1563-L1607 HydrophobicContact CB-CD1 4.4Å; L1563-L1607 HydrophobicContact CD2-CB 4.43Å; L1563-L1607 HydrophobicContact CD2-CD1 4.25Å; L1563-L1607 HydrophobicContact CG-CD1 4.29Å; L1563-L1608 HydrophobicContact CD1-CD2 4.46Å; L1563-L1608 HydrophobicContact CD2-CD2 4.46Å |
| 1564 | A | 87.7 | Confident | 80.3 | Confident | 38 Ų | 38 | 55.5 Ų | 55.5 | 31% | 0.314 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.8 | -44.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.3 | I1560 D1561 G1562 L1567 K1568 L1607 | I1560-A1564 PolarHBondContact O-N 2.62Å; D1561-A1564 WeakPolarHBondContact O-CB 3.47Å; D1561-A1564 PolarHBondContact O-N 2.84Å; G1562-A1564 VanDerWaalsContact C-N 3.33Å; A1564-L1567 PolarHBondContact O-N 3.48Å; A1564-K1568 PolarHBondContact O-N 2.88Å; A1564-L1607 HydrophobicContact CB-CD1 3.99Å; A1564-L1607 HydrophobicContact CB-CD2 4.35Å |
| 1565 | N | 89.1 | Confident | 81.4 | Confident | 38 Ų | 38 | 58.2 Ų | 58.2 | 20% | 0.203 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.3 | -43.8 | 177.2 | -68.7 | -3.6 | 0 | 0 | 0 | 111.8 | E1508 L1551 D1561 G1562 K1568 V1569 | E1508-N1565 HydrophobicContact CB-CB 4.29Å; L1551-N1565 HydrophobicContact CB-CB 4.48Å; L1551-N1565 PolarHBondContact O-ND2 3.48Å; D1561-N1565 PolarHBondContact O-N 3.28Å; D1561-N1565 VanDerWaalsContact O-N 3.11Å; G1562-N1565 PolarHBondContact O-N 3.09Å; N1565-K1568 WeakPolarHBondContact O-CB 3.2Å; N1565-K1568 PolarHBondContact O-N 3.31Å; N1565-V1569 WeakPolarHBondContact O-CG2 3.08Å; N1565-V1569 PolarHBondContact O-N 3.21Å; N1565-V1569 VanDerWaalsContact O-N 3.13Å |
| 1566 | L | 91.9 | Very high | 83 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.3 | -45.9 | 175.3 | 178.3 | 59 | 0 | 0 | 0 | 112.6 | L1511 L1530 F1544 L1548 L1551 G1562 L1563 K1568 V1569 L1570 L1580 | L1511-L1566 HydrophobicContact CD2-CD1 3.46Å; L1511-L1566 VanDerWaalsContact CD2-CD1 3.46Å; L1530-L1566 HydrophobicContact CD2-CD1 3.98Å; F1544-L1566 HydrophobicContact CE2-CD2 3.47Å; F1544-L1566 VanDerWaalsContact CE2-CD2 3.47Å; F1544-L1566 HydrophobicContact CZ-CD2 3.75Å; L1548-L1566 HydrophobicContact CD2-CB 4.46Å; L1548-L1566 HydrophobicContact CD2-CD2 3.85Å; L1551-L1566 HydrophobicContact CD1-CB 3.87Å; L1551-L1566 HydrophobicContact CD1-CD1 4.33Å; G1562-L1566 WeakPolarHBondContact O-CB 3.42Å; G1562-L1566 PolarHBondContact O-N 2.82Å; L1563-L1566 PolarHBondContact O-N 3.12Å; L1566-K1568 VanDerWaalsContact C-N 3.28Å; L1566-K1568 PolarHBondContact O-N 3.12Å; L1566-V1569 PolarHBondContact O-N 2.9Å; L1566-L1570 HydrophobicContact CD1-CD1 4.02Å; L1566-L1570 HydrophobicContact CD1-CG 4.28Å; L1566-L1570 HydrophobicContact CG-CD1 4.26Å; L1566-L1570 WeakPolarHBondContact O-CG 3.36Å; L1566-L1570 PolarHBondContact O-N 3.47Å; L1566-L1570 VanDerWaalsContact O-N 3.15Å; L1566-L1580 HydrophobicContact CD1-CD2 4.47Å; L1566-L1580 HydrophobicContact CD2-CD2 3.58Å; L1566-L1580 HydrophobicContact CG-CD2 3.99Å |
| 1567 | L | 89.5 | Confident | 84.2 | Confident | 5 Ų | 5 | 42.7 Ų | 42.7 | 3% | 0.026 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -63.5 | -35 | 177.3 | -71.5 | 167.9 | 0 | 0 | 0 | 111.9 | L1563 A1564 G1571 T1576 L1580 L1607 L1608 A1611 | L1563-L1567 HydrophobicContact CD1-CD1 4.19Å; L1563-L1567 HydrophobicContact CD1-CG 4.24Å; L1563-L1567 HydrophobicContact CG-CD1 4Å; L1563-L1567 HydrophobicContact CG-CG 4.5Å; L1563-L1567 WeakPolarHBondContact O-CB 3.16Å; L1563-L1567 WeakPolarHBondContact O-CD1 3.48Å; L1563-L1567 VanDerWaalsContact O-CG 3.23Å; L1563-L1567 WeakPolarHBondContact O-CG 3.36Å; L1563-L1567 PolarHBondContact O-N 3.5Å; A1564-L1567 PolarHBondContact O-N 3.48Å; L1567-G1571 CarbonylContact O-C 3.3Å; L1567-G1571 PolarHBondContact O-N 2.9Å; L1567-T1576 HydrophobicContact CD2-CG2 3.92Å; L1567-L1580 HydrophobicContact CD2-CD1 3.5Å; L1567-L1580 VanDerWaalsContact CD2-CD1 3.5Å; L1567-L1580 HydrophobicContact CG-CD1 4.46Å; L1567-L1607 HydrophobicContact CD1-CB 3.89Å; L1567-L1608 HydrophobicContact CD1-CD2 4.44Å; L1567-L1608 HydrophobicContact CD2-CD2 4.46Å; L1567-A1611 HydrophobicContact CD1-CB 4.25Å; L1567-A1611 HydrophobicContact CD2-CB 3.75Å; L1567-A1611 HydrophobicContact CG-CB 4.41Å |
| 1568 | K | 87.1 | Confident | 85 | Confident | 121 Ų | 121 | 37.6 Ų | 37.6 | 53% | 0.526 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -62.8 | -43.7 | 174.7 | -164.8 | -161.8 | -170.6 | -174.3 | 0 | 112.3 | E1508 A1564 N1565 L1566 | E1508-K1568 IonicContact OE1-NZ 2.68Å; E1508-K1568 PolarHBondContact OE1-NZ 3.3Å; E1508-K1568 WeakPolarHBondContact OE2-CD 3.25Å; E1508-K1568 WeakPolarHBondContact OE2-CE 3.03Å; E1508-K1568 IonicContact OE2-NZ 3.64Å; E1508-K1568 PolarHBondContact OE2-NZ 3.36Å; A1564-K1568 PolarHBondContact O-N 2.88Å; N1565-K1568 WeakPolarHBondContact O-CB 3.2Å; N1565-K1568 PolarHBondContact O-N 3.31Å; L1566-K1568 VanDerWaalsContact C-N 3.28Å; L1566-K1568 PolarHBondContact O-N 3.12Å |
| 1569 | V | 89.1 | Confident | 85.5 | Confident | 19 Ų | 19 | 34.2 Ų | 34.2 | 12% | 0.115 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -67 | -38.4 | 179.5 | 173.5 | 0 | 0 | 0 | 0 | 112.5 | E1508 L1511 N1512 L1515 N1565 L1566 | E1508-V1569 HydrophobicContact CB-CG2 3.58Å; E1508-V1569 WeakPolarHBondContact O-CG2 3.14Å; L1511-V1569 HydrophobicContact CD2-CB 4.41Å; L1511-V1569 HydrophobicContact CD2-CG1 4.25Å; L1511-V1569 HydrophobicContact CD2-CG2 4.49Å; L1511-V1569 HydrophobicContact CG-CG1 4.24Å; N1512-V1569 HydrophobicContact CB-CG1 3.93Å; N1512-V1569 HydrophobicContact CB-CG2 4.34Å; L1515-V1569 HydrophobicContact CD1-CG1 3.66Å; N1565-V1569 WeakPolarHBondContact O-CG2 3.08Å; N1565-V1569 PolarHBondContact O-N 3.21Å; N1565-V1569 VanDerWaalsContact O-N 3.13Å; L1566-V1569 PolarHBondContact O-N 2.9Å |
| 1570 | L | 88.4 | Confident | 85.7 | Confident | 5 Ų | 5 | 33 Ų | 33 | 3% | 0.026 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -78.4 | -36.8 | 179.9 | -60.9 | 177.2 | 0 | 0 | 0 | 112.2 | L1515 K1526 L1530 L1566 T1576 I1579 L1580 | L1515-L1570 HydrophobicContact CD1-CD2 4.04Å; K1526-L1570 HydrophobicContact CD-CD2 4.17Å; K1526-L1570 PolarHBondContact NZ-O 3.4Å; L1530-L1570 HydrophobicContact CD1-CD1 3.79Å; L1530-L1570 HydrophobicContact CD1-CD2 3.9Å; L1530-L1570 HydrophobicContact CD1-CG 4.47Å; L1566-L1570 HydrophobicContact CD1-CD1 4.02Å; L1566-L1570 HydrophobicContact CD1-CG 4.28Å; L1566-L1570 HydrophobicContact CG-CD1 4.26Å; L1566-L1570 WeakPolarHBondContact O-CG 3.36Å; L1566-L1570 PolarHBondContact O-N 3.47Å; L1566-L1570 VanDerWaalsContact O-N 3.15Å; L1570-T1576 HydrophobicContact CB-CG2 3.48Å; L1570-T1576 VanDerWaalsContact CB-CG2 3.48Å; L1570-T1576 HydrophobicContact CD1-CG2 4Å; L1570-T1576 HydrophobicContact CG-CG2 4.4Å; L1570-I1579 HydrophobicContact CD1-CG2 4.14Å; L1570-I1579 HydrophobicContact CD2-CG2 4.29Å; L1570-L1580 HydrophobicContact CD1-CD1 4.36Å; L1570-L1580 HydrophobicContact CD1-CD2 3.55Å; L1570-L1580 HydrophobicContact CD1-CG 3.73Å |
| 1571 | G | 81.9 | Confident | 85.9 | Confident | 19 Ų | 19 | 32.3 Ų | 32.3 | 20% | 0.196 | 19% | 0.188 | C | C | . | . | trans | 118.7 | 146.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L1567 N1573 T1576 | L1567-G1571 CarbonylContact O-C 3.3Å; L1567-G1571 PolarHBondContact O-N 2.9Å; G1571-N1573 PolarHBondContact O-N 3.45Å; G1571-T1576 VanDerWaalsContact O-CB 3.3Å; G1571-T1576 WeakPolarHBondContact O-CB 3.39Å; G1571-T1576 WeakPolarHBondContact O-CG2 2.87Å; G1571-T1576 PolarHBondContact O-OG1 3.39Å | ||
| 1572 | N | 78.7 | Confident | 85.9 | Confident | 118 Ų | 118 | 34.5 Ų | 34.5 | 63% | 0.631 | 20% | 0.197 | S | C | * | . | S | Bend | trans | -80.5 | 72.1 | 174.1 | -69.6 | -57.6 | 0 | 0 | 0 | 110.7 | A1611 | N1572-A1611 CarbonylContact C-O 3.48Å; N1572-A1611 VanDerWaalsContact C-O 3.25Å |
| 1573 | N | 81.5 | Confident | 85.9 | Confident | 56 Ų | 56 | 34.6 Ų | 34.6 | 30% | 0.299 | 20% | 0.198 | S | C | . | . | S | Bend | trans | -137.5 | 160.6 | 176.8 | 60 | 49.4 | 0 | 0 | 0 | 111.8 | G1571 D1575 T1576 A1611 | G1571-N1573 PolarHBondContact O-N 3.45Å; N1573-D1575 VanDerWaalsContact C-N 3.28Å; N1573-D1575 PolarHBondContact O-N 3.38Å; N1573-D1575 PolarHBondContact OD1-N 3Å; N1573-T1576 WeakPolarHBondContact O-CB 3.34Å; N1573-T1576 PolarHBondContact O-N 3.33Å; N1573-T1576 WeakPolarHBondContact OD1-CB 3.19Å; N1573-T1576 PolarHBondContact OD1-N 3.28Å; N1573-T1576 PolarHBondContact OD1-OG1 2.65Å; N1573-A1611 CarbonylContact C-O 3.53Å; N1573-A1611 VanDerWaalsContact C-O 3.24Å; N1573-A1611 WeakPolarHBondContact CA-O 3.35Å; N1573-A1611 PolarHBondContact N-O 3.05Å; N1573-A1611 VanDerWaalsContact N-O 3.08Å |
| 1574 | P | 77.1 | Confident | 85.7 | Confident | 61 Ų | 61 | 35.4 Ų | 35.4 | 40% | 0.396 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -59.6 | -34.1 | 178.6 | -25.9 | 36 | 0 | 0 | 0 | 114.3 | T1576 L1577 N1621 | P1574-T1576 PolarHBondContact O-N 2.81Å; P1574-L1577 PolarHBondContact O-N 3.02Å; P1574-N1621 HydrophobicContact CB-CB 4.42Å |
| 1575 | D | 81.8 | Confident | 85.1 | Confident | 106 Ų | 106 | 36.3 Ų | 36.3 | 57% | 0.567 | 21% | 0.214 | S | C | * | . | H | α-helix | trans | -63.1 | -30.5 | -178.3 | -56.1 | -39.5 | 0 | 0 | 0 | 112.1 | N1573 L1577 G1578 I1579 | N1573-D1575 VanDerWaalsContact C-N 3.28Å; N1573-D1575 PolarHBondContact O-N 3.38Å; N1573-D1575 PolarHBondContact OD1-N 3Å; D1575-L1577 PolarHBondContact O-N 3.02Å; D1575-G1578 WeakPolarHBondContact O-CA 3.49Å; D1575-G1578 PolarHBondContact O-N 3.11Å; D1575-I1579 WeakPolarHBondContact O-CG1 3.4Å; D1575-I1579 PolarHBondContact O-N 3.26Å |
| 1576 | T | 86.6 | Confident | 84.3 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61.2 | -29.4 | 177.2 | -70.4 | 0 | 0 | 0 | 0 | 113.3 | L1567 L1570 G1571 N1573 P1574 L1580 | L1567-T1576 HydrophobicContact CD2-CG2 3.92Å; L1570-T1576 HydrophobicContact CB-CG2 3.48Å; L1570-T1576 VanDerWaalsContact CB-CG2 3.48Å; L1570-T1576 HydrophobicContact CD1-CG2 4Å; L1570-T1576 HydrophobicContact CG-CG2 4.4Å; G1571-T1576 VanDerWaalsContact O-CB 3.3Å; G1571-T1576 WeakPolarHBondContact O-CB 3.39Å; G1571-T1576 WeakPolarHBondContact O-CG2 2.87Å; G1571-T1576 PolarHBondContact O-OG1 3.39Å; N1573-T1576 WeakPolarHBondContact O-CB 3.34Å; N1573-T1576 PolarHBondContact O-N 3.33Å; N1573-T1576 WeakPolarHBondContact OD1-CB 3.19Å; N1573-T1576 PolarHBondContact OD1-N 3.28Å; N1573-T1576 PolarHBondContact OD1-OG1 2.65Å; P1574-T1576 PolarHBondContact O-N 2.81Å; T1576-L1580 HydrophobicContact CG2-CD1 4.34Å; T1576-L1580 WeakPolarHBondContact O-CG 3.11Å; T1576-L1580 PolarHBondContact O-N 3.37Å |
| 1577 | L | 84.8 | Confident | 83.8 | Confident | 2 Ų | 2 | 37.9 Ų | 37.9 | 1% | 0.01 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -68.7 | -38.5 | 169.6 | -68.9 | -171.9 | 0 | 0 | 0 | 112.1 | P1574 D1575 L1580 L1581 L1608 A1612 L1622 A1625 | P1574-L1577 PolarHBondContact O-N 3.02Å; D1575-L1577 PolarHBondContact O-N 3.02Å; L1577-L1580 PolarHBondContact O-N 3.33Å; L1577-L1581 VanDerWaalsContact O-CB 3.28Å; L1577-L1581 WeakPolarHBondContact O-CB 3.42Å; L1577-L1581 WeakPolarHBondContact O-CD1 3.43Å; L1577-L1581 WeakPolarHBondContact O-CG 3.25Å; L1577-L1581 PolarHBondContact O-N 3.07Å; L1577-L1608 HydrophobicContact CD2-CB 4.26Å; L1577-L1608 HydrophobicContact CD2-CD2 3.95Å; L1577-A1612 HydrophobicContact CD1-CB 3.53Å; L1577-A1612 HydrophobicContact CG-CB 4.2Å; L1577-L1622 HydrophobicContact CD1-CB 3.84Å; L1577-L1622 HydrophobicContact CD1-CD1 3.51Å; L1577-L1622 HydrophobicContact CD1-CG 4.29Å; L1577-L1622 HydrophobicContact CD2-CD1 4.15Å; L1577-L1622 HydrophobicContact CG-CD1 4.46Å; L1577-A1625 HydrophobicContact CB-CB 3.8Å; L1577-A1625 HydrophobicContact CD1-CB 4.38Å |
| 1578 | G | 85 | Confident | 83.5 | Confident | 32 Ų | 32 | 39.3 Ų | 39.3 | 33% | 0.33 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -58.8 | -49 | 173 | 0 | 0 | 0 | 0 | 0 | 111.1 | D1575 L1580 L1581 E1582 | D1575-G1578 WeakPolarHBondContact O-CA 3.49Å; D1575-G1578 PolarHBondContact O-N 3.11Å; G1578-L1580 PolarHBondContact O-N 3.02Å; G1578-L1581 PolarHBondContact O-N 2.85Å; G1578-E1582 VanDerWaalsContact O-CB 3.28Å; G1578-E1582 WeakPolarHBondContact O-CB 3.28Å; G1578-E1582 PolarHBondContact O-N 2.93Å |
| 1579 | I | 86.1 | Confident | 83.2 | Confident | 5 Ų | 5 | 38.9 Ų | 38.9 | 3% | 0.026 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -54.6 | -53 | 176.6 | -64.3 | 174.2 | 0 | 0 | 0 | 111.5 | K1526 A1527 L1530 L1570 D1575 A1583 | K1526-I1579 HydrophobicContact CB-CD1 4.13Å; K1526-I1579 HydrophobicContact CB-CG2 3.94Å; K1526-I1579 HydrophobicContact CD-CD1 3.94Å; A1527-I1579 HydrophobicContact CB-CG2 4.18Å; L1530-I1579 HydrophobicContact CD1-CG2 3.63Å; L1570-I1579 HydrophobicContact CD1-CG2 4.14Å; L1570-I1579 HydrophobicContact CD2-CG2 4.29Å; D1575-I1579 WeakPolarHBondContact O-CG1 3.4Å; D1575-I1579 PolarHBondContact O-N 3.26Å; I1579-A1583 WeakPolarHBondContact O-CB 3.32Å; I1579-A1583 PolarHBondContact O-N 3.43Å; I1579-A1583 VanDerWaalsContact O-N 3.08Å |
| 1580 | L | 88.5 | Confident | 83 | Confident | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.005 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -65.6 | -43 | -178 | -75.3 | 175.2 | 0 | 0 | 0 | 112.8 | L1530 F1544 L1566 L1567 L1570 T1576 L1577 G1578 A1583 I1584 I1594 | L1530-L1580 HydrophobicContact CD1-CD2 4.38Å; F1544-L1580 HydrophobicContact CE2-CD2 4.37Å; F1544-L1580 HydrophobicContact CZ-CD2 4.49Å; L1566-L1580 HydrophobicContact CD1-CD2 4.47Å; L1566-L1580 HydrophobicContact CD2-CD2 3.58Å; L1566-L1580 HydrophobicContact CG-CD2 3.99Å; L1567-L1580 HydrophobicContact CD2-CD1 3.5Å; L1567-L1580 VanDerWaalsContact CD2-CD1 3.5Å; L1567-L1580 HydrophobicContact CG-CD1 4.46Å; L1570-L1580 HydrophobicContact CD1-CD1 4.36Å; L1570-L1580 HydrophobicContact CD1-CD2 3.55Å; L1570-L1580 HydrophobicContact CD1-CG 3.73Å; T1576-L1580 HydrophobicContact CG2-CD1 4.34Å; T1576-L1580 WeakPolarHBondContact O-CG 3.11Å; T1576-L1580 PolarHBondContact O-N 3.37Å; L1577-L1580 PolarHBondContact O-N 3.33Å; G1578-L1580 PolarHBondContact O-N 3.02Å; L1580-A1583 PolarHBondContact O-N 3.4Å; L1580-I1584 WeakPolarHBondContact O-CD1 3.33Å; L1580-I1584 WeakPolarHBondContact O-CG1 3.31Å; L1580-I1584 PolarHBondContact O-N 2.94Å; L1580-I1594 HydrophobicContact CB-CD1 4.14Å |
| 1581 | L | 87.1 | Confident | 83 | Confident | 3 Ų | 3 | 37.9 Ų | 37.9 | 2% | 0.016 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -66.6 | -47 | -179.9 | -71.4 | 166.6 | 0 | 0 | 0 | 110.6 | L1577 G1578 A1583 I1584 G1585 G1586 L1591 I1594 A1625 A1626 | L1577-L1581 VanDerWaalsContact O-CB 3.28Å; L1577-L1581 WeakPolarHBondContact O-CB 3.42Å; L1577-L1581 WeakPolarHBondContact O-CD1 3.43Å; L1577-L1581 WeakPolarHBondContact O-CG 3.25Å; L1577-L1581 PolarHBondContact O-N 3.07Å; G1578-L1581 PolarHBondContact O-N 2.85Å; L1581-A1583 VanDerWaalsContact C-N 3.29Å; L1581-A1583 PolarHBondContact O-N 2.96Å; L1581-I1584 PolarHBondContact O-N 3.28Å; L1581-G1585 PolarHBondContact O-N 3.41Å; L1581-G1586 VanDerWaalsContact O-CA 3.24Å; L1581-G1586 WeakPolarHBondContact O-CA 3.25Å; L1581-G1586 PolarHBondContact O-N 3.24Å; L1581-L1591 HydrophobicContact CD2-CB 3.93Å; L1581-I1594 HydrophobicContact CD2-CD1 3.66Å; L1581-I1594 HydrophobicContact CG-CD1 4.14Å; L1581-A1625 VanDerWaalsContact CD1-C 3.48Å; L1581-A1625 HydrophobicContact CD1-CB 3.79Å; L1581-A1626 HydrophobicContact CD1-CB 4.13Å |
| 1582 | E | 85.5 | Confident | 83.1 | Confident | 95 Ų | 95 | 37.6 Ų | 37.6 | 44% | 0.444 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -60.7 | -36.2 | 177.7 | -179.9 | 162.3 | -145.5 | 0 | 0 | 113 | A1527 G1578 I1584 | A1527-E1582 HydrophobicContact CB-CB 4.19Å; A1527-E1582 HydrophobicContact CB-CG 4.14Å; G1578-E1582 VanDerWaalsContact O-CB 3.28Å; G1578-E1582 WeakPolarHBondContact O-CB 3.28Å; G1578-E1582 PolarHBondContact O-N 2.93Å; E1582-I1584 VanDerWaalsContact C-N 3.35Å; E1582-I1584 PolarHBondContact O-N 3.13Å |
| 1583 | A | 87.2 | Confident | 83.4 | Confident | 2 Ų | 2 | 34.3 Ų | 34.3 | 2% | 0.017 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -65.3 | -34.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | A1527 L1530 K1531 I1534 I1579 L1580 L1581 | A1527-A1583 WeakPolarHBondContact O-CB 3.32Å; L1530-A1583 HydrophobicContact CB-CB 3.69Å; L1530-A1583 HydrophobicContact CD1-CB 4.47Å; K1531-A1583 HydrophobicContact CB-CB 4.41Å; K1531-A1583 WeakPolarHBondContact CG-O 3.42Å; I1534-A1583 HydrophobicContact CD1-CB 3.93Å; I1579-A1583 WeakPolarHBondContact O-CB 3.32Å; I1579-A1583 PolarHBondContact O-N 3.43Å; I1579-A1583 VanDerWaalsContact O-N 3.08Å; L1580-A1583 PolarHBondContact O-N 3.4Å; L1581-A1583 VanDerWaalsContact C-N 3.29Å; L1581-A1583 PolarHBondContact O-N 2.96Å |
| 1584 | I | 84.8 | Confident | 83.8 | Confident | 18 Ų | 18 | 31.7 Ų | 31.7 | 9% | 0.092 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -93.6 | -29.4 | -174.2 | -66 | 162.6 | 0 | 0 | 0 | 112.6 | I1534 F1544 L1580 L1581 E1582 D1593 I1594 | I1534-I1584 HydrophobicContact CD1-CG1 3.67Å; F1544-I1584 HydrophobicContact CB-CD1 4.32Å; F1544-I1584 HydrophobicContact CB-CG1 4.37Å; F1544-I1584 HydrophobicContact CD1-CD1 3.6Å; F1544-I1584 HydrophobicContact CD2-CD1 3.64Å; F1544-I1584 HydrophobicContact CD2-CG1 4.09Å; F1544-I1584 HydrophobicContact CE1-CD1 3.73Å; F1544-I1584 HydrophobicContact CE2-CD1 3.74Å; F1544-I1584 HydrophobicContact CG-CD1 3.57Å; F1544-I1584 HydrophobicContact CG-CG1 4.07Å; F1544-I1584 HydrophobicContact CZ-CD1 3.79Å; L1580-I1584 WeakPolarHBondContact O-CD1 3.33Å; L1580-I1584 WeakPolarHBondContact O-CG1 3.31Å; L1580-I1584 PolarHBondContact O-N 2.94Å; L1581-I1584 PolarHBondContact O-N 3.28Å; E1582-I1584 VanDerWaalsContact C-N 3.35Å; E1582-I1584 PolarHBondContact O-N 3.13Å; I1584-D1593 HydrophobicContact CG2-CB 3.88Å; I1584-I1594 HydrophobicContact CD1-CD1 3.91Å; I1584-I1594 HydrophobicContact CD1-CG1 3.24Å |
| 1585 | G | 75.5 | Confident | 84.2 | Confident | 56 Ų | 56 | 28.8 Ų | 28.8 | 58% | 0.577 | 18% | 0.179 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 151.5 | -14.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | L1581 | L1581-G1585 PolarHBondContact O-N 3.41Š|
| 1586 | G | 73.3 | Confident | 84.2 | Confident | 10 Ų | 10 | 25 Ų | 25 | 10% | 0.103 | 16% | 0.162 | C | C | . | . | trans | 87.7 | 169.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 115 | L1581 G1590 | L1581-G1586 VanDerWaalsContact O-CA 3.24Å; L1581-G1586 WeakPolarHBondContact O-CA 3.25Å; L1581-G1586 PolarHBondContact O-N 3.24Å; G1586-G1590 PolarHBondContact O-N 3.15Å | ||
| 1587 | N | 80.2 | Confident | 84.1 | Confident | 62 Ų | 62 | 25 Ų | 25 | 33% | 0.332 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | 62.4 | -152.7 | 170.1 | -28.2 | -67.5 | 0 | 0 | 0 | 113.3 | D1589 L1591 A1626 K1627 | N1587-D1589 VanDerWaalsContact C-N 3.27Å; N1587-D1589 PolarHBondContact O-N 3.02Å; N1587-L1591 PolarHBondContact O-N 3.39Å; N1587-A1626 CarbonylContact C-O 3.53Å; N1587-A1626 WeakPolarHBondContact CA-O 3.3Å; N1587-K1627 WeakPolarHBondContact OD1-CD 3.33Å; N1587-K1627 WeakPolarHBondContact OD1-CE 3.41Å; N1587-K1627 PolarHBondContact OD1-NZ 3.04Å |
| 1588 | S | 83 | Confident | 84 | Confident | 35 Ų | 35 | 25.2 Ų | 25.2 | 25% | 0.245 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -52.9 | -40.9 | 176.4 | 46.2 | 0 | 0 | 0 | 0 | 113.9 | L1591 A1592 A1626 | S1588-L1591 PolarHBondContact O-N 2.92Å; S1588-A1592 PolarHBondContact O-N 3.32Å; S1588-A1626 PolarHBondContact N-O 3.4Å |
| 1589 | D | 81.5 | Confident | 83.5 | Confident | 111 Ų | 111 | 24.9 Ų | 24.9 | 59% | 0.594 | 16% | 0.161 | S | C | * | . | H | α-helix | trans | -82 | -40.5 | -164.2 | -55.2 | -3.9 | 0 | 0 | 0 | 109.6 | N1587 L1591 A1592 D1593 | N1587-D1589 VanDerWaalsContact C-N 3.27Å; N1587-D1589 PolarHBondContact O-N 3.02Å; D1589-L1591 PolarHBondContact O-N 2.88Å; D1589-A1592 WeakPolarHBondContact O-CB 3.49Å; D1589-A1592 PolarHBondContact O-N 2.92Å; D1589-A1592 VanDerWaalsContact O-N 3.1Å; D1589-D1593 PolarHBondContact O-N 3.41Å |
| 1590 | G | 85 | Confident | 82.7 | Confident | 2 Ų | 2 | 24.8 Ų | 24.8 | 2% | 0.021 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.4 | -34.2 | 167.4 | 0 | 0 | 0 | 0 | 0 | 113 | G1586 I1594 | G1586-G1590 PolarHBondContact O-N 3.15Å; G1590-I1594 WeakPolarHBondContact O-CD1 3.46Å; G1590-I1594 WeakPolarHBondContact O-CG1 3.46Å; G1590-I1594 PolarHBondContact O-N 3.49Å |
| 1591 | L | 88 | Confident | 82.2 | Confident | 1 Ų | 1 | 25 Ų | 25 | 1% | 0.005 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -70.9 | -37.1 | 174.2 | -178.9 | 57.1 | 0 | 0 | 0 | 112.2 | L1581 N1587 S1588 D1589 L1595 L1608 L1622 A1626 L1628 L1634 V1637 | L1581-L1591 HydrophobicContact CD2-CB 3.93Å; N1587-L1591 PolarHBondContact O-N 3.39Å; S1588-L1591 PolarHBondContact O-N 2.92Å; D1589-L1591 PolarHBondContact O-N 2.88Å; L1591-L1595 HydrophobicContact CD1-CD1 4.15Å; L1591-L1595 HydrophobicContact CD1-CG 4.23Å; L1591-L1595 HydrophobicContact CG-CD1 4.19Å; L1591-L1595 WeakPolarHBondContact O-CB 3.48Å; L1591-L1595 VanDerWaalsContact O-CG 3.3Å; L1591-L1595 WeakPolarHBondContact O-CG 3.34Å; L1591-L1595 PolarHBondContact O-N 3.47Å; L1591-L1595 VanDerWaalsContact O-N 3.17Å; L1591-L1608 HydrophobicContact CD1-CD1 3.67Å; L1591-L1622 HydrophobicContact CD1-CD1 3.82Å; L1591-L1622 HydrophobicContact CD2-CD1 4.17Å; L1591-L1622 HydrophobicContact CD2-CG 4.25Å; L1591-A1626 HydrophobicContact CB-CB 4.16Å; L1591-A1626 HydrophobicContact CD2-CB 3.8Å; L1591-L1628 HydrophobicContact CD2-CD1 3.98Å; L1591-L1634 HydrophobicContact CD2-CD1 3.96Å; L1591-V1637 HydrophobicContact CB-CG1 4.2Å; L1591-V1637 HydrophobicContact CD2-CG1 4.19Å; L1591-V1637 HydrophobicContact CG-CG1 4Å |
| 1592 | A | 84.7 | Confident | 82 | Confident | 13 Ų | 13 | 24.9 Ų | 24.9 | 11% | 0.107 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.2 | -45.9 | 173 | 0 | 0 | 0 | 0 | 0 | 111 | S1588 D1589 L1595 A1596 V1637 A1640 | S1588-A1592 PolarHBondContact O-N 3.32Å; D1589-A1592 WeakPolarHBondContact O-CB 3.49Å; D1589-A1592 PolarHBondContact O-N 2.92Å; D1589-A1592 VanDerWaalsContact O-N 3.1Å; A1592-L1595 PolarHBondContact O-N 3.03Å; A1592-A1596 VanDerWaalsContact O-CB 3.26Å; A1592-A1596 WeakPolarHBondContact O-CB 3.42Å; A1592-A1596 PolarHBondContact O-N 2.93Å; A1592-V1637 HydrophobicContact CB-CG1 4.15Å; A1592-A1640 HydrophobicContact CB-CB 4.43Å |
| 1593 | D | 85.2 | Confident | 81.9 | Confident | 49 Ų | 49 | 21.4 Ų | 21.4 | 26% | 0.262 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -65.5 | -43.4 | 179.6 | -79.6 | 0.4 | 0 | 0 | 0 | 112.5 | Q1541 I1584 D1589 L1595 A1596 A1597 | Q1541-D1593 HydrophobicContact CB-CB 4.19Å; Q1541-D1593 HydrophobicContact CG-CB 4.35Å; I1584-D1593 HydrophobicContact CG2-CB 3.88Å; D1589-D1593 PolarHBondContact O-N 3.41Å; D1593-L1595 VanDerWaalsContact C-N 3.35Å; D1593-L1595 PolarHBondContact O-N 3.09Å; D1593-A1596 PolarHBondContact O-N 3.12Å; D1593-A1597 WeakPolarHBondContact O-CB 3.3Å; D1593-A1597 PolarHBondContact O-N 3.29Å |
| 1594 | I | 88.4 | Confident | 81.9 | Confident | 1 Ų | 1 | 21.3 Ų | 21.3 | 1% | 0.005 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -56.1 | -51.2 | 174 | -71.2 | 164.1 | 0 | 0 | 0 | 110.4 | F1544 L1563 L1580 L1581 I1584 G1590 A1597 A1598 L1608 | F1544-I1594 HydrophobicContact CD1-CG1 4.46Å; F1544-I1594 HydrophobicContact CE1-CB 4.11Å; F1544-I1594 HydrophobicContact CE1-CG1 3.9Å; F1544-I1594 HydrophobicContact CE1-CG2 4.07Å; F1544-I1594 HydrophobicContact CZ-CG1 4.35Å; L1563-I1594 HydrophobicContact CD1-CG2 4.44Å; L1580-I1594 HydrophobicContact CB-CD1 4.14Å; L1581-I1594 HydrophobicContact CD2-CD1 3.66Å; L1581-I1594 HydrophobicContact CG-CD1 4.14Å; I1584-I1594 HydrophobicContact CD1-CD1 3.91Å; I1584-I1594 HydrophobicContact CD1-CG1 3.24Å; G1590-I1594 WeakPolarHBondContact O-CD1 3.46Å; G1590-I1594 WeakPolarHBondContact O-CG1 3.46Å; G1590-I1594 PolarHBondContact O-N 3.49Å; I1594-A1597 PolarHBondContact O-N 3.05Å; I1594-A1598 WeakPolarHBondContact O-CB 3.35Å; I1594-A1598 PolarHBondContact O-N 3.25Å; I1594-L1608 HydrophobicContact CG2-CD1 3.77Å; I1594-L1608 HydrophobicContact CG2-CD2 3.96Å; I1594-L1608 HydrophobicContact CG2-CG 4.38Å |
| 1595 | L | 85.7 | Confident | 82.1 | Confident | 0 Ų | 0 | 20.5 Ų | 20.5 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -63.2 | -48 | -177.7 | -72.7 | 171 | 0 | 0 | 0 | 110.7 | L1591 A1592 D1593 A1598 G1599 G1600 A1604 L1605 L1608 L1638 A1641 L1643 | L1591-L1595 HydrophobicContact CD1-CD1 4.15Å; L1591-L1595 HydrophobicContact CD1-CG 4.23Å; L1591-L1595 HydrophobicContact CG-CD1 4.19Å; L1591-L1595 WeakPolarHBondContact O-CB 3.48Å; L1591-L1595 VanDerWaalsContact O-CG 3.3Å; L1591-L1595 WeakPolarHBondContact O-CG 3.34Å; L1591-L1595 PolarHBondContact O-N 3.47Å; L1591-L1595 VanDerWaalsContact O-N 3.17Å; A1592-L1595 PolarHBondContact O-N 3.03Å; D1593-L1595 VanDerWaalsContact C-N 3.35Å; D1593-L1595 PolarHBondContact O-N 3.09Å; L1595-A1598 PolarHBondContact O-N 3.3Å; L1595-G1599 CarbonylContact O-C 3.6Å; L1595-G1599 PolarHBondContact O-N 3.46Å; L1595-G1600 WeakPolarHBondContact O-CA 3.36Å; L1595-G1600 PolarHBondContact O-N 2.92Å; L1595-A1604 HydrophobicContact CD2-CB 4.09Å; L1595-L1605 HydrophobicContact CD1-CD1 4.35Å; L1595-L1605 HydrophobicContact CD2-CB 3.87Å; L1595-L1605 HydrophobicContact CD2-CD1 4.16Å; L1595-L1608 HydrophobicContact CD2-CD1 3.87Å; L1595-L1608 HydrophobicContact CG-CD1 4.27Å; L1595-L1638 HydrophobicContact CD1-CD2 3.49Å; L1595-L1638 VanDerWaalsContact CD1-CD2 3.49Å; L1595-A1641 HydrophobicContact CB-CB 3.65Å; L1595-A1641 HydrophobicContact CD1-CB 4.17Å; L1595-L1643 HydrophobicContact CB-CD1 4.43Å; L1595-L1643 HydrophobicContact CD1-CD1 4.31Å |
| 1596 | A | 82.7 | Confident | 82.7 | Confident | 26 Ų | 26 | 19 Ų | 19 | 22% | 0.215 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -66.9 | -35.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q1541 A1592 D1593 G1599 | Q1541-A1596 HydrophobicContact CG-CB 4.46Å; Q1541-A1596 VanDerWaalsContact NE2-CB 3.31Å; A1592-A1596 VanDerWaalsContact O-CB 3.26Å; A1592-A1596 WeakPolarHBondContact O-CB 3.42Å; A1592-A1596 PolarHBondContact O-N 2.93Å; D1593-A1596 PolarHBondContact O-N 3.12Å; A1596-G1599 CarbonylContact O-C 3.41Å; A1596-G1599 WeakPolarHBondContact O-CA 3.48Å; A1596-G1599 PolarHBondContact O-N 2.93Å |
| 1597 | A | 83.8 | Confident | 83.4 | Confident | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -69.6 | -39.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q1541 F1544 N1545 L1548 P1559 D1593 I1594 G1599 | Q1541-A1597 HydrophobicContact CG-CB 4.09Å; F1544-A1597 HydrophobicContact CD1-CB 3.59Å; F1544-A1597 HydrophobicContact CE1-CB 4.29Å; F1544-A1597 HydrophobicContact CG-CB 4.48Å; N1545-A1597 HydrophobicContact CB-CB 3.92Å; N1545-A1597 PolarHBondContact ND2-O 2.99Å; L1548-A1597 HydrophobicContact CD1-CB 4.27Å; P1559-A1597 WeakPolarHBondContact CB-O 3.47Å; D1593-A1597 WeakPolarHBondContact O-CB 3.3Å; D1593-A1597 PolarHBondContact O-N 3.29Å; I1594-A1597 PolarHBondContact O-N 3.05Å; A1597-G1599 PolarHBondContact O-N 2.92Å |
| 1598 | A | 82.5 | Confident | 83.8 | Confident | 8 Ų | 8 | 17.6 Ų | 17.6 | 7% | 0.066 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -70.4 | -16.1 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | L1548 L1563 I1594 L1595 A1604 | L1548-A1598 HydrophobicContact CD1-CB 4.1Å; L1563-A1598 HydrophobicContact CB-CB 4.34Å; L1563-A1598 HydrophobicContact CD2-CB 3.69Å; I1594-A1598 WeakPolarHBondContact O-CB 3.35Å; I1594-A1598 PolarHBondContact O-N 3.25Å; L1595-A1598 PolarHBondContact O-N 3.3Å; A1598-A1604 HydrophobicContact CB-CB 3.75Å |
| 1599 | G | 74.2 | Confident | 84.1 | Confident | 25 Ų | 25 | 16 Ų | 16 | 26% | 0.258 | 10% | 0.098 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 133.8 | -23 | 164.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | L1595 A1596 A1597 T1694 | L1595-G1599 CarbonylContact O-C 3.6Å; L1595-G1599 PolarHBondContact O-N 3.46Å; A1596-G1599 CarbonylContact O-C 3.41Å; A1596-G1599 WeakPolarHBondContact O-CA 3.48Å; A1596-G1599 PolarHBondContact O-N 2.93Å; A1597-G1599 PolarHBondContact O-N 2.92Å; G1599-T1694 VanDerWaalsContact C-CG2 3.41Å; G1599-T1694 WeakPolarHBondContact O-CB 3.29Å; G1599-T1694 VanDerWaalsContact O-CG2 3.26Å; G1599-T1694 WeakPolarHBondContact O-CG2 3.39Å; G1599-T1694 PolarHBondContact O-OG1 3.3Å |
| 1600 | G | 69.7 | Low | 84.4 | Confident | 3 Ų | 3 | 14.5 Ų | 14.5 | 3% | 0.031 | 9% | 0.091 | C | C | . | . | S | Bend | trans | 95.1 | 26.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | L1595 A1641 L1643 | L1595-G1600 WeakPolarHBondContact O-CA 3.36Å; L1595-G1600 PolarHBondContact O-N 2.92Å; G1600-A1641 WeakPolarHBondContact CA-O 3.35Å; G1600-L1643 WeakPolarHBondContact O-CG 3.5Å |
| 1601 | G | 77.9 | Confident | 84.4 | Confident | 4 Ų | 4 | 14.4 Ų | 14.4 | 4% | 0.041 | 9% | 0.09 | C | C | . | . | trans | -95 | 162.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | E1603 A1604 L1605 E1670 | G1601-E1603 PolarHBondContact O-N 3.4Å; G1601-A1604 PolarHBondContact O-N 3.38Å; G1601-L1605 PolarHBondContact O-N 2.93Å; G1601-E1670 WeakPolarHBondContact CA-OE2 3.5Å | ||
| 1602 | A | 82.9 | Confident | 84.2 | Confident | 1 Ų | 1 | 14.4 Ų | 14.4 | 1% | 0.008 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -61 | -32.2 | 165.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | A1604 L1605 Q1606 L1647 N1666 A1667 E1670 | A1602-A1604 VanDerWaalsContact C-N 3.32Å; A1602-A1604 PolarHBondContact O-N 3.07Å; A1602-L1605 PolarHBondContact O-N 3.42Å; A1602-Q1606 WeakPolarHBondContact O-CB 3.36Å; A1602-Q1606 PolarHBondContact O-N 2.91Å; A1602-L1647 HydrophobicContact CB-CD1 3.84Å; A1602-N1666 HydrophobicContact CB-CB 3.53Å; A1602-A1667 HydrophobicContact CB-CB 4.31Å; A1602-E1670 WeakPolarHBondContact CA-OE2 3.46Å; A1602-E1670 VanDerWaalsContact CB-OE1 3.32Å; A1602-E1670 WeakPolarHBondContact CB-OE1 3.14Å; A1602-E1670 VanDerWaalsContact N-CD 3.27Å; A1602-E1670 PolarHBondContact N-OE1 3.31Å; A1602-E1670 PolarHBondContact N-OE2 3.28Å |
| 1603 | E | 83.7 | Confident | 84.1 | Confident | 22 Ų | 22 | 16.6 Ų | 16.6 | 10% | 0.103 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59.3 | -41.7 | 176.2 | -164.4 | 172.6 | -168.1 | 0 | 0 | 111.7 | I1560 G1601 Q1606 L1607 A1667 E1670 N1671 R1674 | I1560-E1603 HydrophobicContact CD1-CB 4.14Å; I1560-E1603 HydrophobicContact CD1-CG 4.04Å; I1560-E1603 HydrophobicContact CG1-CB 4.32Å; I1560-E1603 HydrophobicContact CG1-CG 3.94Å; G1601-E1603 PolarHBondContact O-N 3.4Å; E1603-Q1606 PolarHBondContact O-N 2.9Å; E1603-L1607 PolarHBondContact O-N 3.43Å; E1603-L1607 VanDerWaalsContact O-N 3.07Å; E1603-A1667 HydrophobicContact CB-CB 4.44Å; E1603-E1670 HydrophobicContact CB-CB 4.44Å; E1603-E1670 PolarHBondContact N-OE2 3.27Å; E1603-N1671 VanDerWaalsContact OE1-CB 3.31Å; E1603-N1671 WeakPolarHBondContact OE1-CB 3.37Å; E1603-N1671 PolarHBondContact OE1-ND2 3.02Å; E1603-R1674 VanDerWaalsContact CD-NE 3.28Å; E1603-R1674 IonicContact OE1-CZ 2.63Å; E1603-R1674 VanDerWaalsContact OE1-CZ 3.28Å; E1603-R1674 IonicContact OE1-NE 3.23Å; E1603-R1674 PolarHBondContact OE1-NE 2.99Å; E1603-R1674 IonicContact OE1-NH2 3.5Å; E1603-R1674 PolarHBondContact OE1-NH2 3.08Å; E1603-R1674 WeakPolarHBondContact OE2-CD 3.49Å; E1603-R1674 IonicContact OE2-CZ 3.52Å; E1603-R1674 IonicContact OE2-NE 2.64Å; E1603-R1674 PolarHBondContact OE2-NE 3.29Å; E1603-R1674 IonicContact OE2-NH2 2.71Å |
| 1604 | A | 87.3 | Confident | 84 | Confident | 1 Ų | 1 | 15.2 Ų | 15.2 | 1% | 0.008 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -64.9 | -45.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | I1560 L1563 L1595 A1598 G1601 A1602 Q1606 L1607 L1608 | I1560-A1604 VanDerWaalsContact CD1-CA 3.43Å; I1560-A1604 HydrophobicContact CD1-CB 3.79Å; L1563-A1604 HydrophobicContact CD2-CB 4.32Å; L1595-A1604 HydrophobicContact CD2-CB 4.09Å; A1598-A1604 HydrophobicContact CB-CB 3.75Å; G1601-A1604 PolarHBondContact O-N 3.38Å; A1602-A1604 VanDerWaalsContact C-N 3.32Å; A1602-A1604 PolarHBondContact O-N 3.07Å; A1604-Q1606 VanDerWaalsContact C-N 3.29Å; A1604-Q1606 PolarHBondContact O-N 2.83Å; A1604-L1607 PolarHBondContact O-N 3.29Å; A1604-L1608 PolarHBondContact O-N 2.71Å |
| 1605 | L | 88.1 | Confident | 83.9 | Confident | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.9 | -35.9 | 177.4 | -176.1 | 61.2 | 0 | 0 | 0 | 111.8 | L1595 G1601 A1602 L1608 I1609 L1622 L1638 L1643 F1659 V1663 | L1595-L1605 HydrophobicContact CD1-CD1 4.35Å; L1595-L1605 HydrophobicContact CD2-CB 3.87Å; L1595-L1605 HydrophobicContact CD2-CD1 4.16Å; G1601-L1605 PolarHBondContact O-N 2.93Å; A1602-L1605 PolarHBondContact O-N 3.42Å; L1605-L1608 PolarHBondContact O-N 2.68Å; L1605-I1609 HydrophobicContact CD1-CD1 4.44Å; L1605-I1609 HydrophobicContact CG-CD1 4.01Å; L1605-I1609 VanDerWaalsContact O-CG1 3.3Å; L1605-I1609 WeakPolarHBondContact O-CG1 3.5Å; L1605-I1609 PolarHBondContact O-N 3.36Å; L1605-L1622 HydrophobicContact CD1-CD2 3.74Å; L1605-L1638 HydrophobicContact CD1-CD2 4.2Å; L1605-L1638 HydrophobicContact CD2-CD1 4.01Å; L1605-L1638 HydrophobicContact CD2-CD2 3.85Å; L1605-L1643 HydrophobicContact CB-CD2 4.31Å; L1605-L1643 HydrophobicContact CD2-CD2 4.02Å; L1605-F1659 HydrophobicContact CD2-CE1 4.18Å; L1605-F1659 HydrophobicContact CD2-CZ 3.81Å; L1605-V1663 HydrophobicContact CB-CG1 4.1Å; L1605-V1663 HydrophobicContact CD2-CG1 4.02Å; L1605-V1663 HydrophobicContact CD2-CG2 3.7Å; L1605-V1663 HydrophobicContact CG-CG1 4Å; L1605-V1663 HydrophobicContact CG-CG2 4.47Å |
| 1606 | Q | 89.3 | Confident | 83.7 | Confident | 25 Ų | 25 | 18.9 Ų | 18.9 | 12% | 0.117 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -68.2 | -37.1 | 176.5 | -167.5 | 60 | 59.6 | 0 | 0 | 112.5 | A1602 E1603 A1604 I1609 N1610 V1663 A1664 A1667 | A1602-Q1606 WeakPolarHBondContact O-CB 3.36Å; A1602-Q1606 PolarHBondContact O-N 2.91Å; E1603-Q1606 PolarHBondContact O-N 2.9Å; A1604-Q1606 VanDerWaalsContact C-N 3.29Å; A1604-Q1606 PolarHBondContact O-N 2.83Å; Q1606-I1609 PolarHBondContact O-N 2.9Å; Q1606-N1610 PolarHBondContact NE2-OD1 2.97Å; Q1606-N1610 WeakPolarHBondContact O-CB 3.4Å; Q1606-N1610 PolarHBondContact O-N 3.22Å; Q1606-N1610 PolarHBondContact O-ND2 2.98Å; Q1606-N1610 PolarHBondContact O-OD1 3.36Å; Q1606-V1663 HydrophobicContact CB-CG1 4.11Å; Q1606-A1664 VanDerWaalsContact OE1-N 3.11Å; Q1606-A1667 HydrophobicContact CB-CB 3.73Å; Q1606-A1667 HydrophobicContact CG-CB 4.17Å |
| 1607 | L | 88.4 | Confident | 83.7 | Confident | 43 Ų | 43 | 24.5 Ų | 24.5 | 23% | 0.225 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60.5 | -45.4 | 173.2 | -71.7 | 179.6 | 0 | 0 | 0 | 111.6 | I1560 L1563 A1564 L1567 E1603 A1604 N1610 A1611 | I1560-L1607 HydrophobicContact CD1-CD1 3.62Å; I1560-L1607 HydrophobicContact CD1-CG 4.47Å; I1560-L1607 HydrophobicContact CG1-CD1 4.31Å; L1563-L1607 HydrophobicContact CB-CD1 4.4Å; L1563-L1607 HydrophobicContact CD2-CB 4.43Å; L1563-L1607 HydrophobicContact CD2-CD1 4.25Å; L1563-L1607 HydrophobicContact CG-CD1 4.29Å; A1564-L1607 HydrophobicContact CB-CD1 3.99Å; A1564-L1607 HydrophobicContact CB-CD2 4.35Å; L1567-L1607 HydrophobicContact CD1-CB 3.89Å; E1603-L1607 PolarHBondContact O-N 3.43Å; E1603-L1607 VanDerWaalsContact O-N 3.07Å; A1604-L1607 PolarHBondContact O-N 3.29Å; L1607-N1610 PolarHBondContact O-N 3.35Å; L1607-A1611 PolarHBondContact O-N 3.32Å |
| 1608 | L | 89.1 | Confident | 83.8 | Confident | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -63.5 | -43.6 | 176.9 | -62 | 176.6 | 0 | 0 | 0 | 112.3 | L1563 L1567 L1577 L1591 I1594 L1595 A1604 L1605 N1610 A1612 L1622 | L1563-L1608 HydrophobicContact CD1-CD2 4.46Å; L1563-L1608 HydrophobicContact CD2-CD2 4.46Å; L1567-L1608 HydrophobicContact CD1-CD2 4.44Å; L1567-L1608 HydrophobicContact CD2-CD2 4.46Å; L1577-L1608 HydrophobicContact CD2-CB 4.26Å; L1577-L1608 HydrophobicContact CD2-CD2 3.95Å; L1591-L1608 HydrophobicContact CD1-CD1 3.67Å; I1594-L1608 HydrophobicContact CG2-CD1 3.77Å; I1594-L1608 HydrophobicContact CG2-CD2 3.96Å; I1594-L1608 HydrophobicContact CG2-CG 4.38Å; L1595-L1608 HydrophobicContact CD2-CD1 3.87Å; L1595-L1608 HydrophobicContact CG-CD1 4.27Å; A1604-L1608 PolarHBondContact O-N 2.71Å; L1605-L1608 PolarHBondContact O-N 2.68Å; L1608-N1610 VanDerWaalsContact C-N 3.29Å; L1608-N1610 PolarHBondContact O-N 2.65Å; L1608-A1612 WeakPolarHBondContact O-CB 3.5Å; L1608-A1612 PolarHBondContact O-N 2.81Å; L1608-A1612 VanDerWaalsContact O-N 3.13Å; L1608-L1622 HydrophobicContact CB-CD1 4.3Å; L1608-L1622 HydrophobicContact CB-CD2 4.38Å |
| 1609 | I | 88.2 | Confident | 84 | Confident | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -60.3 | -40.6 | 174.7 | -70.7 | 165.5 | 0 | 0 | 0 | 110.8 | L1605 Q1606 A1612 G1614 G1615 L1619 L1622 V1663 | L1605-I1609 HydrophobicContact CD1-CD1 4.44Å; L1605-I1609 HydrophobicContact CG-CD1 4.01Å; L1605-I1609 VanDerWaalsContact O-CG1 3.3Å; L1605-I1609 WeakPolarHBondContact O-CG1 3.5Å; L1605-I1609 PolarHBondContact O-N 3.36Å; Q1606-I1609 PolarHBondContact O-N 2.9Å; I1609-A1612 PolarHBondContact O-N 2.81Å; I1609-G1614 VanDerWaalsContact O-CA 3.22Å; I1609-G1614 WeakPolarHBondContact O-CA 3.44Å; I1609-G1614 PolarHBondContact O-N 2.69Å; I1609-G1615 WeakPolarHBondContact CG2-O 3.4Å; I1609-L1619 HydrophobicContact CD1-CD1 3.81Å; I1609-L1619 HydrophobicContact CG1-CD1 4.01Å; I1609-L1622 HydrophobicContact CG1-CD2 4.1Å; I1609-V1663 HydrophobicContact CD1-CB 4.49Å; I1609-V1663 HydrophobicContact CD1-CG1 4.11Å |
| 1610 | N | 88.2 | Confident | 84.6 | Confident | 81 Ų | 81 | 26.5 Ų | 26.5 | 43% | 0.433 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -66.9 | -48.4 | 180 | -71.2 | -5.8 | 0 | 0 | 0 | 112.1 | Q1606 L1607 L1608 A1612 G1613 G1614 | Q1606-N1610 PolarHBondContact NE2-OD1 2.97Å; Q1606-N1610 WeakPolarHBondContact O-CB 3.4Å; Q1606-N1610 PolarHBondContact O-N 3.22Å; Q1606-N1610 PolarHBondContact O-ND2 2.98Å; Q1606-N1610 PolarHBondContact O-OD1 3.36Å; L1607-N1610 PolarHBondContact O-N 3.35Å; L1608-N1610 VanDerWaalsContact C-N 3.29Å; L1608-N1610 PolarHBondContact O-N 2.65Å; N1610-A1612 PolarHBondContact O-N 2.61Å; N1610-G1613 PolarHBondContact O-N 3.4Å; N1610-G1614 PolarHBondContact O-N 3.04Å |
| 1611 | A | 85.1 | Confident | 85.5 | Confident | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -59.3 | -32.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L1567 N1572 N1573 L1607 G1613 | L1567-A1611 HydrophobicContact CD1-CB 4.25Å; L1567-A1611 HydrophobicContact CD2-CB 3.75Å; L1567-A1611 HydrophobicContact CG-CB 4.41Å; N1572-A1611 CarbonylContact C-O 3.48Å; N1572-A1611 VanDerWaalsContact C-O 3.25Å; N1573-A1611 CarbonylContact C-O 3.53Å; N1573-A1611 VanDerWaalsContact C-O 3.24Å; N1573-A1611 WeakPolarHBondContact CA-O 3.35Å; N1573-A1611 PolarHBondContact N-O 3.05Å; N1573-A1611 VanDerWaalsContact N-O 3.08Å; L1607-A1611 PolarHBondContact O-N 3.32Å; A1611-G1613 PolarHBondContact O-N 3.41Å |
| 1612 | A | 83.8 | Confident | 86 | Confident | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 18% | 0.182 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.1 | 0.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | L1577 L1608 I1609 N1610 G1618 N1621 | L1577-A1612 HydrophobicContact CD1-CB 3.53Å; L1577-A1612 HydrophobicContact CG-CB 4.2Å; L1608-A1612 WeakPolarHBondContact O-CB 3.5Å; L1608-A1612 PolarHBondContact O-N 2.81Å; L1608-A1612 VanDerWaalsContact O-N 3.13Å; I1609-A1612 PolarHBondContact O-N 2.81Å; N1610-A1612 PolarHBondContact O-N 2.61Å; A1612-G1618 VanDerWaalsContact CB-O 3.27Å; A1612-G1618 WeakPolarHBondContact CB-O 3.23Å; A1612-G1618 WeakPolarHBondContact O-CA 3.2Å; A1612-N1621 HydrophobicContact CB-CB 4.05Å; A1612-N1621 PolarHBondContact O-ND2 2.75Å |
| 1613 | G | 82.5 | Confident | 86.2 | Confident | 60 Ų | 60 | 29.3 Ų | 29.3 | 62% | 0.619 | 19% | 0.186 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 113.6 | -6.6 | -178 | 0 | 0 | 0 | 0 | 0 | 115.1 | N1610 A1611 | N1610-G1613 PolarHBondContact O-N 3.4Å; A1611-G1613 PolarHBondContact O-N 3.41Å |
| 1614 | G | 83 | Confident | 86.3 | Confident | 19 Ų | 19 | 31.5 Ų | 31.5 | 20% | 0.196 | 21% | 0.208 | C | C | . | . | S | Bend | trans | 83.3 | 165 | 172.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | I1609 N1610 E1617 G1618 | I1609-G1614 VanDerWaalsContact O-CA 3.22Å; I1609-G1614 WeakPolarHBondContact O-CA 3.44Å; I1609-G1614 PolarHBondContact O-N 2.69Å; N1610-G1614 PolarHBondContact O-N 3.04Å; G1614-E1617 PolarHBondContact O-N 2.52Å; G1614-G1618 PolarHBondContact O-N 3.04Å |
| 1615 | G | 84.9 | Confident | 86.1 | Confident | 37 Ų | 37 | 32.8 Ų | 32.8 | 38% | 0.381 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | 59.4 | -134.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | I1609 S1660 | I1609-G1615 WeakPolarHBondContact CG2-O 3.4Å; G1615-S1660 VanDerWaalsContact C-OG 3.22Å; G1615-S1660 PolarHBondContact O-OG 2.7Å |
| 1616 | A | 82.2 | Confident | 86.1 | Confident | 41 Ų | 41 | 32.8 Ų | 32.8 | 34% | 0.339 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -82.6 | -27.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.9 | L1619 V1620 | A1616-L1619 WeakPolarHBondContact O-CB 3.44Å; A1616-L1619 PolarHBondContact O-N 2.93Å; A1616-V1620 PolarHBondContact O-N 3.14Å; A1616-V1620 VanDerWaalsContact O-N 3.07Å |
| 1617 | E | 83.2 | Confident | 86.1 | Confident | 144 Ų | 144 | 38.5 Ų | 38.5 | 67% | 0.673 | 24% | 0.243 | S | C | * | . | H | α-helix | trans | -71.1 | -45.4 | -180 | -173.9 | 166.3 | -178.4 | 0 | 0 | 111.1 | G1614 L1619 V1620 N1621 | G1614-E1617 PolarHBondContact O-N 2.52Å; E1617-L1619 PolarHBondContact O-N 3.48Å; E1617-V1620 WeakPolarHBondContact O-CB 3.31Å; E1617-V1620 PolarHBondContact O-N 2.75Å; E1617-N1621 PolarHBondContact O-N 3.1Å |
| 1618 | G | 86.2 | Confident | 86 | Confident | 0 Ų | 0 | 37 Ų | 37 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.7 | -30.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | A1612 G1614 L1622 | A1612-G1618 VanDerWaalsContact CB-O 3.27Å; A1612-G1618 WeakPolarHBondContact CB-O 3.23Å; A1612-G1618 WeakPolarHBondContact O-CA 3.2Å; G1614-G1618 PolarHBondContact O-N 3.04Å; G1618-L1622 VanDerWaalsContact O-CB 3.28Å; G1618-L1622 WeakPolarHBondContact O-CB 3.27Å; G1618-L1622 PolarHBondContact O-N 2.94Å |
| 1619 | L | 87 | Confident | 85.7 | Confident | 0 Ų | 0 | 43.6 Ų | 43.6 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -72.3 | -37.4 | 173.1 | -168.3 | 75 | 0 | 0 | 0 | 112.4 | I1609 A1616 E1617 L1622 L1623 L1631 L1634 L1656 F1659 | I1609-L1619 HydrophobicContact CD1-CD1 3.81Å; I1609-L1619 HydrophobicContact CG1-CD1 4.01Å; A1616-L1619 WeakPolarHBondContact O-CB 3.44Å; A1616-L1619 PolarHBondContact O-N 2.93Å; E1617-L1619 PolarHBondContact O-N 3.48Å; L1619-L1622 HydrophobicContact CD1-CD2 4.42Å; L1619-L1622 PolarHBondContact O-N 3.21Å; L1619-L1623 WeakPolarHBondContact O-CB 3.1Å; L1619-L1623 VanDerWaalsContact O-CG 3.28Å; L1619-L1623 WeakPolarHBondContact O-CG 3.37Å; L1619-L1623 PolarHBondContact O-N 3.41Å; L1619-L1631 HydrophobicContact CD2-CD2 3.97Å; L1619-L1634 HydrophobicContact CD1-CD2 4.07Å; L1619-L1656 HydrophobicContact CD2-CB 4.34Å; L1619-L1656 HydrophobicContact CD2-CD2 4.1Å; L1619-L1656 HydrophobicContact CD2-CG 4.04Å; L1619-F1659 HydrophobicContact CD1-CD1 4.17Å; L1619-F1659 HydrophobicContact CD1-CE1 3.9Å; L1619-F1659 HydrophobicContact CD2-CD1 3.64Å; L1619-F1659 HydrophobicContact CD2-CE1 4.22Å |
| 1620 | V | 86.7 | Confident | 85.4 | Confident | 75 Ų | 75 | 46.9 Ų | 46.9 | 46% | 0.455 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.2 | -43.9 | 172 | 173.4 | 0 | 0 | 0 | 0 | 110.5 | A1616 E1617 L1622 L1623 A1624 L1656 | A1616-V1620 PolarHBondContact O-N 3.14Å; A1616-V1620 VanDerWaalsContact O-N 3.07Å; E1617-V1620 WeakPolarHBondContact O-CB 3.31Å; E1617-V1620 PolarHBondContact O-N 2.75Å; V1620-L1622 VanDerWaalsContact C-N 3.35Å; V1620-L1622 PolarHBondContact O-N 3.12Å; V1620-L1623 PolarHBondContact O-N 2.99Å; V1620-A1624 WeakPolarHBondContact O-CB 3.22Å; V1620-A1624 PolarHBondContact O-N 3.3Å; V1620-L1656 HydrophobicContact CG2-CD2 3.47Å; V1620-L1656 VanDerWaalsContact CG2-CD2 3.47Å |
| 1621 | N | 87.3 | Confident | 85.2 | Confident | 48 Ų | 48 | 43.6 Ų | 43.6 | 26% | 0.257 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.3 | -38.9 | 177.3 | -67 | -18.7 | 0 | 0 | 0 | 111.6 | P1574 A1612 E1617 A1624 A1625 | P1574-N1621 HydrophobicContact CB-CB 4.42Å; A1612-N1621 HydrophobicContact CB-CB 4.05Å; A1612-N1621 PolarHBondContact O-ND2 2.75Å; E1617-N1621 PolarHBondContact O-N 3.1Å; N1621-A1624 PolarHBondContact O-N 3.08Å; N1621-A1625 WeakPolarHBondContact O-CB 3.33Å; N1621-A1625 PolarHBondContact O-N 3.37Å |
| 1622 | L | 88.4 | Confident | 85.1 | Confident | 1 Ų | 1 | 47.6 Ų | 47.6 | 1% | 0.005 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64.5 | -43.8 | 173.7 | -178.3 | 63.2 | 0 | 0 | 0 | 112.9 | L1577 L1591 L1605 L1608 I1609 G1618 L1619 V1620 A1626 | L1577-L1622 HydrophobicContact CD1-CB 3.84Å; L1577-L1622 HydrophobicContact CD1-CD1 3.51Å; L1577-L1622 HydrophobicContact CD1-CG 4.29Å; L1577-L1622 HydrophobicContact CD2-CD1 4.15Å; L1577-L1622 HydrophobicContact CG-CD1 4.46Å; L1591-L1622 HydrophobicContact CD1-CD1 3.82Å; L1591-L1622 HydrophobicContact CD2-CD1 4.17Å; L1591-L1622 HydrophobicContact CD2-CG 4.25Å; L1605-L1622 HydrophobicContact CD1-CD2 3.74Å; L1608-L1622 HydrophobicContact CB-CD1 4.3Å; L1608-L1622 HydrophobicContact CB-CD2 4.38Å; I1609-L1622 HydrophobicContact CG1-CD2 4.1Å; G1618-L1622 VanDerWaalsContact O-CB 3.28Å; G1618-L1622 WeakPolarHBondContact O-CB 3.27Å; G1618-L1622 PolarHBondContact O-N 2.94Å; L1619-L1622 HydrophobicContact CD1-CD2 4.42Å; L1619-L1622 PolarHBondContact O-N 3.21Å; V1620-L1622 VanDerWaalsContact C-N 3.35Å; V1620-L1622 PolarHBondContact O-N 3.12Å; L1622-A1626 VanDerWaalsContact O-CB 3.3Å; L1622-A1626 WeakPolarHBondContact O-CB 3.42Å; L1622-A1626 PolarHBondContact O-N 2.8Å |
| 1623 | L | 87.5 | Confident | 85.2 | Confident | 18 Ų | 18 | 50.7 Ų | 50.7 | 9% | 0.094 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.3 | -45 | 173.4 | -73.1 | 165.9 | 0 | 0 | 0 | 111.2 | L1619 V1620 K1627 L1628 L1631 L1634 | L1619-L1623 WeakPolarHBondContact O-CB 3.1Å; L1619-L1623 VanDerWaalsContact O-CG 3.28Å; L1619-L1623 WeakPolarHBondContact O-CG 3.37Å; L1619-L1623 PolarHBondContact O-N 3.41Å; V1620-L1623 PolarHBondContact O-N 2.99Å; L1623-K1627 PolarHBondContact O-N 3.37Å; L1623-L1628 HydrophobicContact CB-CB 4.46Å; L1623-L1628 HydrophobicContact CD2-CB 3.66Å; L1623-L1628 HydrophobicContact CD2-CD1 3.98Å; L1623-L1628 HydrophobicContact CD2-CG 4.49Å; L1623-L1628 PolarHBondContact O-N 2.92Å; L1623-L1631 HydrophobicContact CD1-CD2 3.98Å; L1623-L1631 HydrophobicContact CD1-CG 4.46Å; L1623-L1631 HydrophobicContact CD2-CD2 4.42Å; L1623-L1634 HydrophobicContact CD2-CB 3.83Å; L1623-L1634 HydrophobicContact CD2-CD2 4.09Å; L1623-L1634 HydrophobicContact CD2-CG 4.39Å |
| 1624 | A | 85.9 | Confident | 85.5 | Confident | 68 Ų | 68 | 47.9 Ų | 47.9 | 56% | 0.562 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -64.6 | -47 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | V1620 N1621 A1626 K1627 | V1620-A1624 WeakPolarHBondContact O-CB 3.22Å; V1620-A1624 PolarHBondContact O-N 3.3Å; N1621-A1624 PolarHBondContact O-N 3.08Å; A1624-A1626 PolarHBondContact O-N 3.12Å; A1624-K1627 PolarHBondContact O-N 2.73Å; A1624-K1627 VanDerWaalsContact O-N 3.08Å |
| 1625 | A | 84.2 | Confident | 85.6 | Confident | 28 Ų | 28 | 47 Ų | 47 | 23% | 0.231 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.8 | -41 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L1577 L1581 N1621 K1627 | L1577-A1625 HydrophobicContact CB-CB 3.8Å; L1577-A1625 HydrophobicContact CD1-CB 4.38Å; L1581-A1625 VanDerWaalsContact CD1-C 3.48Å; L1581-A1625 HydrophobicContact CD1-CB 3.79Å; N1621-A1625 WeakPolarHBondContact O-CB 3.33Å; N1621-A1625 PolarHBondContact O-N 3.37Å; A1625-K1627 PolarHBondContact O-N 3.43Å |
| 1626 | A | 86.9 | Confident | 85.6 | Confident | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 27% | 0.265 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | 1.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114 | L1581 N1587 S1588 L1591 L1622 A1624 L1628 | L1581-A1626 HydrophobicContact CD1-CB 4.13Å; N1587-A1626 CarbonylContact C-O 3.53Å; N1587-A1626 WeakPolarHBondContact CA-O 3.3Å; S1588-A1626 PolarHBondContact N-O 3.4Å; L1591-A1626 HydrophobicContact CB-CB 4.16Å; L1591-A1626 HydrophobicContact CD2-CB 3.8Å; L1622-A1626 VanDerWaalsContact O-CB 3.3Å; L1622-A1626 WeakPolarHBondContact O-CB 3.42Å; L1622-A1626 PolarHBondContact O-N 2.8Å; A1624-A1626 PolarHBondContact O-N 3.12Å; A1626-L1628 HydrophobicContact CB-CD1 3.8Å; A1626-L1628 HydrophobicContact CB-CG 3.87Å; A1626-L1628 PolarHBondContact O-N 3.39Å |
| 1627 | K | 88.5 | Confident | 85.8 | Confident | 145 Ų | 145 | 47.1 Ų | 47.1 | 63% | 0.63 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | 40.1 | -178 | -52.5 | -178.8 | -161.1 | 148 | 0 | 113.2 | N1587 L1623 A1624 A1625 | N1587-K1627 WeakPolarHBondContact OD1-CD 3.33Å; N1587-K1627 WeakPolarHBondContact OD1-CE 3.41Å; N1587-K1627 PolarHBondContact OD1-NZ 3.04Å; L1623-K1627 PolarHBondContact O-N 3.37Å; A1624-K1627 PolarHBondContact O-N 2.73Å; A1624-K1627 VanDerWaalsContact O-N 3.08Å; A1625-K1627 PolarHBondContact O-N 3.43Å |
| 1628 | L | 86.3 | Confident | 85.9 | Confident | 13 Ų | 13 | 40.3 Ų | 40.3 | 7% | 0.068 | 22% | 0.22 | C | C | . | . | trans | -93.3 | 113 | 177.3 | -62.4 | 171 | 0 | 0 | 0 | 109.4 | L1591 L1623 A1626 N1630 Q1633 L1634 V1637 | L1591-L1628 HydrophobicContact CD2-CD1 3.98Å; L1623-L1628 HydrophobicContact CB-CB 4.46Å; L1623-L1628 HydrophobicContact CD2-CB 3.66Å; L1623-L1628 HydrophobicContact CD2-CD1 3.98Å; L1623-L1628 HydrophobicContact CD2-CG 4.49Å; L1623-L1628 PolarHBondContact O-N 2.92Å; A1626-L1628 HydrophobicContact CB-CD1 3.8Å; A1626-L1628 HydrophobicContact CB-CG 3.87Å; A1626-L1628 PolarHBondContact O-N 3.39Å; L1628-N1630 PolarHBondContact O-N 3.48Å; L1628-N1630 VanDerWaalsContact O-N 3.15Å; L1628-Q1633 HydrophobicContact CD2-CB 3.78Å; L1628-L1634 HydrophobicContact CD1-CB 4.1Å; L1628-L1634 HydrophobicContact CD1-CD1 3.83Å; L1628-V1637 HydrophobicContact CD2-CG2 4.1Å | ||
| 1629 | D | 83.1 | Confident | 85.7 | Confident | 138 Ų | 138 | 42.5 Ų | 42.5 | 74% | 0.738 | 24% | 0.238 | S | C | * | . | S | Bend | trans | -60.3 | -24.7 | -179.6 | -62.5 | -58.5 | 0 | 0 | 0 | 113 | Q1633 | D1629-Q1633 PolarHBondContact OD2-NE2 2.75Š|
| 1630 | N | 82.7 | Confident | 85.3 | Confident | 69 Ų | 69 | 46.3 Ų | 46.3 | 37% | 0.369 | 27% | 0.269 | S | S | . | . | S | Bend | trans | -167 | 167.2 | -171.3 | 56.6 | 74.7 | 0 | 0 | 0 | 113.4 | L1628 Q1632 Q1633 L1634 | L1628-N1630 PolarHBondContact O-N 3.48Å; L1628-N1630 VanDerWaalsContact O-N 3.15Å; N1630-Q1632 VanDerWaalsContact C-N 3.26Å; N1630-Q1632 PolarHBondContact O-N 3.22Å; N1630-Q1632 WeakPolarHBondContact OD1-CA 3.47Å; N1630-Q1632 VanDerWaalsContact OD1-CB 3.3Å; N1630-Q1632 WeakPolarHBondContact OD1-CB 3.42Å; N1630-Q1632 PolarHBondContact OD1-N 2.83Å; N1630-Q1633 PolarHBondContact O-N 2.87Å; N1630-Q1633 PolarHBondContact OD1-N 3.01Å; N1630-L1634 PolarHBondContact O-N 2.91Å |
| 1631 | L | 83.6 | Confident | 84.7 | Confident | 11 Ų | 11 | 43.1 Ų | 43.1 | 6% | 0.058 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.4 | -14.8 | 178.1 | -68.6 | 170.9 | 0 | 0 | 0 | 115.2 | L1619 L1623 L1634 A1635 A1651 G1654 L1656 | L1619-L1631 HydrophobicContact CD2-CD2 3.97Å; L1623-L1631 HydrophobicContact CD1-CD2 3.98Å; L1623-L1631 HydrophobicContact CD1-CG 4.46Å; L1623-L1631 HydrophobicContact CD2-CD2 4.42Å; L1631-L1634 HydrophobicContact CD2-CD2 3.74Å; L1631-A1635 WeakPolarHBondContact O-CB 3.34Å; L1631-A1635 PolarHBondContact O-N 3.08Å; L1631-A1651 VanDerWaalsContact CB-O 3.31Å; L1631-A1651 WeakPolarHBondContact CB-O 3.3Å; L1631-G1654 VanDerWaalsContact CD1-C 3.46Å; L1631-G1654 WeakPolarHBondContact CD1-O 3.44Å; L1631-L1656 HydrophobicContact CD1-CD1 3.8Å; L1631-L1656 HydrophobicContact CD1-CG 3.97Å; L1631-L1656 HydrophobicContact CG-CD1 4.45Å |
| 1632 | Q | 83.4 | Confident | 84.2 | Confident | 85 Ų | 85 | 43.1 Ų | 43.1 | 40% | 0.397 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -73.6 | -43.8 | 173.6 | 171.6 | 66.6 | 58.9 | 0 | 0 | 110.3 | N1630 L1634 A1635 D1636 | N1630-Q1632 VanDerWaalsContact C-N 3.26Å; N1630-Q1632 PolarHBondContact O-N 3.22Å; N1630-Q1632 WeakPolarHBondContact OD1-CA 3.47Å; N1630-Q1632 VanDerWaalsContact OD1-CB 3.3Å; N1630-Q1632 WeakPolarHBondContact OD1-CB 3.42Å; N1630-Q1632 PolarHBondContact OD1-N 2.83Å; Q1632-L1634 VanDerWaalsContact C-N 3.31Å; Q1632-L1634 PolarHBondContact O-N 3Å; Q1632-A1635 WeakPolarHBondContact O-CB 3.44Å; Q1632-A1635 PolarHBondContact O-N 2.96Å; Q1632-A1635 VanDerWaalsContact O-N 3.15Å; Q1632-D1636 VanDerWaalsContact NE2-CG 3.33Å; Q1632-D1636 PolarHBondContact NE2-OD1 3.14Å; Q1632-D1636 VanDerWaalsContact NE2-OD1 3.16Å; Q1632-D1636 PolarHBondContact NE2-OD2 3.28Å; Q1632-D1636 PolarHBondContact O-N 2.73Å; Q1632-D1636 VanDerWaalsContact O-N 3.12Å |
| 1633 | Q | 86.7 | Confident | 83.7 | Confident | 65 Ų | 65 | 43.5 Ų | 43.5 | 30% | 0.304 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -60.8 | -41.3 | 171.4 | -66.6 | 172.2 | -6.6 | 0 | 0 | 111 | L1628 D1629 N1630 A1635 D1636 V1637 | L1628-Q1633 HydrophobicContact CD2-CB 3.78Å; D1629-Q1633 PolarHBondContact OD2-NE2 2.75Å; N1630-Q1633 PolarHBondContact O-N 2.87Å; N1630-Q1633 PolarHBondContact OD1-N 3.01Å; Q1633-A1635 PolarHBondContact O-N 3.23Å; Q1633-D1636 PolarHBondContact O-N 3.44Å; Q1633-V1637 PolarHBondContact O-N 2.65Å |
| 1634 | L | 87.1 | Confident | 83.1 | Confident | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -58.4 | -46.5 | 171.6 | -178.4 | 64.7 | 0 | 0 | 0 | 111.6 | L1591 L1619 L1623 L1628 N1630 L1631 Q1632 D1636 V1637 L1638 F1659 | L1591-L1634 HydrophobicContact CD2-CD1 3.96Å; L1619-L1634 HydrophobicContact CD1-CD2 4.07Å; L1623-L1634 HydrophobicContact CD2-CB 3.83Å; L1623-L1634 HydrophobicContact CD2-CD2 4.09Å; L1623-L1634 HydrophobicContact CD2-CG 4.39Å; L1628-L1634 HydrophobicContact CD1-CB 4.1Å; L1628-L1634 HydrophobicContact CD1-CD1 3.83Å; N1630-L1634 PolarHBondContact O-N 2.91Å; L1631-L1634 HydrophobicContact CD2-CD2 3.74Å; Q1632-L1634 VanDerWaalsContact C-N 3.31Å; Q1632-L1634 PolarHBondContact O-N 3Å; L1634-D1636 PolarHBondContact O-N 3.21Å; L1634-V1637 CarbonylContact O-C 3.12Å; L1634-V1637 WeakPolarHBondContact O-CB 3.48Å; L1634-V1637 PolarHBondContact O-N 2.74Å; L1634-V1637 VanDerWaalsContact O-N 3.11Å; L1634-L1638 HydrophobicContact CD1-CD1 4.49Å; L1634-L1638 HydrophobicContact CD1-CD2 4.16Å; L1634-L1638 HydrophobicContact CD1-CG 4.12Å; L1634-L1638 HydrophobicContact CD2-CD1 4.48Å; L1634-L1638 HydrophobicContact CG-CD1 4.07Å; L1634-L1638 HydrophobicContact CG-CG 4.1Å; L1634-L1638 VanDerWaalsContact O-CG 3.29Å; L1634-L1638 WeakPolarHBondContact O-CG 3.42Å; L1634-L1638 PolarHBondContact O-N 3.2Å; L1634-F1659 HydrophobicContact CD2-CE1 4.1Å; L1634-F1659 HydrophobicContact CD2-CZ 4.5Å |
| 1635 | A | 85.5 | Confident | 82.7 | Confident | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -57.7 | -35.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | L1631 Q1632 Q1633 A1639 V1648 A1651 R1652 | L1631-A1635 WeakPolarHBondContact O-CB 3.34Å; L1631-A1635 PolarHBondContact O-N 3.08Å; Q1632-A1635 WeakPolarHBondContact O-CB 3.44Å; Q1632-A1635 PolarHBondContact O-N 2.96Å; Q1632-A1635 VanDerWaalsContact O-N 3.15Å; Q1633-A1635 PolarHBondContact O-N 3.23Å; A1635-A1639 WeakPolarHBondContact O-CB 3.38Å; A1635-A1639 PolarHBondContact O-N 3.32Å; A1635-V1648 HydrophobicContact CB-CG1 4.39Å; A1635-A1651 HydrophobicContact CB-CB 3.58Å; A1635-R1652 HydrophobicContact CB-CB 4.49Å; A1635-R1652 HydrophobicContact CB-CG 3.37Å |
| 1636 | D | 85.3 | Confident | 82.6 | Confident | 71 Ų | 71 | 47 Ų | 47 | 38% | 0.38 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -76.4 | -34 | 179 | -60 | -33.3 | 0 | 0 | 0 | 111.3 | Q1632 Q1633 L1634 A1639 A1640 R1652 | Q1632-D1636 VanDerWaalsContact NE2-CG 3.33Å; Q1632-D1636 PolarHBondContact NE2-OD1 3.14Å; Q1632-D1636 VanDerWaalsContact NE2-OD1 3.16Å; Q1632-D1636 PolarHBondContact NE2-OD2 3.28Å; Q1632-D1636 PolarHBondContact O-N 2.73Å; Q1632-D1636 VanDerWaalsContact O-N 3.12Å; Q1633-D1636 PolarHBondContact O-N 3.44Å; L1634-D1636 PolarHBondContact O-N 3.21Å; D1636-A1639 PolarHBondContact O-N 2.96Å; D1636-A1640 PolarHBondContact O-N 3.48Å; D1636-R1652 IonicContact OD1-CZ 2.87Å; D1636-R1652 IonicContact OD1-NE 2.7Å; D1636-R1652 PolarHBondContact OD1-NE 3.46Å; D1636-R1652 IonicContact OD1-NH2 3.23Å; D1636-R1652 PolarHBondContact OD1-NH2 2.97Å |
| 1637 | V | 85.9 | Confident | 82.3 | Confident | 11 Ų | 11 | 47 Ų | 47 | 7% | 0.067 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.2 | -45.6 | 166.4 | 167 | 0 | 0 | 0 | 0 | 112.1 | L1591 A1592 L1628 Q1633 L1634 A1639 A1640 A1641 | L1591-V1637 HydrophobicContact CB-CG1 4.2Å; L1591-V1637 HydrophobicContact CD2-CG1 4.19Å; L1591-V1637 HydrophobicContact CG-CG1 4Å; A1592-V1637 HydrophobicContact CB-CG1 4.15Å; L1628-V1637 HydrophobicContact CD2-CG2 4.1Å; Q1633-V1637 PolarHBondContact O-N 2.65Å; L1634-V1637 CarbonylContact O-C 3.12Å; L1634-V1637 WeakPolarHBondContact O-CB 3.48Å; L1634-V1637 PolarHBondContact O-N 2.74Å; L1634-V1637 VanDerWaalsContact O-N 3.11Å; V1637-A1639 VanDerWaalsContact C-N 3.29Å; V1637-A1639 PolarHBondContact O-N 3.31Å; V1637-A1640 WeakPolarHBondContact O-CB 3.4Å; V1637-A1640 PolarHBondContact O-N 2.96Å; V1637-A1641 WeakPolarHBondContact O-CB 3.27Å; V1637-A1641 PolarHBondContact O-N 3.2Å |
| 1638 | L | 86.3 | Confident | 82 | Confident | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.9 | -32.8 | 178.5 | -63 | -177.3 | 0 | 0 | 0 | 112.1 | L1595 L1605 L1634 G1642 L1643 V1648 A1651 F1659 | L1595-L1638 HydrophobicContact CD1-CD2 3.49Å; L1595-L1638 VanDerWaalsContact CD1-CD2 3.49Å; L1605-L1638 HydrophobicContact CD1-CD2 4.2Å; L1605-L1638 HydrophobicContact CD2-CD1 4.01Å; L1605-L1638 HydrophobicContact CD2-CD2 3.85Å; L1634-L1638 HydrophobicContact CD1-CD1 4.49Å; L1634-L1638 HydrophobicContact CD1-CD2 4.16Å; L1634-L1638 HydrophobicContact CD1-CG 4.12Å; L1634-L1638 HydrophobicContact CD2-CD1 4.48Å; L1634-L1638 HydrophobicContact CG-CD1 4.07Å; L1634-L1638 HydrophobicContact CG-CG 4.1Å; L1634-L1638 VanDerWaalsContact O-CG 3.29Å; L1634-L1638 WeakPolarHBondContact O-CG 3.42Å; L1634-L1638 PolarHBondContact O-N 3.2Å; L1638-G1642 PolarHBondContact O-N 3.47Å; L1638-L1643 HydrophobicContact CB-CB 4.35Å; L1638-L1643 HydrophobicContact CD2-CD1 4.27Å; L1638-L1643 HydrophobicContact CD2-CD2 4.06Å; L1638-L1643 PolarHBondContact O-N 3.22Å; L1638-V1648 HydrophobicContact CB-CG2 4.29Å; L1638-A1651 HydrophobicContact CD1-CB 4.37Å; L1638-F1659 HydrophobicContact CD1-CE1 4.5Å; L1638-F1659 HydrophobicContact CD1-CE2 3.99Å; L1638-F1659 HydrophobicContact CD1-CZ 3.49Å; L1638-F1659 VanDerWaalsContact CD1-CZ 3.49Å |
| 1639 | A | 81.5 | Confident | 81.8 | Confident | 47 Ų | 47 | 43.3 Ų | 43.3 | 39% | 0.388 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -69 | -38.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A1635 D1636 V1637 G1642 V1648 | A1635-A1639 WeakPolarHBondContact O-CB 3.38Å; A1635-A1639 PolarHBondContact O-N 3.32Å; D1636-A1639 PolarHBondContact O-N 2.96Å; V1637-A1639 VanDerWaalsContact C-N 3.29Å; V1637-A1639 PolarHBondContact O-N 3.31Å; A1639-G1642 PolarHBondContact O-N 2.93Å; A1639-V1648 HydrophobicContact CB-CG1 4.16Å; A1639-V1648 HydrophobicContact CB-CG2 3.94Å |
| 1640 | A | 79 | Confident | 81.8 | Confident | 79 Ų | 79 | 37.5 Ų | 37.5 | 65% | 0.653 | 24% | 0.235 | S | C | * | . | H | α-helix | trans | -64.6 | -42.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | A1592 D1636 V1637 G1642 | A1592-A1640 HydrophobicContact CB-CB 4.43Å; D1636-A1640 PolarHBondContact O-N 3.48Å; V1637-A1640 WeakPolarHBondContact O-CB 3.4Å; V1637-A1640 PolarHBondContact O-N 2.96Å; A1640-G1642 PolarHBondContact O-N 2.88Å |
| 1641 | A | 74.6 | Confident | 81.8 | Confident | 8 Ų | 8 | 34.2 Ų | 34.2 | 7% | 0.066 | 22% | 0.218 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -71.7 | -1.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | L1595 G1600 V1637 L1643 | L1595-A1641 HydrophobicContact CB-CB 3.65Å; L1595-A1641 HydrophobicContact CD1-CB 4.17Å; G1600-A1641 WeakPolarHBondContact CA-O 3.35Å; V1637-A1641 WeakPolarHBondContact O-CB 3.27Å; V1637-A1641 PolarHBondContact O-N 3.2Å; A1641-L1643 HydrophobicContact CB-CD1 3.74Å |
| 1642 | G | 75 | Confident | 81.8 | Confident | 48 Ų | 48 | 39.6 Ų | 39.6 | 50% | 0.495 | 24% | 0.237 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 81.4 | 10.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | L1638 A1639 A1640 | L1638-G1642 PolarHBondContact O-N 3.47Å; A1639-G1642 PolarHBondContact O-N 2.93Å; A1640-G1642 PolarHBondContact O-N 2.88Å |
| 1643 | L | 79.3 | Confident | 81.7 | Confident | 9 Ų | 9 | 39 Ų | 39 | 5% | 0.047 | 24% | 0.242 | C | C | . | . | trans | -64.7 | 155.1 | 177.5 | -78.6 | 81.1 | 0 | 0 | 0 | 111.5 | L1595 G1600 L1605 L1638 A1641 L1647 | L1595-L1643 HydrophobicContact CB-CD1 4.43Å; L1595-L1643 HydrophobicContact CD1-CD1 4.31Å; G1600-L1643 WeakPolarHBondContact O-CG 3.5Å; L1605-L1643 HydrophobicContact CB-CD2 4.31Å; L1605-L1643 HydrophobicContact CD2-CD2 4.02Å; L1638-L1643 HydrophobicContact CB-CB 4.35Å; L1638-L1643 HydrophobicContact CD2-CD1 4.27Å; L1638-L1643 HydrophobicContact CD2-CD2 4.06Å; L1638-L1643 PolarHBondContact O-N 3.22Å; A1641-L1643 HydrophobicContact CB-CD1 3.74Å; L1643-L1647 HydrophobicContact CD2-CD1 3.92Å | ||
| 1644 | S | 74.9 | Confident | 81.2 | Confident | 11 Ų | 11 | 38.1 Ų | 38.1 | 8% | 0.077 | 25% | 0.25 | C | S | . | . | trans | -56.8 | 144.6 | -174.2 | 66.4 | 0 | 0 | 0 | 0 | 114.5 | D1646 L1647 V1648 | S1644-D1646 PolarHBondContact O-N 3.3Å; S1644-L1647 PolarHBondContact O-N 3.34Å; S1644-V1648 PolarHBondContact O-N 3.29Å; S1644-V1648 VanDerWaalsContact O-N 3.09Å | ||
| 1645 | D | 77.7 | Confident | 81 | Confident | 117 Ų | 117 | 41.4 Ų | 41.4 | 63% | 0.626 | 27% | 0.268 | S | S | * | . | H | α-helix | trans | -49 | -34.3 | 173.9 | -61.3 | -54.9 | 0 | 0 | 0 | 113.3 | L1647 S1649 | D1645-L1647 VanDerWaalsContact C-N 3.35Å; D1645-L1647 PolarHBondContact O-N 3.43Å; D1645-S1649 WeakPolarHBondContact O-CB 3.3Å; D1645-S1649 PolarHBondContact O-N 3.06Å; D1645-S1649 PolarHBondContact O-OG 2.87Å |
| 1646 | D | 80.4 | Confident | 80.8 | Confident | 59 Ų | 59 | 44 Ų | 44 | 32% | 0.316 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.4 | -42.8 | 177.8 | -60.7 | -0.9 | 0 | 0 | 0 | 111 | S1644 A1650 N1698 R1701 | S1644-D1646 PolarHBondContact O-N 3.3Å; D1646-A1650 WeakPolarHBondContact O-CB 3.19Å; D1646-A1650 PolarHBondContact O-N 3.03Å; D1646-A1650 VanDerWaalsContact O-N 3.12Å; D1646-N1698 PolarHBondContact OD1-ND2 2.79Å; D1646-N1698 VanDerWaalsContact OD1-ND2 3.14Å; D1646-N1698 PolarHBondContact OD2-ND2 2.9Å; D1646-R1701 IonicContact OD2-NH1 2.7Å; D1646-R1701 PolarHBondContact OD2-NH1 2.9Å |
| 1647 | L | 81.8 | Confident | 80.5 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.005 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -76.5 | -43.6 | 177.6 | -71.8 | 174.5 | 0 | 0 | 0 | 112.1 | A1602 L1643 S1644 D1645 S1649 A1650 A1651 F1659 L1662 V1663 N1666 | A1602-L1647 HydrophobicContact CB-CD1 3.84Å; L1643-L1647 HydrophobicContact CD2-CD1 3.92Å; S1644-L1647 PolarHBondContact O-N 3.34Å; D1645-L1647 VanDerWaalsContact C-N 3.35Å; D1645-L1647 PolarHBondContact O-N 3.43Å; L1647-S1649 VanDerWaalsContact C-N 3.26Å; L1647-S1649 PolarHBondContact O-N 3.41Å; L1647-A1650 PolarHBondContact O-N 2.95Å; L1647-A1650 VanDerWaalsContact O-N 3.13Å; L1647-A1651 PolarHBondContact O-N 2.85Å; L1647-F1659 HydrophobicContact CB-CE2 4.36Å; L1647-F1659 HydrophobicContact CD2-CE2 4.21Å; L1647-F1659 WeakPolarHBondContact O-CE2 3.2Å; L1647-L1662 HydrophobicContact CD2-CB 4.29Å; L1647-L1662 HydrophobicContact CD2-CD2 3.95Å; L1647-L1662 HydrophobicContact CD2-CG 3.78Å; L1647-V1663 HydrophobicContact CD2-CG2 3.86Å; L1647-N1666 WeakPolarHBondContact CG-ND2 3.41Å |
| 1648 | V | 81.8 | Confident | 80.3 | Confident | 7 Ų | 7 | 48.6 Ų | 48.6 | 4% | 0.042 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -56.6 | -44.3 | 174.8 | 173.4 | 0 | 0 | 0 | 0 | 110.1 | A1635 L1638 A1639 S1644 A1651 R1652 | A1635-V1648 HydrophobicContact CB-CG1 4.39Å; L1638-V1648 HydrophobicContact CB-CG2 4.29Å; A1639-V1648 HydrophobicContact CB-CG1 4.16Å; A1639-V1648 HydrophobicContact CB-CG2 3.94Å; S1644-V1648 PolarHBondContact O-N 3.29Å; S1644-V1648 VanDerWaalsContact O-N 3.09Å; V1648-A1651 PolarHBondContact O-N 3.26Å; V1648-R1652 WeakPolarHBondContact O-CG 3.36Å; V1648-R1652 PolarHBondContact O-N 3.4Å; V1648-R1652 VanDerWaalsContact O-N 3.13Å |
| 1649 | S | 82.4 | Confident | 80.3 | Confident | 74 Ų | 74 | 48.6 Ų | 48.6 | 52% | 0.517 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -66.7 | -37.2 | 177.1 | -57.6 | 0 | 0 | 0 | 0 | 112.8 | D1645 L1647 R1652 S1653 | D1645-S1649 WeakPolarHBondContact O-CB 3.3Å; D1645-S1649 PolarHBondContact O-N 3.06Å; D1645-S1649 PolarHBondContact O-OG 2.87Å; L1647-S1649 VanDerWaalsContact C-N 3.26Å; L1647-S1649 PolarHBondContact O-N 3.41Å; S1649-R1652 PolarHBondContact O-N 3Å; S1649-S1653 PolarHBondContact O-N 2.9Å |
| 1650 | A | 82.9 | Confident | 80.5 | Confident | 16 Ų | 16 | 46.7 Ų | 46.7 | 13% | 0.132 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -69 | -38.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | D1646 L1647 S1653 F1659 L1662 | D1646-A1650 WeakPolarHBondContact O-CB 3.19Å; D1646-A1650 PolarHBondContact O-N 3.03Å; D1646-A1650 VanDerWaalsContact O-N 3.12Å; L1647-A1650 PolarHBondContact O-N 2.95Å; L1647-A1650 VanDerWaalsContact O-N 3.13Å; A1650-S1653 VanDerWaalsContact O-CB 3.25Å; A1650-S1653 WeakPolarHBondContact O-CB 3.11Å; A1650-S1653 PolarHBondContact O-N 3.12Å; A1650-S1653 VanDerWaalsContact O-N 3.11Å; A1650-S1653 PolarHBondContact O-OG 3.43Å; A1650-F1659 HydrophobicContact CB-CD2 3.86Å; A1650-L1662 HydrophobicContact CB-CD2 3.51Å |
| 1651 | A | 83.1 | Confident | 80.7 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | L1631 A1635 L1638 L1647 V1648 S1653 G1654 F1659 | L1631-A1651 VanDerWaalsContact CB-O 3.31Å; L1631-A1651 WeakPolarHBondContact CB-O 3.3Å; A1635-A1651 HydrophobicContact CB-CB 3.58Å; L1638-A1651 HydrophobicContact CD1-CB 4.37Å; L1647-A1651 PolarHBondContact O-N 2.85Å; V1648-A1651 PolarHBondContact O-N 3.26Å; A1651-S1653 PolarHBondContact O-N 3.24Å; A1651-G1654 PolarHBondContact O-N 3.28Å; A1651-G1654 VanDerWaalsContact O-N 3.12Å; A1651-F1659 HydrophobicContact CB-CD2 3.94Å; A1651-F1659 HydrophobicContact CB-CE2 3.76Å; A1651-F1659 HydrophobicContact CB-CZ 4.31Å |
| 1652 | R | 82.9 | Confident | 81.2 | Confident | 124 Ų | 124 | 48.2 Ų | 48.2 | 47% | 0.468 | 29% | 0.287 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | -11.2 | 174 | -64.5 | -174.9 | -178.6 | 147.3 | -3.4 | 114.7 | A1635 D1636 V1648 S1649 G1654 | A1635-R1652 HydrophobicContact CB-CB 4.49Å; A1635-R1652 HydrophobicContact CB-CG 3.37Å; D1636-R1652 IonicContact OD1-CZ 2.87Å; D1636-R1652 IonicContact OD1-NE 2.7Å; D1636-R1652 PolarHBondContact OD1-NE 3.46Å; D1636-R1652 IonicContact OD1-NH2 3.23Å; D1636-R1652 PolarHBondContact OD1-NH2 2.97Å; V1648-R1652 WeakPolarHBondContact O-CG 3.36Å; V1648-R1652 PolarHBondContact O-N 3.4Å; V1648-R1652 VanDerWaalsContact O-N 3.13Å; S1649-R1652 PolarHBondContact O-N 3Å; R1652-G1654 VanDerWaalsContact C-N 3.33Å |
| 1653 | S | 81.1 | Confident | 81.7 | Confident | 71 Ų | 71 | 46 Ų | 46 | 50% | 0.497 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.1 | -21.8 | 174 | 79.7 | 0 | 0 | 0 | 0 | 113.7 | S1649 A1650 A1651 N1655 | S1649-S1653 PolarHBondContact O-N 2.9Å; A1650-S1653 VanDerWaalsContact O-CB 3.25Å; A1650-S1653 WeakPolarHBondContact O-CB 3.11Å; A1650-S1653 PolarHBondContact O-N 3.12Å; A1650-S1653 VanDerWaalsContact O-N 3.11Å; A1650-S1653 PolarHBondContact O-OG 3.43Å; A1651-S1653 PolarHBondContact O-N 3.24Å; S1653-N1655 VanDerWaalsContact C-N 3.31Å; S1653-N1655 PolarHBondContact O-N 3.42Å; S1653-N1655 PolarHBondContact OG-N 2.9Å |
| 1654 | G | 76.9 | Confident | 82 | Confident | 47 Ų | 47 | 47.6 Ų | 47.6 | 49% | 0.485 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 79.1 | -0.2 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | L1631 A1651 R1652 L1656 | L1631-G1654 VanDerWaalsContact CD1-C 3.46Å; L1631-G1654 WeakPolarHBondContact CD1-O 3.44Å; A1651-G1654 PolarHBondContact O-N 3.28Å; A1651-G1654 VanDerWaalsContact O-N 3.12Å; R1652-G1654 VanDerWaalsContact C-N 3.33Å; G1654-L1656 PolarHBondContact O-N 3.22Å |
| 1655 | N | 83.5 | Confident | 82.4 | Confident | 69 Ų | 69 | 53.9 Ų | 53.9 | 37% | 0.369 | 30% | 0.3 | S | S | . | . | trans | -90.9 | 97.1 | -178.8 | -172.1 | -3.8 | 0 | 0 | 0 | 112.2 | S1653 S1657 E1658 F1659 | S1653-N1655 VanDerWaalsContact C-N 3.31Å; S1653-N1655 PolarHBondContact O-N 3.42Å; S1653-N1655 PolarHBondContact OG-N 2.9Å; N1655-S1657 VanDerWaalsContact C-N 3.34Å; N1655-S1657 PolarHBondContact O-N 3.42Å; N1655-S1657 PolarHBondContact OD1-N 3Å; N1655-E1658 HydrophobicContact CB-CB 4.07Å; N1655-E1658 WeakPolarHBondContact ND2-CB 3.18Å; N1655-E1658 PolarHBondContact ND2-OE2 3.05Å; N1655-E1658 PolarHBondContact O-N 3.5Å; N1655-F1659 VanDerWaalsContact O-CB 3.28Å; N1655-F1659 WeakPolarHBondContact O-CB 3.27Å; N1655-F1659 PolarHBondContact O-N 3.44Å | ||
| 1656 | L | 80.3 | Confident | 82.7 | Confident | 54 Ų | 54 | 48.5 Ų | 48.5 | 28% | 0.283 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -53.7 | -43.6 | -179.2 | -86.1 | 94.7 | 0 | 0 | 0 | 113.8 | L1619 V1620 L1631 G1654 S1660 | L1619-L1656 HydrophobicContact CD2-CB 4.34Å; L1619-L1656 HydrophobicContact CD2-CD2 4.1Å; L1619-L1656 HydrophobicContact CD2-CG 4.04Å; V1620-L1656 HydrophobicContact CG2-CD2 3.47Å; V1620-L1656 VanDerWaalsContact CG2-CD2 3.47Å; L1631-L1656 HydrophobicContact CD1-CD1 3.8Å; L1631-L1656 HydrophobicContact CD1-CG 3.97Å; L1631-L1656 HydrophobicContact CG-CD1 4.45Å; G1654-L1656 PolarHBondContact O-N 3.22Å; L1656-S1660 WeakPolarHBondContact O-CB 3.37Å; L1656-S1660 PolarHBondContact O-N 3.47Å |
| 1657 | S | 80.2 | Confident | 82.8 | Confident | 65 Ų | 65 | 46.1 Ų | 46.1 | 46% | 0.455 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -69.7 | -51.3 | -175.7 | -167.1 | 0 | 0 | 0 | 0 | 110.8 | N1655 F1659 S1660 D1661 | N1655-S1657 VanDerWaalsContact C-N 3.34Å; N1655-S1657 PolarHBondContact O-N 3.42Å; N1655-S1657 PolarHBondContact OD1-N 3Å; S1657-F1659 VanDerWaalsContact C-N 3.26Å; S1657-F1659 PolarHBondContact O-N 3.42Å; S1657-S1660 PolarHBondContact O-N 3.1Å; S1657-S1660 VanDerWaalsContact O-N 3.16Å; S1657-D1661 WeakPolarHBondContact O-CB 3.1Å; S1657-D1661 VanDerWaalsContact O-CG 3.28Å; S1657-D1661 PolarHBondContact O-N 3.35Å; S1657-D1661 VanDerWaalsContact O-OD2 3.13Å |
| 1658 | E | 81.7 | Confident | 82.8 | Confident | 114 Ų | 114 | 49 Ų | 49 | 53% | 0.533 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -65 | -32 | -179 | -178.5 | 173.5 | -163.3 | 0 | 0 | 112.3 | N1655 L1662 | N1655-E1658 HydrophobicContact CB-CB 4.07Å; N1655-E1658 WeakPolarHBondContact ND2-CB 3.18Å; N1655-E1658 PolarHBondContact ND2-OE2 3.05Å; N1655-E1658 PolarHBondContact O-N 3.5Å; E1658-L1662 VanDerWaalsContact O-CB 3.31Å; E1658-L1662 WeakPolarHBondContact O-CB 3.3Å; E1658-L1662 PolarHBondContact O-N 3.27Å |
| 1659 | F | 85.9 | Confident | 82.5 | Confident | 0 Ų | 0 | 51.7 Ų | 51.7 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -66.1 | -51.7 | 169.9 | 179.1 | -101.2 | 0 | 0 | 0 | 111.7 | L1605 L1619 L1634 L1638 L1647 A1650 A1651 N1655 S1657 D1661 L1662 V1663 | L1605-F1659 HydrophobicContact CD2-CE1 4.18Å; L1605-F1659 HydrophobicContact CD2-CZ 3.81Å; L1619-F1659 HydrophobicContact CD1-CD1 4.17Å; L1619-F1659 HydrophobicContact CD1-CE1 3.9Å; L1619-F1659 HydrophobicContact CD2-CD1 3.64Å; L1619-F1659 HydrophobicContact CD2-CE1 4.22Å; L1634-F1659 HydrophobicContact CD2-CE1 4.1Å; L1634-F1659 HydrophobicContact CD2-CZ 4.5Å; L1638-F1659 HydrophobicContact CD1-CE1 4.5Å; L1638-F1659 HydrophobicContact CD1-CE2 3.99Å; L1638-F1659 HydrophobicContact CD1-CZ 3.49Å; L1638-F1659 VanDerWaalsContact CD1-CZ 3.49Å; L1647-F1659 HydrophobicContact CB-CE2 4.36Å; L1647-F1659 HydrophobicContact CD2-CE2 4.21Å; L1647-F1659 WeakPolarHBondContact O-CE2 3.2Å; A1650-F1659 HydrophobicContact CB-CD2 3.86Å; A1651-F1659 HydrophobicContact CB-CD2 3.94Å; A1651-F1659 HydrophobicContact CB-CE2 3.76Å; A1651-F1659 HydrophobicContact CB-CZ 4.31Å; N1655-F1659 VanDerWaalsContact O-CB 3.28Å; N1655-F1659 WeakPolarHBondContact O-CB 3.27Å; N1655-F1659 PolarHBondContact O-N 3.44Å; S1657-F1659 VanDerWaalsContact C-N 3.26Å; S1657-F1659 PolarHBondContact O-N 3.42Å; F1659-D1661 VanDerWaalsContact C-N 3.34Å; F1659-D1661 PolarHBondContact O-N 3.48Å; F1659-L1662 CarbonylContact O-C 3.47Å; F1659-L1662 WeakPolarHBondContact O-CA 3.13Å; F1659-L1662 WeakPolarHBondContact O-CB 3.4Å; F1659-L1662 PolarHBondContact O-N 2.82Å; F1659-V1663 HydrophobicContact CD1-CG2 4.1Å; F1659-V1663 HydrophobicContact CD2-CG2 4.43Å; F1659-V1663 HydrophobicContact CE1-CG2 3.54Å; F1659-V1663 HydrophobicContact CE2-CG2 3.9Å; F1659-V1663 HydrophobicContact CZ-CG2 3.41Å; F1659-V1663 VanDerWaalsContact CZ-CG2 3.41Å; F1659-V1663 WeakPolarHBondContact O-CG2 3.49Å; F1659-V1663 PolarHBondContact O-N 3.42Å |
| 1660 | S | 84.8 | Confident | 82.2 | Confident | 7 Ų | 7 | 50 Ų | 50 | 5% | 0.049 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -59.1 | -43.8 | 178 | -167.6 | 0 | 0 | 0 | 0 | 111.7 | G1615 L1656 S1657 L1662 V1663 A1664 | G1615-S1660 VanDerWaalsContact C-OG 3.22Å; G1615-S1660 PolarHBondContact O-OG 2.7Å; L1656-S1660 WeakPolarHBondContact O-CB 3.37Å; L1656-S1660 PolarHBondContact O-N 3.47Å; S1657-S1660 PolarHBondContact O-N 3.1Å; S1657-S1660 VanDerWaalsContact O-N 3.16Å; S1660-L1662 VanDerWaalsContact C-N 3.26Å; S1660-L1662 PolarHBondContact O-N 2.86Å; S1660-V1663 PolarHBondContact O-N 2.82Å; S1660-A1664 WeakPolarHBondContact O-CB 3.33Å; S1660-A1664 PolarHBondContact O-N 3.26Å |
| 1661 | D | 84.3 | Confident | 81.9 | Confident | 87 Ų | 87 | 52.1 Ų | 52.1 | 47% | 0.465 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -61.5 | -30.4 | 173.6 | -71.2 | -40.9 | 0 | 0 | 0 | 112.8 | S1657 F1659 R1665 | S1657-D1661 WeakPolarHBondContact O-CB 3.1Å; S1657-D1661 VanDerWaalsContact O-CG 3.28Å; S1657-D1661 PolarHBondContact O-N 3.35Å; S1657-D1661 VanDerWaalsContact O-OD2 3.13Å; F1659-D1661 VanDerWaalsContact C-N 3.34Å; F1659-D1661 PolarHBondContact O-N 3.48Å; D1661-R1665 WeakPolarHBondContact O-CB 3.16Å; D1661-R1665 VanDerWaalsContact O-CG 3.3Å; D1661-R1665 WeakPolarHBondContact O-CG 3.18Å; D1661-R1665 PolarHBondContact O-N 3.43Å; D1661-R1665 PolarHBondContact O-NE 3.01Å |
| 1662 | L | 84.6 | Confident | 81.5 | Confident | 33 Ų | 33 | 59.2 Ų | 59.2 | 17% | 0.173 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -79.7 | -38.6 | 175.6 | -172.9 | 64.3 | 0 | 0 | 0 | 112.2 | L1647 A1650 E1658 F1659 S1660 R1665 N1666 | L1647-L1662 HydrophobicContact CD2-CB 4.29Å; L1647-L1662 HydrophobicContact CD2-CD2 3.95Å; L1647-L1662 HydrophobicContact CD2-CG 3.78Å; A1650-L1662 HydrophobicContact CB-CD2 3.51Å; E1658-L1662 VanDerWaalsContact O-CB 3.31Å; E1658-L1662 WeakPolarHBondContact O-CB 3.3Å; E1658-L1662 PolarHBondContact O-N 3.27Å; F1659-L1662 CarbonylContact O-C 3.47Å; F1659-L1662 WeakPolarHBondContact O-CA 3.13Å; F1659-L1662 WeakPolarHBondContact O-CB 3.4Å; F1659-L1662 PolarHBondContact O-N 2.82Å; S1660-L1662 VanDerWaalsContact C-N 3.26Å; S1660-L1662 PolarHBondContact O-N 2.86Å; L1662-R1665 PolarHBondContact O-N 3.13Å; L1662-N1666 WeakPolarHBondContact O-CB 3.29Å; L1662-N1666 PolarHBondContact O-N 2.89Å |
| 1663 | V | 86.3 | Confident | 80.9 | Confident | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.5 | -50.4 | 171.8 | 178 | 0 | 0 | 0 | 0 | 109.6 | L1605 Q1606 I1609 L1647 F1659 S1660 R1665 N1666 A1667 | L1605-V1663 HydrophobicContact CB-CG1 4.1Å; L1605-V1663 HydrophobicContact CD2-CG1 4.02Å; L1605-V1663 HydrophobicContact CD2-CG2 3.7Å; L1605-V1663 HydrophobicContact CG-CG1 4Å; L1605-V1663 HydrophobicContact CG-CG2 4.47Å; Q1606-V1663 HydrophobicContact CB-CG1 4.11Å; I1609-V1663 HydrophobicContact CD1-CB 4.49Å; I1609-V1663 HydrophobicContact CD1-CG1 4.11Å; L1647-V1663 HydrophobicContact CD2-CG2 3.86Å; F1659-V1663 HydrophobicContact CD1-CG2 4.1Å; F1659-V1663 HydrophobicContact CD2-CG2 4.43Å; F1659-V1663 HydrophobicContact CE1-CG2 3.54Å; F1659-V1663 HydrophobicContact CE2-CG2 3.9Å; F1659-V1663 HydrophobicContact CZ-CG2 3.41Å; F1659-V1663 VanDerWaalsContact CZ-CG2 3.41Å; F1659-V1663 WeakPolarHBondContact O-CG2 3.49Å; F1659-V1663 PolarHBondContact O-N 3.42Å; S1660-V1663 PolarHBondContact O-N 2.82Å; V1663-R1665 VanDerWaalsContact C-N 3.33Å; V1663-R1665 PolarHBondContact O-N 3.43Å; V1663-N1666 PolarHBondContact O-N 3.24Å; V1663-A1667 VanDerWaalsContact O-CB 3.24Å; V1663-A1667 WeakPolarHBondContact O-CB 3.26Å; V1663-A1667 PolarHBondContact O-N 3.3Å |
| 1664 | A | 84.9 | Confident | 80.3 | Confident | 43 Ų | 43 | 53.7 Ų | 53.7 | 36% | 0.355 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -59.4 | -40.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q1606 S1660 A1668 | Q1606-A1664 VanDerWaalsContact OE1-N 3.11Å; S1660-A1664 WeakPolarHBondContact O-CB 3.33Å; S1660-A1664 PolarHBondContact O-N 3.26Å; A1664-A1668 WeakPolarHBondContact O-CB 3.45Å; A1664-A1668 PolarHBondContact O-N 3.04Å |
| 1665 | R | 83.6 | Confident | 79.9 | Confident | 143 Ų | 143 | 56 Ų | 56 | 54% | 0.54 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -68.7 | -42.7 | 175.8 | -78.6 | 176.9 | -68.9 | 150 | -1.7 | 112.9 | D1661 L1662 V1663 A1668 E1669 | D1661-R1665 WeakPolarHBondContact O-CB 3.16Å; D1661-R1665 VanDerWaalsContact O-CG 3.3Å; D1661-R1665 WeakPolarHBondContact O-CG 3.18Å; D1661-R1665 PolarHBondContact O-N 3.43Å; D1661-R1665 PolarHBondContact O-NE 3.01Å; L1662-R1665 PolarHBondContact O-N 3.13Å; V1663-R1665 VanDerWaalsContact C-N 3.33Å; V1663-R1665 PolarHBondContact O-N 3.43Å; R1665-A1668 PolarHBondContact O-N 3.38Å; R1665-E1669 PolarHBondContact O-N 3.08Å |
| 1666 | N | 82.8 | Confident | 79.1 | Confident | 5 Ų | 5 | 57.7 Ų | 57.7 | 3% | 0.027 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -69.4 | -38.9 | 177.9 | -75.2 | -1.1 | 0 | 0 | 0 | 111 | A1602 L1647 L1662 V1663 A1668 E1669 E1670 I1697 | A1602-N1666 HydrophobicContact CB-CB 3.53Å; L1647-N1666 WeakPolarHBondContact CG-ND2 3.41Å; L1662-N1666 WeakPolarHBondContact O-CB 3.29Å; L1662-N1666 PolarHBondContact O-N 2.89Å; V1663-N1666 PolarHBondContact O-N 3.24Å; N1666-A1668 VanDerWaalsContact C-N 3.31Å; N1666-A1668 PolarHBondContact O-N 3.04Å; N1666-E1669 PolarHBondContact O-N 2.92Å; N1666-E1669 VanDerWaalsContact O-N 3.15Å; N1666-E1670 WeakPolarHBondContact O-CB 3.21Å; N1666-E1670 WeakPolarHBondContact O-CG 2.81Å; N1666-E1670 PolarHBondContact O-N 3.28Å; N1666-I1697 HydrophobicContact CB-CD1 4.01Å |
| 1667 | A | 83.3 | Confident | 77.7 | Confident | 8 Ų | 8 | 58.3 Ų | 58.3 | 7% | 0.066 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.6 | -40.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | A1602 E1603 Q1606 V1663 E1670 N1671 | A1602-A1667 HydrophobicContact CB-CB 4.31Å; E1603-A1667 HydrophobicContact CB-CB 4.44Å; Q1606-A1667 HydrophobicContact CB-CB 3.73Å; Q1606-A1667 HydrophobicContact CG-CB 4.17Å; V1663-A1667 VanDerWaalsContact O-CB 3.24Å; V1663-A1667 WeakPolarHBondContact O-CB 3.26Å; V1663-A1667 PolarHBondContact O-N 3.3Å; A1667-E1670 PolarHBondContact O-N 3.24Å; A1667-N1671 VanDerWaalsContact O-CB 3.28Å; A1667-N1671 WeakPolarHBondContact O-CB 3.24Å; A1667-N1671 PolarHBondContact O-N 3.29Å |
| 1668 | A | 81.2 | Confident | 76.6 | Confident | 62 Ų | 62 | 58.4 Ų | 58.4 | 51% | 0.512 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -68.3 | -36.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113 | A1664 R1665 N1666 Y1672 | A1664-A1668 WeakPolarHBondContact O-CB 3.45Å; A1664-A1668 PolarHBondContact O-N 3.04Å; R1665-A1668 PolarHBondContact O-N 3.38Å; N1666-A1668 VanDerWaalsContact C-N 3.31Å; N1666-A1668 PolarHBondContact O-N 3.04Å; A1668-Y1672 WeakPolarHBondContact O-CB 3.5Å; A1668-Y1672 PolarHBondContact O-N 2.96Å; A1668-Y1672 VanDerWaalsContact O-N 3.08Å |
| 1669 | E | 76.2 | Confident | 75.3 | Confident | 64 Ų | 64 | 62.5 Ų | 62.5 | 30% | 0.299 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -67.7 | -40.1 | 173.7 | -167.6 | 173.4 | -179.7 | 0 | 0 | 111.2 | R1665 N1666 I1673 I1697 R1701 | R1665-E1669 PolarHBondContact O-N 3.08Å; N1666-E1669 PolarHBondContact O-N 2.92Å; N1666-E1669 VanDerWaalsContact O-N 3.15Å; E1669-I1673 HydrophobicContact CG-CD1 4.31Å; E1669-I1673 WeakPolarHBondContact O-CD1 3.44Å; E1669-I1673 VanDerWaalsContact O-CG1 3.25Å; E1669-I1673 WeakPolarHBondContact O-CG1 3.43Å; E1669-I1673 PolarHBondContact O-N 2.93Å; E1669-I1673 VanDerWaalsContact O-N 3.14Å; E1669-I1697 HydrophobicContact CG-CG2 4.44Å; E1669-I1697 WeakPolarHBondContact OE1-CG2 3.1Å; E1669-R1701 IonicContact OE1-NE 3.49Å; E1669-R1701 PolarHBondContact OE1-NE 2.86Å; E1669-R1701 IonicContact OE2-CZ 2.68Å; E1669-R1701 IonicContact OE2-NE 3.64Å; E1669-R1701 IonicContact OE2-NH2 3.47Å; E1669-R1701 PolarHBondContact OE2-NH2 3.17Å |
| 1670 | E | 75.6 | Confident | 74 | Confident | 37 Ų | 37 | 68 Ų | 68 | 17% | 0.173 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -65.1 | -52.2 | 175.2 | -75.5 | 173 | -163 | 0 | 0 | 112.2 | G1601 A1602 E1603 N1666 A1667 Y1672 I1673 R1674 I1697 | G1601-E1670 WeakPolarHBondContact CA-OE2 3.5Å; A1602-E1670 WeakPolarHBondContact CA-OE2 3.46Å; A1602-E1670 VanDerWaalsContact CB-OE1 3.32Å; A1602-E1670 WeakPolarHBondContact CB-OE1 3.14Å; A1602-E1670 VanDerWaalsContact N-CD 3.27Å; A1602-E1670 PolarHBondContact N-OE1 3.31Å; A1602-E1670 PolarHBondContact N-OE2 3.28Å; E1603-E1670 HydrophobicContact CB-CB 4.44Å; E1603-E1670 PolarHBondContact N-OE2 3.27Å; N1666-E1670 WeakPolarHBondContact O-CB 3.21Å; N1666-E1670 WeakPolarHBondContact O-CG 2.81Å; N1666-E1670 PolarHBondContact O-N 3.28Å; A1667-E1670 PolarHBondContact O-N 3.24Å; E1670-Y1672 VanDerWaalsContact C-N 3.32Å; E1670-Y1672 PolarHBondContact O-N 2.91Å; E1670-I1673 CarbonylContact O-C 3.37Å; E1670-I1673 WeakPolarHBondContact O-CA 3.36Å; E1670-I1673 WeakPolarHBondContact O-CB 3.25Å; E1670-I1673 PolarHBondContact O-N 3.35Å; E1670-R1674 WeakPolarHBondContact O-CB 3.38Å; E1670-R1674 PolarHBondContact O-N 3.01Å; E1670-I1697 HydrophobicContact CG-CD1 4.11Å; E1670-I1697 HydrophobicContact CG-CG1 4.38Å |
| 1671 | N | 77.8 | Confident | 72.8 | Confident | 61 Ų | 61 | 68.8 Ų | 68.8 | 33% | 0.326 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60.1 | -41.2 | 178.3 | -171.4 | -18.2 | 0 | 0 | 0 | 111.5 | E1603 A1667 I1673 R1674 T1675 | E1603-N1671 VanDerWaalsContact OE1-CB 3.31Å; E1603-N1671 WeakPolarHBondContact OE1-CB 3.37Å; E1603-N1671 PolarHBondContact OE1-ND2 3.02Å; A1667-N1671 VanDerWaalsContact O-CB 3.28Å; A1667-N1671 WeakPolarHBondContact O-CB 3.24Å; A1667-N1671 PolarHBondContact O-N 3.29Å; N1671-I1673 VanDerWaalsContact C-N 3.26Å; N1671-I1673 PolarHBondContact O-N 3.4Å; N1671-R1674 WeakPolarHBondContact O-CB 3.45Å; N1671-R1674 PolarHBondContact O-N 3.37Å; N1671-R1674 VanDerWaalsContact O-N 3.12Å; N1671-T1675 PolarHBondContact O-N 3.44Å; N1671-T1675 PolarHBondContact O-OG1 2.68Å; N1671-T1675 WeakPolarHBondContact OD1-CG2 3.35Å |
| 1672 | Y | 73.8 | Confident | 71.8 | Confident | 149 Ų | 149 | 66.3 Ų | 66.3 | 58% | 0.584 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -62.8 | -28.7 | 174 | 177.8 | -101.8 | 0 | 0 | 0 | 113.5 | A1668 E1670 R1676 | A1668-Y1672 WeakPolarHBondContact O-CB 3.5Å; A1668-Y1672 PolarHBondContact O-N 2.96Å; A1668-Y1672 VanDerWaalsContact O-N 3.08Å; E1670-Y1672 VanDerWaalsContact C-N 3.32Å; E1670-Y1672 PolarHBondContact O-N 2.91Å; Y1672-R1676 PolarHBondContact OH-NH1 2.8Å |
| 1673 | I | 69.2 | Low | 70.7 | Confident | 30 Ų | 30 | 73.6 Ų | 73.6 | 15% | 0.154 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -78.2 | -41.6 | 171.2 | -68.9 | 162.4 | 0 | 0 | 0 | 110.4 | E1669 E1670 N1671 T1675 R1676 I1700 | E1669-I1673 HydrophobicContact CG-CD1 4.31Å; E1669-I1673 WeakPolarHBondContact O-CD1 3.44Å; E1669-I1673 VanDerWaalsContact O-CG1 3.25Å; E1669-I1673 WeakPolarHBondContact O-CG1 3.43Å; E1669-I1673 PolarHBondContact O-N 2.93Å; E1669-I1673 VanDerWaalsContact O-N 3.14Å; E1670-I1673 CarbonylContact O-C 3.37Å; E1670-I1673 WeakPolarHBondContact O-CA 3.36Å; E1670-I1673 WeakPolarHBondContact O-CB 3.25Å; E1670-I1673 PolarHBondContact O-N 3.35Å; N1671-I1673 VanDerWaalsContact C-N 3.26Å; N1671-I1673 PolarHBondContact O-N 3.4Å; I1673-T1675 VanDerWaalsContact C-N 3.34Å; I1673-T1675 PolarHBondContact O-N 2.9Å; I1673-R1676 WeakPolarHBondContact O-CB 3.48Å; I1673-R1676 PolarHBondContact O-N 2.81Å; I1673-I1700 HydrophobicContact CD1-CD1 4.12Å; I1673-I1700 HydrophobicContact CD1-CG2 4.17Å; I1673-I1700 HydrophobicContact CG2-CD1 4.08Å |
| 1674 | R | 69 | Low | 69.5 | Low | 50 Ų | 50 | 79 Ų | 79 | 19% | 0.189 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -62.7 | -34.2 | -178.3 | -174.3 | 171.1 | 71.3 | 85.7 | -6.2 | 113.7 | R1558 D1561 E1603 E1670 N1671 | R1558-R1674 VanDerWaalsContact NH1-CG 3.26Å; R1558-R1674 PolarHBondContact NH1-O 3.02Å; R1558-R1674 PolarHBondContact NH2-O 3.23Å; D1561-R1674 IonicContact OD1-CZ 3.8Å; D1561-R1674 IonicContact OD1-NH1 3.61Å; D1561-R1674 PolarHBondContact OD1-NH1 2.61Å; D1561-R1674 IonicContact OD1-NH2 2.67Å; D1561-R1674 PolarHBondContact OD1-NH2 2.9Å; D1561-R1674 IonicContact OD2-CZ 2.68Å; D1561-R1674 IonicContact OD2-NH1 2.71Å; D1561-R1674 PolarHBondContact OD2-NH1 2.76Å; E1603-R1674 VanDerWaalsContact CD-NE 3.28Å; E1603-R1674 IonicContact OE1-CZ 2.63Å; E1603-R1674 VanDerWaalsContact OE1-CZ 3.28Å; E1603-R1674 IonicContact OE1-NE 3.23Å; E1603-R1674 PolarHBondContact OE1-NE 2.99Å; E1603-R1674 IonicContact OE1-NH2 3.5Å; E1603-R1674 PolarHBondContact OE1-NH2 3.08Å; E1603-R1674 WeakPolarHBondContact OE2-CD 3.49Å; E1603-R1674 IonicContact OE2-CZ 3.52Å; E1603-R1674 IonicContact OE2-NE 2.64Å; E1603-R1674 PolarHBondContact OE2-NE 3.29Å; E1603-R1674 IonicContact OE2-NH2 2.71Å; E1670-R1674 WeakPolarHBondContact O-CB 3.38Å; E1670-R1674 PolarHBondContact O-N 3.01Å; N1671-R1674 WeakPolarHBondContact O-CB 3.45Å; N1671-R1674 PolarHBondContact O-N 3.37Å; N1671-R1674 VanDerWaalsContact O-N 3.12Å |
| 1675 | T | 68 | Low | 68.3 | Low | 94 Ų | 94 | 77.8 Ų | 77.8 | 58% | 0.577 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.3 | -6.6 | 178.7 | 48.7 | 0 | 0 | 0 | 0 | 113.9 | N1671 I1673 | N1671-T1675 PolarHBondContact O-N 3.44Å; N1671-T1675 PolarHBondContact O-OG1 2.68Å; N1671-T1675 WeakPolarHBondContact OD1-CG2 3.35Å; I1673-T1675 VanDerWaalsContact C-N 3.34Å; I1673-T1675 PolarHBondContact O-N 2.9Å |
| 1676 | R | 66.6 | Low | 67.1 | Low | 105 Ų | 105 | 75.1 Ų | 75.1 | 40% | 0.396 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -76.5 | 131.5 | -175.5 | -163.8 | 180 | -168.5 | 112.9 | 15.5 | 112.3 | Y1672 I1673 E1680 | Y1672-R1676 PolarHBondContact OH-NH1 2.8Å; I1673-R1676 WeakPolarHBondContact O-CB 3.48Å; I1673-R1676 PolarHBondContact O-N 2.81Å; R1676-E1680 IonicContact CZ-OE2 3.94Å; R1676-E1680 IonicContact NE-OE2 2.57Å; R1676-E1680 PolarHBondContact NE-OE2 3.29Å; R1676-E1680 IonicContact NH2-OE2 3.42Å; R1676-E1680 PolarHBondContact NH2-OE2 2.65Å |
| 1677 | S | 52.5 | Low | 65.8 | Low | 68 Ų | 68 | 79.4 Ų | 79.4 | 48% | 0.476 | 39% | 0.391 | S | S | . | . | trans | -60.3 | 139.9 | -171.7 | 88 | 0 | 0 | 0 | 0 | 114.4 | K1679 E1680 | S1677-K1679 PolarHBondContact O-N 3.33Å; S1677-E1680 PolarHBondContact O-N 3.24Å; S1677-E1680 VanDerWaalsContact O-N 3.1Å | ||
| 1678 | A | 56 | Low | 64.7 | Low | 67 Ų | 67 | 81 Ų | 81 | 55% | 0.554 | 40% | 0.395 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | -6.7 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | K1686 | A1678-K1686 WeakPolarHBondContact O-CE 3.48Å; A1678-K1686 PolarHBondContact O-NZ 2.88Å |
| 1679 | K | 55.6 | Low | 63.5 | Low | 199 Ų | 199 | 80.4 Ų | 80.4 | 87% | 0.865 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -25.6 | 175 | -70.9 | 177.9 | -180 | 171.5 | 0 | 113.1 | S1677 | S1677-K1679 PolarHBondContact O-N 3.33Š|
| 1680 | E | 58.1 | Low | 62.3 | Low | 117 Ų | 117 | 87.8 Ų | 87.8 | 55% | 0.547 | 41% | 0.408 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.1 | -22.8 | -176.2 | -65.9 | -152.2 | 133.8 | 0 | 0 | 115.1 | R1676 S1677 | R1676-E1680 IonicContact CZ-OE2 3.94Å; R1676-E1680 IonicContact NE-OE2 2.57Å; R1676-E1680 PolarHBondContact NE-OE2 3.29Å; R1676-E1680 IonicContact NH2-OE2 3.42Å; R1676-E1680 PolarHBondContact NH2-OE2 2.65Å; S1677-E1680 PolarHBondContact O-N 3.24Å; S1677-E1680 VanDerWaalsContact O-N 3.1Å |
| 1681 | L | 59.8 | Low | 61.1 | Low | 23 Ų | 23 | 90.9 Ų | 90.9 | 12% | 0.12 | 43% | 0.43 | C | S | . | . | trans | -77.3 | 131.8 | -173.2 | -66.7 | 149.5 | 0 | 0 | 0 | 110.8 | E1685 K1686 L1689 | L1681-E1685 WeakPolarHBondContact CA-OE2 3.18Å; L1681-E1685 HydrophobicContact CB-CB 4.12Å; L1681-E1685 HydrophobicContact CD2-CB 3.78Å; L1681-E1685 HydrophobicContact CD2-CG 4.47Å; L1681-K1686 HydrophobicContact CB-CG 3.91Å; L1681-K1686 WeakPolarHBondContact O-CE 3.39Å; L1681-K1686 PolarHBondContact O-NZ 3.26Å; L1681-L1689 HydrophobicContact CD1-CD1 3.55Å; L1681-L1689 HydrophobicContact CD2-CD1 4.03Å; L1681-L1689 HydrophobicContact CG-CD1 4.36Å | ||
| 1682 | C | 63.4 | Low | 59.9 | Low | 35 Ų | 35 | 96.4 Ų | 96.4 | 24% | 0.236 | 45% | 0.446 | C | S | . | . | trans | -73.9 | 173.1 | 175.9 | 69.7 | 0 | 0 | 0 | 0 | 111.3 | E1684 E1685 K1686 | C1682-E1684 VanDerWaalsContact C-N 3.27Å; C1682-E1684 PolarHBondContact O-N 3.06Å; C1682-E1684 PolarHBondContact SG-OE2 2.87Å; C1682-E1685 PolarHBondContact N-OE2 3.38Å; C1682-E1685 PolarHBondContact O-N 3.42Å; C1682-E1685 PolarHBondContact SG-OE2 2.71Å; C1682-K1686 WeakPolarHBondContact O-CG 3.24Å; C1682-K1686 PolarHBondContact O-N 2.97Å | ||
| 1683 | R | 61 | Low | 58.7 | Low | 186 Ų | 186 | 93.9 Ų | 93.9 | 70% | 0.702 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -59.1 | -43.3 | -173.4 | -172.1 | 176.9 | -174.1 | 163.2 | 5.7 | 111.2 | E1685 K1686 E1687 | R1683-E1685 PolarHBondContact O-N 2.57Å; R1683-K1686 WeakPolarHBondContact O-CB 3.41Å; R1683-K1686 PolarHBondContact O-N 3.03Å; R1683-E1687 IonicContact NE-OE2 3.81Å; R1683-E1687 WeakPolarHBondContact O-CB 3.3Å; R1683-E1687 PolarHBondContact O-N 3.25Å |
| 1684 | E | 60.8 | Low | 57.7 | Low | 112 Ų | 112 | 94.4 Ų | 94.4 | 52% | 0.523 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -65.8 | -37.1 | -179.7 | -54.7 | 74 | -163.5 | 0 | 0 | 112.1 | C1682 W1688 L1703 | C1682-E1684 VanDerWaalsContact C-N 3.27Å; C1682-E1684 PolarHBondContact O-N 3.06Å; C1682-E1684 PolarHBondContact SG-OE2 2.87Å; E1684-W1688 VanDerWaalsContact O-CB 3.24Å; E1684-W1688 WeakPolarHBondContact O-CB 3.48Å; E1684-W1688 PolarHBondContact O-N 2.78Å; E1684-L1703 HydrophobicContact CB-CD1 4.46Å |
| 1685 | E | 59.3 | Low | 56.7 | Low | 18 Ų | 18 | 92.6 Ų | 92.6 | 8% | 0.084 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -72.5 | -32.2 | 175.6 | -69.7 | 164 | 163.2 | 0 | 0 | 111.7 | L1681 C1682 R1683 L1689 L1703 K1707 | L1681-E1685 WeakPolarHBondContact CA-OE2 3.18Å; L1681-E1685 HydrophobicContact CB-CB 4.12Å; L1681-E1685 HydrophobicContact CD2-CB 3.78Å; L1681-E1685 HydrophobicContact CD2-CG 4.47Å; C1682-E1685 PolarHBondContact N-OE2 3.38Å; C1682-E1685 PolarHBondContact O-N 3.42Å; C1682-E1685 PolarHBondContact SG-OE2 2.71Å; R1683-E1685 PolarHBondContact O-N 2.57Å; E1685-L1689 WeakPolarHBondContact O-CB 3.45Å; E1685-L1689 WeakPolarHBondContact O-CG 3.5Å; E1685-L1689 PolarHBondContact O-N 3.45Å; E1685-L1703 HydrophobicContact CG-CD1 4.15Å; E1685-K1707 WeakPolarHBondContact OE1-CE 3.41Å; E1685-K1707 IonicContact OE1-NZ 3.35Å; E1685-K1707 PolarHBondContact OE1-NZ 3.05Å; E1685-K1707 IonicContact OE2-NZ 3.18Å; E1685-K1707 PolarHBondContact OE2-NZ 3.41Å |
| 1686 | K | 59.6 | Low | 55.9 | Low | 87 Ų | 87 | 91.3 Ų | 91.3 | 38% | 0.378 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -71.9 | -45.5 | 172.7 | -75 | 170 | 171 | 160.4 | 0 | 112.3 | A1678 L1681 C1682 R1683 W1688 L1689 R1690 | A1678-K1686 WeakPolarHBondContact O-CE 3.48Å; A1678-K1686 PolarHBondContact O-NZ 2.88Å; L1681-K1686 HydrophobicContact CB-CG 3.91Å; L1681-K1686 WeakPolarHBondContact O-CE 3.39Å; L1681-K1686 PolarHBondContact O-NZ 3.26Å; C1682-K1686 WeakPolarHBondContact O-CG 3.24Å; C1682-K1686 PolarHBondContact O-N 2.97Å; R1683-K1686 WeakPolarHBondContact O-CB 3.41Å; R1683-K1686 PolarHBondContact O-N 3.03Å; K1686-W1688 VanDerWaalsContact C-N 3.25Å; K1686-W1688 PolarHBondContact O-N 2.82Å; K1686-L1689 PolarHBondContact O-N 3.15Å; K1686-R1690 WeakPolarHBondContact O-CB 3.48Å; K1686-R1690 PolarHBondContact O-N 2.78Å |
| 1687 | E | 54.7 | Low | 55.3 | Low | 96 Ų | 96 | 86.7 Ų | 86.7 | 45% | 0.449 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -59.6 | -40 | 174.6 | -131.5 | 79.5 | -138.4 | 0 | 0 | 110.2 | R1683 R1690 T1691 | R1683-E1687 IonicContact NE-OE2 3.81Å; R1683-E1687 WeakPolarHBondContact O-CB 3.3Å; R1683-E1687 PolarHBondContact O-N 3.25Å; E1687-R1690 PolarHBondContact O-N 2.78Å; E1687-T1691 WeakPolarHBondContact O-CB 3.37Å; E1687-T1691 VanDerWaalsContact O-CG2 3.31Å; E1687-T1691 WeakPolarHBondContact O-CG2 3.32Å; E1687-T1691 PolarHBondContact O-N 3.27Å; E1687-T1691 PolarHBondContact O-OG1 3.2Å |
| 1688 | W | 60.2 | Low | 55.5 | Low | 40 Ų | 40 | 85.9 Ų | 85.9 | 15% | 0.152 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.7 | -56.9 | 174.7 | -173.4 | 88.6 | 0 | 0 | 0 | 112 | E1684 K1686 R1690 T1691 R1692 G1695 F1699 I1700 | E1684-W1688 VanDerWaalsContact O-CB 3.24Å; E1684-W1688 WeakPolarHBondContact O-CB 3.48Å; E1684-W1688 PolarHBondContact O-N 2.78Å; K1686-W1688 VanDerWaalsContact C-N 3.25Å; K1686-W1688 PolarHBondContact O-N 2.82Å; W1688-R1690 PolarHBondContact O-N 2.93Å; W1688-R1690 VanDerWaalsContact O-N 3.14Å; W1688-T1691 PolarHBondContact O-N 3.03Å; W1688-T1691 VanDerWaalsContact O-N 3.08Å; W1688-T1691 PolarHBondContact O-OG1 3.49Å; W1688-R1692 CarbonylContact O-C 3.48Å; W1688-R1692 PolarHBondContact O-N 3.49Å; W1688-G1695 VanDerWaalsContact CZ2-O 3.25Å; W1688-G1695 WeakPolarHBondContact CZ2-O 3.43Å; W1688-F1699 AromaticContact CD1-CD1 3.42Å; W1688-F1699 VanDerWaalsContact CD1-CD1 3.42Å; W1688-F1699 AromaticContact CD1-CE1 3.64Å; W1688-F1699 HydrophobicContact CG-CD1 4.1Å; W1688-F1699 HydrophobicContact CG-CE1 4.19Å; W1688-F1699 AromaticContact NE1-CD1 3.48Å; W1688-I1700 HydrophobicContact CD2-CD1 4.48Å; W1688-I1700 HydrophobicContact CE3-CD1 3.92Å; W1688-I1700 HydrophobicContact CH2-CD1 3.63Å; W1688-I1700 HydrophobicContact CH2-CG1 4.31Å; W1688-I1700 HydrophobicContact CZ2-CD1 4.18Å; W1688-I1700 HydrophobicContact CZ2-CG1 4.37Å; W1688-I1700 HydrophobicContact CZ3-CD1 3.49Å; W1688-I1700 VanDerWaalsContact CZ3-CD1 3.49Å; W1688-I1700 HydrophobicContact CZ3-CG1 4.42Å |
| 1689 | L | 55.5 | Low | 55.4 | Low | 50 Ų | 50 | 87.3 Ų | 87.3 | 26% | 0.262 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -57.4 | -30 | 177.1 | -76.8 | 168.7 | 0 | 0 | 0 | 113.1 | L1681 E1685 K1686 | L1681-L1689 HydrophobicContact CD1-CD1 3.55Å; L1681-L1689 HydrophobicContact CD2-CD1 4.03Å; L1681-L1689 HydrophobicContact CG-CD1 4.36Å; E1685-L1689 WeakPolarHBondContact O-CB 3.45Å; E1685-L1689 WeakPolarHBondContact O-CG 3.5Å; E1685-L1689 PolarHBondContact O-N 3.45Å; K1686-L1689 PolarHBondContact O-N 3.15Å |
| 1690 | R | 51.4 | Low | 55.4 | Low | 220 Ų | 220 | 78.9 Ų | 78.9 | 83% | 0.83 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -84.3 | -18.8 | -179.8 | -169.1 | 172.5 | -169.3 | 158.8 | 8.4 | 114.2 | K1686 E1687 W1688 | K1686-R1690 WeakPolarHBondContact O-CB 3.48Å; K1686-R1690 PolarHBondContact O-N 2.78Å; E1687-R1690 PolarHBondContact O-N 2.78Å; W1688-R1690 PolarHBondContact O-N 2.93Å; W1688-R1690 VanDerWaalsContact O-N 3.14Å |
| 1691 | T | 49.8 | Very low | 55.5 | Low | 101 Ų | 101 | 77 Ų | 77 | 62% | 0.62 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -110.7 | -29 | -177.6 | 54 | 0 | 0 | 0 | 0 | 113.7 | E1687 W1688 | E1687-T1691 WeakPolarHBondContact O-CB 3.37Å; E1687-T1691 VanDerWaalsContact O-CG2 3.31Å; E1687-T1691 WeakPolarHBondContact O-CG2 3.32Å; E1687-T1691 PolarHBondContact O-N 3.27Å; E1687-T1691 PolarHBondContact O-OG1 3.2Å; W1688-T1691 PolarHBondContact O-N 3.03Å; W1688-T1691 VanDerWaalsContact O-N 3.08Å; W1688-T1691 PolarHBondContact O-OG1 3.49Å |
| 1692 | R | 53.1 | Low | 55.4 | Low | 178 Ų | 178 | 82.5 Ų | 82.5 | 67% | 0.672 | 39% | 0.385 | S | S | * | . | trans | -150.6 | 101.5 | 173.2 | -62.4 | -171.6 | -174.1 | -150.9 | -3.3 | 109.6 | W1688 T1694 | W1688-R1692 CarbonylContact O-C 3.48Å; W1688-R1692 PolarHBondContact O-N 3.49Å; R1692-T1694 PolarHBondContact O-N 3.43Å | ||
| 1693 | P | 49.3 | Very low | 55.1 | Low | 96 Ų | 96 | 82 Ų | 82 | 62% | 0.623 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -16.8 | 178.8 | -25.2 | 35.4 | 0 | 0 | 0 | 114.7 | ||
| 1694 | T | 47.5 | Very low | 54.9 | Low | 41 Ų | 41 | 75.8 Ų | 75.8 | 25% | 0.252 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -134.2 | 22.9 | -161 | 48 | 0 | 0 | 0 | 0 | 113.7 | G1599 R1692 | G1599-T1694 VanDerWaalsContact C-CG2 3.41Å; G1599-T1694 WeakPolarHBondContact O-CB 3.29Å; G1599-T1694 VanDerWaalsContact O-CG2 3.26Å; G1599-T1694 WeakPolarHBondContact O-CG2 3.39Å; G1599-T1694 PolarHBondContact O-OG1 3.3Å; R1692-T1694 PolarHBondContact O-N 3.43Å |
| 1695 | G | 48.9 | Very low | 55 | Low | 12 Ų | 12 | 73.9 Ų | 73.9 | 12% | 0.124 | 36% | 0.359 | C | S | . | . | trans | -58.6 | 155.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112 | W1688 I1697 | W1688-G1695 VanDerWaalsContact CZ2-O 3.25Å; W1688-G1695 WeakPolarHBondContact CZ2-O 3.43Å; G1695-I1697 PolarHBondContact O-N 3.32Å | ||
| 1696 | P | 51.2 | Low | 55.1 | Low | 66 Ų | 66 | 78.2 Ų | 78.2 | 43% | 0.429 | 38% | 0.382 | S | S | . | . | trans | -60.1 | 129.5 | -176.3 | 22.4 | -33.3 | 0 | 0 | 0 | 111.8 | N1698 F1699 | P1696-N1698 PolarHBondContact O-N 2.86Å; P1696-F1699 PolarHBondContact O-N 3.36Å | ||
| 1697 | I | 53.4 | Low | 55 | Low | 9 Ų | 9 | 76.8 Ų | 76.8 | 5% | 0.046 | 38% | 0.375 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -45.7 | -29.9 | -179.8 | -59.9 | 172.2 | 0 | 0 | 0 | 112.3 | N1666 E1669 E1670 G1695 F1699 I1700 R1701 | N1666-I1697 HydrophobicContact CB-CD1 4.01Å; E1669-I1697 HydrophobicContact CG-CG2 4.44Å; E1669-I1697 WeakPolarHBondContact OE1-CG2 3.1Å; E1670-I1697 HydrophobicContact CG-CD1 4.11Å; E1670-I1697 HydrophobicContact CG-CG1 4.38Å; G1695-I1697 PolarHBondContact O-N 3.32Å; I1697-F1699 PolarHBondContact O-N 3.24Å; I1697-F1699 VanDerWaalsContact O-N 3.11Å; I1697-I1700 CarbonylContact O-C 3.51Å; I1697-I1700 PolarHBondContact O-N 3.35Å; I1697-R1701 HydrophobicContact CG2-CG 3.97Å; I1697-R1701 PolarHBondContact O-N 3.45Å |
| 1698 | N | 56.8 | Low | 55.4 | Low | 51 Ų | 51 | 77.4 Ų | 77.4 | 27% | 0.273 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -56.9 | -20.5 | 174.8 | -73 | -38 | 0 | 0 | 0 | 115.1 | D1646 P1696 R1701 K1702 | D1646-N1698 PolarHBondContact OD1-ND2 2.79Å; D1646-N1698 VanDerWaalsContact OD1-ND2 3.14Å; D1646-N1698 PolarHBondContact OD2-ND2 2.9Å; P1696-N1698 PolarHBondContact O-N 2.86Å; N1698-R1701 PolarHBondContact OD1-NH1 3.44Å; N1698-K1702 WeakPolarHBondContact O-CB 3.43Å; N1698-K1702 WeakPolarHBondContact O-CD 3.32Å; N1698-K1702 WeakPolarHBondContact O-CG 3.22Å; N1698-K1702 PolarHBondContact O-N 3.33Å; N1698-K1702 VanDerWaalsContact O-N 3.12Å |
| 1699 | F | 54.4 | Low | 55.6 | Low | 96 Ų | 96 | 79.5 Ų | 79.5 | 42% | 0.421 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -72.1 | -49.4 | 167.1 | -174.2 | -112 | 0 | 0 | 0 | 111.6 | W1688 P1696 I1697 R1701 K1702 L1703 | W1688-F1699 AromaticContact CD1-CD1 3.42Å; W1688-F1699 VanDerWaalsContact CD1-CD1 3.42Å; W1688-F1699 AromaticContact CD1-CE1 3.64Å; W1688-F1699 HydrophobicContact CG-CD1 4.1Å; W1688-F1699 HydrophobicContact CG-CE1 4.19Å; W1688-F1699 AromaticContact NE1-CD1 3.48Å; P1696-F1699 PolarHBondContact O-N 3.36Å; I1697-F1699 PolarHBondContact O-N 3.24Å; I1697-F1699 VanDerWaalsContact O-N 3.11Å; F1699-R1701 PolarHBondContact O-N 2.9Å; F1699-K1702 CarbonylContact O-C 3.6Å; F1699-K1702 WeakPolarHBondContact O-CB 3.3Å; F1699-K1702 PolarHBondContact O-N 3.33Å; F1699-K1702 VanDerWaalsContact O-N 3.16Å; F1699-L1703 HydrophobicContact CD1-CD1 4.33Å; F1699-L1703 HydrophobicContact CE1-CD1 3.66Å; F1699-L1703 HydrophobicContact CZ-CD1 3.88Å; F1699-L1703 WeakPolarHBondContact O-CB 3.35Å; F1699-L1703 PolarHBondContact O-N 3.28Å |
| 1700 | I | 55.8 | Low | 55.8 | Low | 22 Ų | 22 | 83.3 Ų | 83.3 | 11% | 0.113 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -65.8 | -36.1 | 176.6 | -70.8 | -179.3 | 0 | 0 | 0 | 111.6 | I1673 W1688 I1697 L1703 T1704 | I1673-I1700 HydrophobicContact CD1-CD1 4.12Å; I1673-I1700 HydrophobicContact CD1-CG2 4.17Å; I1673-I1700 HydrophobicContact CG2-CD1 4.08Å; W1688-I1700 HydrophobicContact CD2-CD1 4.48Å; W1688-I1700 HydrophobicContact CE3-CD1 3.92Å; W1688-I1700 HydrophobicContact CH2-CD1 3.63Å; W1688-I1700 HydrophobicContact CH2-CG1 4.31Å; W1688-I1700 HydrophobicContact CZ2-CD1 4.18Å; W1688-I1700 HydrophobicContact CZ2-CG1 4.37Å; W1688-I1700 HydrophobicContact CZ3-CD1 3.49Å; W1688-I1700 VanDerWaalsContact CZ3-CD1 3.49Å; W1688-I1700 HydrophobicContact CZ3-CG1 4.42Å; I1697-I1700 CarbonylContact O-C 3.51Å; I1697-I1700 PolarHBondContact O-N 3.35Å; I1700-L1703 PolarHBondContact O-N 3.07Å; I1700-T1704 WeakPolarHBondContact O-CB 3.28Å; I1700-T1704 PolarHBondContact O-N 3.4Å; I1700-T1704 PolarHBondContact O-OG1 2.89Å |
| 1701 | R | 59.9 | Low | 56.3 | Low | 77 Ų | 77 | 80.8 Ų | 80.8 | 29% | 0.291 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.3 | -40.4 | 171.2 | -71 | 174.4 | -172.8 | 157.2 | 0.2 | 111.6 | D1646 E1669 I1697 N1698 F1699 T1705 | D1646-R1701 IonicContact OD2-NH1 2.7Å; D1646-R1701 PolarHBondContact OD2-NH1 2.9Å; E1669-R1701 IonicContact OE1-NE 3.49Å; E1669-R1701 PolarHBondContact OE1-NE 2.86Å; E1669-R1701 IonicContact OE2-CZ 2.68Å; E1669-R1701 IonicContact OE2-NE 3.64Å; E1669-R1701 IonicContact OE2-NH2 3.47Å; E1669-R1701 PolarHBondContact OE2-NH2 3.17Å; I1697-R1701 HydrophobicContact CG2-CG 3.97Å; I1697-R1701 PolarHBondContact O-N 3.45Å; N1698-R1701 PolarHBondContact OD1-NH1 3.44Å; F1699-R1701 PolarHBondContact O-N 2.9Å; R1701-T1705 VanDerWaalsContact O-CB 3.27Å; R1701-T1705 WeakPolarHBondContact O-CB 3.4Å; R1701-T1705 PolarHBondContact O-N 2.87Å; R1701-T1705 PolarHBondContact O-OG1 3.32Å |
| 1702 | K | 58.6 | Low | 57 | Low | 139 Ų | 139 | 82.1 Ų | 82.1 | 60% | 0.604 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -64.5 | -47 | 171.9 | -78.4 | 169.2 | -176.2 | 170 | 0 | 111.7 | N1698 F1699 T1704 T1705 I1706 | N1698-K1702 WeakPolarHBondContact O-CB 3.43Å; N1698-K1702 WeakPolarHBondContact O-CD 3.32Å; N1698-K1702 WeakPolarHBondContact O-CG 3.22Å; N1698-K1702 PolarHBondContact O-N 3.33Å; N1698-K1702 VanDerWaalsContact O-N 3.12Å; F1699-K1702 CarbonylContact O-C 3.6Å; F1699-K1702 WeakPolarHBondContact O-CB 3.3Å; F1699-K1702 PolarHBondContact O-N 3.33Å; F1699-K1702 VanDerWaalsContact O-N 3.16Å; K1702-T1704 VanDerWaalsContact C-N 3.35Å; K1702-T1704 PolarHBondContact O-N 3.31Å; K1702-T1705 CarbonylContact O-C 3.58Å; K1702-T1705 PolarHBondContact O-N 3.3Å; K1702-I1706 WeakPolarHBondContact O-CB 3.38Å; K1702-I1706 VanDerWaalsContact O-CG1 3.24Å; K1702-I1706 WeakPolarHBondContact O-CG1 3.35Å; K1702-I1706 PolarHBondContact O-N 3.04Å |
| 1703 | L | 55.9 | Low | 57.4 | Low | 24 Ų | 24 | 80.7 Ų | 80.7 | 13% | 0.126 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -65.6 | -36.3 | 179.4 | -129.4 | 167.1 | 0 | 0 | 0 | 111.9 | E1684 E1685 F1699 I1700 I1706 K1707 | E1684-L1703 HydrophobicContact CB-CD1 4.46Å; E1685-L1703 HydrophobicContact CG-CD1 4.15Å; F1699-L1703 HydrophobicContact CD1-CD1 4.33Å; F1699-L1703 HydrophobicContact CE1-CD1 3.66Å; F1699-L1703 HydrophobicContact CZ-CD1 3.88Å; F1699-L1703 WeakPolarHBondContact O-CB 3.35Å; F1699-L1703 PolarHBondContact O-N 3.28Å; I1700-L1703 PolarHBondContact O-N 3.07Å; L1703-I1706 CarbonylContact O-C 3.46Å; L1703-I1706 PolarHBondContact O-N 3.01Å; L1703-K1707 HydrophobicContact CD2-CG 4.49Å; L1703-K1707 WeakPolarHBondContact O-CB 3.49Å; L1703-K1707 WeakPolarHBondContact O-CG 3.28Å; L1703-K1707 PolarHBondContact O-N 3.29Å |
| 1704 | T | 57.7 | Low | 57.9 | Low | 57 Ų | 57 | 80.5 Ų | 80.5 | 35% | 0.35 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -69.4 | -40.6 | 172.9 | -62.1 | 0 | 0 | 0 | 0 | 111.3 | I1700 K1702 I1706 K1707 Q1708 | I1700-T1704 WeakPolarHBondContact O-CB 3.28Å; I1700-T1704 PolarHBondContact O-N 3.4Å; I1700-T1704 PolarHBondContact O-OG1 2.89Å; K1702-T1704 VanDerWaalsContact C-N 3.35Å; K1702-T1704 PolarHBondContact O-N 3.31Å; T1704-I1706 VanDerWaalsContact C-N 3.35Å; T1704-K1707 CarbonylContact O-C 3.5Å; T1704-K1707 PolarHBondContact O-N 3Å; T1704-Q1708 WeakPolarHBondContact O-CB 3.35Å; T1704-Q1708 WeakPolarHBondContact O-CG 3.44Å; T1704-Q1708 PolarHBondContact O-N 2.82Å |
| 1705 | T | 62 | Low | 58.5 | Low | 72 Ų | 72 | 85 Ų | 85 | 44% | 0.442 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.1 | -39.5 | 173.2 | -58.8 | 0 | 0 | 0 | 0 | 111.1 | R1701 K1702 Q1708 N1709 | R1701-T1705 VanDerWaalsContact O-CB 3.27Å; R1701-T1705 WeakPolarHBondContact O-CB 3.4Å; R1701-T1705 PolarHBondContact O-N 2.87Å; R1701-T1705 PolarHBondContact O-OG1 3.32Å; K1702-T1705 CarbonylContact O-C 3.58Å; K1702-T1705 PolarHBondContact O-N 3.3Å; T1705-Q1708 PolarHBondContact O-N 3.16Å; T1705-N1709 WeakPolarHBondContact O-CB 3.46Å; T1705-N1709 VanDerWaalsContact O-CG 3.27Å; T1705-N1709 PolarHBondContact O-N 2.96Å; T1705-N1709 PolarHBondContact O-ND2 3Å |
| 1706 | I | 62 | Low | 59 | Low | 109 Ų | 109 | 89.9 Ų | 89.9 | 56% | 0.559 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -66.6 | -42.5 | 172.9 | -69.8 | 163.4 | 0 | 0 | 0 | 110.4 | K1702 L1703 T1704 Q1708 N1709 Y1710 | K1702-I1706 WeakPolarHBondContact O-CB 3.38Å; K1702-I1706 VanDerWaalsContact O-CG1 3.24Å; K1702-I1706 WeakPolarHBondContact O-CG1 3.35Å; K1702-I1706 PolarHBondContact O-N 3.04Å; L1703-I1706 CarbonylContact O-C 3.46Å; L1703-I1706 PolarHBondContact O-N 3.01Å; T1704-I1706 VanDerWaalsContact C-N 3.35Å; I1706-Q1708 VanDerWaalsContact C-N 3.35Å; I1706-Q1708 PolarHBondContact O-N 2.76Å; I1706-N1709 PolarHBondContact O-N 3.41Å; I1706-Y1710 WeakPolarHBondContact O-CA 3.48Å; I1706-Y1710 WeakPolarHBondContact O-CB 3.37Å; I1706-Y1710 PolarHBondContact O-N 3.45Å |
| 1707 | K | 56.8 | Low | 59.3 | Low | 57 Ų | 57 | 89.4 Ų | 89.4 | 25% | 0.248 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -63.5 | -36.1 | 172.1 | -84.9 | -178.9 | 175.1 | 177.4 | 0 | 112 | E1685 L1703 T1704 R1711 | E1685-K1707 WeakPolarHBondContact OE1-CE 3.41Å; E1685-K1707 IonicContact OE1-NZ 3.35Å; E1685-K1707 PolarHBondContact OE1-NZ 3.05Å; E1685-K1707 IonicContact OE2-NZ 3.18Å; E1685-K1707 PolarHBondContact OE2-NZ 3.41Å; L1703-K1707 HydrophobicContact CD2-CG 4.49Å; L1703-K1707 WeakPolarHBondContact O-CB 3.49Å; L1703-K1707 WeakPolarHBondContact O-CG 3.28Å; L1703-K1707 PolarHBondContact O-N 3.29Å; T1704-K1707 CarbonylContact O-C 3.5Å; T1704-K1707 PolarHBondContact O-N 3Å; K1707-R1711 WeakPolarHBondContact O-CB 3.4Å; K1707-R1711 WeakPolarHBondContact O-CD 3.15Å; K1707-R1711 WeakPolarHBondContact O-CG 3.3Å; K1707-R1711 PolarHBondContact O-N 2.81Å |
| 1708 | Q | 62.5 | Low | 59.5 | Low | 108 Ų | 108 | 93.7 Ų | 93.7 | 51% | 0.505 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -69.8 | -42.8 | 173.9 | -76.1 | -170.5 | 22.7 | 0 | 0 | 111.6 | T1704 T1705 I1706 R1711 K1712 | T1704-Q1708 WeakPolarHBondContact O-CB 3.35Å; T1704-Q1708 WeakPolarHBondContact O-CG 3.44Å; T1704-Q1708 PolarHBondContact O-N 2.82Å; T1705-Q1708 PolarHBondContact O-N 3.16Å; I1706-Q1708 VanDerWaalsContact C-N 3.35Å; I1706-Q1708 PolarHBondContact O-N 2.76Å; Q1708-R1711 PolarHBondContact O-N 3.49Å; Q1708-K1712 WeakPolarHBondContact O-CB 3.28Å; Q1708-K1712 WeakPolarHBondContact O-CG 3.5Å; Q1708-K1712 PolarHBondContact O-N 2.93Å |
| 1709 | N | 65.6 | Low | 59.5 | Low | 85 Ų | 85 | 100.4 Ų | 100.4 | 46% | 0.455 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -69.5 | -37 | 176.8 | -72.9 | -21.4 | 0 | 0 | 0 | 111.8 | T1705 I1706 K1712 W1713 | T1705-N1709 WeakPolarHBondContact O-CB 3.46Å; T1705-N1709 VanDerWaalsContact O-CG 3.27Å; T1705-N1709 PolarHBondContact O-N 2.96Å; T1705-N1709 PolarHBondContact O-ND2 3Å; I1706-N1709 PolarHBondContact O-N 3.41Å; N1709-K1712 PolarHBondContact O-N 3.41Å; N1709-W1713 VanDerWaalsContact O-CB 3.25Å; N1709-W1713 WeakPolarHBondContact O-CB 3.38Å; N1709-W1713 PolarHBondContact O-N 3.42Å |
| 1710 | Y | 60.4 | Low | 59.2 | Low | 129 Ų | 129 | 97.6 Ų | 97.6 | 51% | 0.506 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -69.7 | -36.3 | 170.8 | -178 | -96.5 | 0 | 0 | 0 | 111.6 | I1706 W1713 K1714 | I1706-Y1710 WeakPolarHBondContact O-CA 3.48Å; I1706-Y1710 WeakPolarHBondContact O-CB 3.37Å; I1706-Y1710 PolarHBondContact O-N 3.45Å; Y1710-W1713 HydrophobicContact CD2-CE3 4.16Å; Y1710-W1713 HydrophobicContact CE2-CE3 4.01Å; Y1710-W1713 HydrophobicContact CE2-CZ3 4.05Å; Y1710-W1713 PolarHBondContact O-N 2.97Å; Y1710-K1714 HydrophobicContact CE1-CB 4.4Å; Y1710-K1714 HydrophobicContact CE1-CD 4.01Å; Y1710-K1714 WeakPolarHBondContact O-CA 3.42Å; Y1710-K1714 WeakPolarHBondContact O-CB 3.28Å; Y1710-K1714 PolarHBondContact O-N 3.18Å |
| 1711 | R | 60.5 | Low | 58.9 | Low | 168 Ų | 168 | 99.3 Ų | 99.3 | 63% | 0.634 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -68.5 | -33.4 | 170.9 | -77.2 | 168.4 | 176.9 | -172.9 | -0.9 | 111.9 | K1707 Q1708 K1715 | K1707-R1711 WeakPolarHBondContact O-CB 3.4Å; K1707-R1711 WeakPolarHBondContact O-CD 3.15Å; K1707-R1711 WeakPolarHBondContact O-CG 3.3Å; K1707-R1711 PolarHBondContact O-N 2.81Å; Q1708-R1711 PolarHBondContact O-N 3.49Å; R1711-K1715 VanDerWaalsContact O-CB 3.26Å; R1711-K1715 WeakPolarHBondContact O-CB 3.2Å; R1711-K1715 VanDerWaalsContact O-CG 3.24Å; R1711-K1715 WeakPolarHBondContact O-CG 3.28Å; R1711-K1715 PolarHBondContact O-N 3.33Å |
| 1712 | K | 64.4 | Low | 58.5 | Low | 128 Ų | 128 | 98 Ų | 98 | 56% | 0.557 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -67.6 | -47.6 | 170 | -77.7 | 172.7 | 179.8 | 170 | 0 | 111.2 | Q1708 N1709 K1715 L1716 | Q1708-K1712 WeakPolarHBondContact O-CB 3.28Å; Q1708-K1712 WeakPolarHBondContact O-CG 3.5Å; Q1708-K1712 PolarHBondContact O-N 2.93Å; N1709-K1712 PolarHBondContact O-N 3.41Å; K1712-K1715 PolarHBondContact O-N 2.93Å; K1712-L1716 WeakPolarHBondContact O-CB 3.32Å; K1712-L1716 PolarHBondContact O-N 2.81Å |
| 1713 | W | 62.7 | Low | 57.9 | Low | 149 Ų | 149 | 94.6 Ų | 94.6 | 56% | 0.564 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -64 | -45.3 | 178 | -176.5 | 86.5 | 0 | 0 | 0 | 111.7 | N1709 Y1710 L1716 T1717 | N1709-W1713 VanDerWaalsContact O-CB 3.25Å; N1709-W1713 WeakPolarHBondContact O-CB 3.38Å; N1709-W1713 PolarHBondContact O-N 3.42Å; Y1710-W1713 HydrophobicContact CD2-CE3 4.16Å; Y1710-W1713 HydrophobicContact CE2-CE3 4.01Å; Y1710-W1713 HydrophobicContact CE2-CZ3 4.05Å; Y1710-W1713 PolarHBondContact O-N 2.97Å; W1713-L1716 CarbonylContact O-C 3.59Å; W1713-L1716 WeakPolarHBondContact O-CA 3.39Å; W1713-L1716 VanDerWaalsContact O-CB 3.3Å; W1713-L1716 WeakPolarHBondContact O-CB 3.32Å; W1713-L1716 PolarHBondContact O-N 3.47Å; W1713-T1717 HydrophobicContact CD2-CG2 4.21Å; W1713-T1717 HydrophobicContact CE3-CG2 4.46Å; W1713-T1717 HydrophobicContact CH2-CG2 4.14Å; W1713-T1717 HydrophobicContact CZ2-CG2 3.86Å; W1713-T1717 HydrophobicContact CZ3-CG2 4.43Å; W1713-T1717 PolarHBondContact O-N 3.3Å; W1713-T1717 PolarHBondContact O-OG1 3.32Å; W1713-T1717 VanDerWaalsContact O-OG1 3.07Å |
| 1714 | K | 58.4 | Low | 57.3 | Low | 91 Ų | 91 | 94.7 Ų | 94.7 | 40% | 0.396 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.4 | -43.3 | 173.5 | -179 | 165.1 | 174.1 | 170.1 | 0 | 111.6 | Y1710 L1716 T1717 E1718 | Y1710-K1714 HydrophobicContact CE1-CB 4.4Å; Y1710-K1714 HydrophobicContact CE1-CD 4.01Å; Y1710-K1714 WeakPolarHBondContact O-CA 3.42Å; Y1710-K1714 WeakPolarHBondContact O-CB 3.28Å; Y1710-K1714 PolarHBondContact O-N 3.18Å; K1714-L1716 PolarHBondContact O-N 3.24Å; K1714-T1717 WeakPolarHBondContact CA-OG1 3.46Å; K1714-T1717 PolarHBondContact O-N 3.42Å; K1714-T1717 PolarHBondContact O-OG1 3.24Å; K1714-E1718 WeakPolarHBondContact CE-OE1 3.46Å; K1714-E1718 HydrophobicContact CG-CG 4.14Å; K1714-E1718 WeakPolarHBondContact CG-OE1 3.02Å; K1714-E1718 IonicContact NZ-OE1 3.6Å; K1714-E1718 WeakPolarHBondContact O-CB 3.01Å; K1714-E1718 WeakPolarHBondContact O-CG 3.47Å; K1714-E1718 PolarHBondContact O-N 3.41Å |
| 1715 | K | 61 | Low | 57 | Low | 137 Ų | 137 | 94.6 Ų | 94.6 | 60% | 0.596 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -64.8 | -26.4 | 170.9 | -77 | 178.1 | 177.3 | -176.3 | 0 | 113.2 | R1711 K1712 R1719 | R1711-K1715 VanDerWaalsContact O-CB 3.26Å; R1711-K1715 WeakPolarHBondContact O-CB 3.2Å; R1711-K1715 VanDerWaalsContact O-CG 3.24Å; R1711-K1715 WeakPolarHBondContact O-CG 3.28Å; R1711-K1715 PolarHBondContact O-N 3.33Å; K1712-K1715 PolarHBondContact O-N 2.93Å; K1715-R1719 WeakPolarHBondContact O-CB 3.21Å; K1715-R1719 WeakPolarHBondContact O-CD 3.11Å; K1715-R1719 WeakPolarHBondContact O-CG 3.37Å; K1715-R1719 PolarHBondContact O-N 3.47Å |
| 1716 | L | 58.7 | Low | 56 | Low | 113 Ų | 113 | 95 Ų | 95 | 59% | 0.592 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -76.4 | -42.4 | 172.5 | -87.8 | 160.7 | 0 | 0 | 0 | 111.9 | K1712 W1713 K1714 R1719 A1720 | K1712-L1716 WeakPolarHBondContact O-CB 3.32Å; K1712-L1716 PolarHBondContact O-N 2.81Å; W1713-L1716 CarbonylContact O-C 3.59Å; W1713-L1716 WeakPolarHBondContact O-CA 3.39Å; W1713-L1716 VanDerWaalsContact O-CB 3.3Å; W1713-L1716 WeakPolarHBondContact O-CB 3.32Å; W1713-L1716 PolarHBondContact O-N 3.47Å; K1714-L1716 PolarHBondContact O-N 3.24Å; L1716-R1719 PolarHBondContact O-N 3.3Å; L1716-A1720 VanDerWaalsContact O-CB 3.23Å; L1716-A1720 WeakPolarHBondContact O-CB 2.91Å; L1716-A1720 PolarHBondContact O-N 3.25Å |
| 1717 | T | 57.2 | Low | 54.5 | Low | 56 Ų | 56 | 95.7 Ų | 95.7 | 34% | 0.344 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -76.7 | -25.5 | 176.5 | 47.7 | 0 | 0 | 0 | 0 | 113.2 | W1713 K1714 A1720 S1721 | W1713-T1717 HydrophobicContact CD2-CG2 4.21Å; W1713-T1717 HydrophobicContact CE3-CG2 4.46Å; W1713-T1717 HydrophobicContact CH2-CG2 4.14Å; W1713-T1717 HydrophobicContact CZ2-CG2 3.86Å; W1713-T1717 HydrophobicContact CZ3-CG2 4.43Å; W1713-T1717 PolarHBondContact O-N 3.3Å; W1713-T1717 PolarHBondContact O-OG1 3.32Å; W1713-T1717 VanDerWaalsContact O-OG1 3.07Å; K1714-T1717 WeakPolarHBondContact CA-OG1 3.46Å; K1714-T1717 PolarHBondContact O-N 3.42Å; K1714-T1717 PolarHBondContact O-OG1 3.24Å; T1717-A1720 CarbonylContact O-C 3.59Å; T1717-S1721 WeakPolarHBondContact O-CB 3.2Å; T1717-S1721 PolarHBondContact O-N 2.94Å |
| 1718 | E | 58.6 | Low | 53.3 | Low | 100 Ų | 100 | 97.1 Ų | 97.1 | 47% | 0.467 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -72.9 | -37.9 | 169 | -73.8 | 167.9 | 164.1 | 0 | 0 | 111.5 | K1714 S1721 A1722 | K1714-E1718 WeakPolarHBondContact CE-OE1 3.46Å; K1714-E1718 HydrophobicContact CG-CG 4.14Å; K1714-E1718 WeakPolarHBondContact CG-OE1 3.02Å; K1714-E1718 IonicContact NZ-OE1 3.6Å; K1714-E1718 WeakPolarHBondContact O-CB 3.01Å; K1714-E1718 WeakPolarHBondContact O-CG 3.47Å; K1714-E1718 PolarHBondContact O-N 3.41Å; E1718-S1721 CarbonylContact O-C 3.31Å; E1718-S1721 VanDerWaalsContact O-C 3.3Å; E1718-S1721 VanDerWaalsContact O-CA 3.29Å; E1718-S1721 WeakPolarHBondContact O-CA 3.12Å; E1718-S1721 WeakPolarHBondContact O-CB 3.1Å; E1718-S1721 PolarHBondContact O-N 2.96Å; E1718-A1722 PolarHBondContact O-N 3.31Å |
| 1719 | R | 56.3 | Low | 51.8 | Low | 191 Ų | 191 | 100 Ų | 100 | 72% | 0.721 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -67.8 | -42.9 | 169.6 | -77 | 171.6 | 175 | -175.1 | -3.9 | 111.4 | K1715 L1716 S1721 A1722 | K1715-R1719 WeakPolarHBondContact O-CB 3.21Å; K1715-R1719 WeakPolarHBondContact O-CD 3.11Å; K1715-R1719 WeakPolarHBondContact O-CG 3.37Å; K1715-R1719 PolarHBondContact O-N 3.47Å; L1716-R1719 PolarHBondContact O-N 3.3Å; R1719-S1721 PolarHBondContact O-N 3.24Å; R1719-S1721 VanDerWaalsContact O-N 3.09Å; R1719-A1722 PolarHBondContact O-N 2.97Å |
| 1720 | A | 48.8 | Very low | 50.3 | Low | 38 Ų | 38 | 101.3 Ų | 101.3 | 31% | 0.314 | 50% | 0.499 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.2 | 24.6 | 164.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | L1716 T1717 T1763 | L1716-A1720 VanDerWaalsContact O-CB 3.23Å; L1716-A1720 WeakPolarHBondContact O-CB 2.91Å; L1716-A1720 PolarHBondContact O-N 3.25Å; T1717-A1720 CarbonylContact O-C 3.59Å; A1720-T1763 WeakPolarHBondContact O-CG2 3.16Å; A1720-T1763 PolarHBondContact O-OG1 3.09Å |
| 1721 | S | 49.6 | Very low | 49.1 | Very low | 57 Ų | 57 | 102.3 Ų | 102.3 | 40% | 0.399 | 52% | 0.518 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -128.6 | 17.3 | 162.9 | -162.9 | 0 | 0 | 0 | 0 | 111.9 | T1717 E1718 R1719 A1762 T1763 | T1717-S1721 WeakPolarHBondContact O-CB 3.2Å; T1717-S1721 PolarHBondContact O-N 2.94Å; E1718-S1721 CarbonylContact O-C 3.31Å; E1718-S1721 VanDerWaalsContact O-C 3.3Å; E1718-S1721 VanDerWaalsContact O-CA 3.29Å; E1718-S1721 WeakPolarHBondContact O-CA 3.12Å; E1718-S1721 WeakPolarHBondContact O-CB 3.1Å; E1718-S1721 PolarHBondContact O-N 2.96Å; R1719-S1721 PolarHBondContact O-N 3.24Å; R1719-S1721 VanDerWaalsContact O-N 3.09Å; S1721-A1762 CarbonylContact C-O 3.6Å; S1721-A1762 WeakPolarHBondContact CA-O 3.36Å; S1721-A1762 WeakPolarHBondContact CB-O 3.45Å; S1721-A1762 PolarHBondContact OG-O 2.65Å; S1721-T1763 VanDerWaalsContact C-CA 3.46Å; S1721-T1763 WeakPolarHBondContact CA-OG1 3.27Å; S1721-T1763 PolarHBondContact N-OG1 2.89Å |
| 1722 | A | 50.9 | Low | 47.6 | Very low | 49 Ų | 49 | 101.4 Ų | 101.4 | 41% | 0.405 | 53% | 0.525 | S | S | . | . | S | Bend | trans | -138.4 | 19.4 | 179.8 | 0 | 0 | 0 | 0 | 0 | 119.2 | E1718 R1719 T1763 | E1718-A1722 PolarHBondContact O-N 3.31Å; R1719-A1722 PolarHBondContact O-N 2.97Å; A1722-T1763 CarbonylContact C-O 3.58Å; A1722-T1763 WeakPolarHBondContact CA-O 3.34Å; A1722-T1763 VanDerWaalsContact N-CG2 3.28Å |
| 1723 | A | 45.7 | Very low | 46.3 | Very low | 68 Ų | 68 | 100.4 Ų | 100.4 | 56% | 0.562 | 53% | 0.532 | S | S | * | . | S | Bend | trans | -124.9 | -33.7 | 161.8 | 0 | 0 | 0 | 0 | 0 | 120.2 | T1763 Q1764 | A1723-T1763 CarbonylContact C-O 3.28Å; A1723-T1763 VanDerWaalsContact CA-C 3.44Å; A1723-T1763 WeakPolarHBondContact CA-O 3.13Å; A1723-T1763 HydrophobicContact CB-CG2 3.89Å; A1723-T1763 PolarHBondContact N-O 2.64Å; A1723-T1763 CarbonylContact O-C 3.48Å; A1723-Q1764 WeakPolarHBondContact O-CG 3.25Å; A1723-Q1764 PolarHBondContact O-N 3.12Å |
| 1724 | Q | 44 | Very low | 44.7 | Very low | 26 Ų | 26 | 101.2 Ų | 101.2 | 12% | 0.121 | 54% | 0.542 | C | S | . | . | S | Bend | trans | -98.2 | 0 | 156.7 | 41.8 | 64.4 | -152.2 | 0 | 0 | 134 | L1758 N1759 K1760 F1761 A1762 T1763 Q1764 | Q1724-L1758 PolarHBondContact NE2-O 2.93Å; Q1724-N1759 WeakPolarHBondContact CG-O 3.37Å; Q1724-N1759 PolarHBondContact NE2-O 3.38Å; Q1724-N1759 VanDerWaalsContact OE1-C 3.27Å; Q1724-N1759 PolarHBondContact OE1-O 3.33Å; Q1724-K1760 HydrophobicContact CB-CG 4.09Å; Q1724-K1760 HydrophobicContact CG-CB 4.47Å; Q1724-K1760 HydrophobicContact CG-CG 3.93Å; Q1724-K1760 VanDerWaalsContact NE2-C 3.28Å; Q1724-K1760 VanDerWaalsContact NE2-N 3.16Å; Q1724-K1760 CarbonylContact O-C 3.47Å; Q1724-K1760 VanDerWaalsContact O-C 3.3Å; Q1724-F1761 VanDerWaalsContact NE2-N 3.13Å; Q1724-F1761 CarbonylContact O-C 3.5Å; Q1724-F1761 WeakPolarHBondContact O-CA 3.47Å; Q1724-F1761 PolarHBondContact O-N 3.42Å; Q1724-A1762 PolarHBondContact O-N 3.03Å; Q1724-T1763 HydrophobicContact CG-CG2 4.03Å; Q1724-T1763 PolarHBondContact N-O 3.04Å; Q1724-T1763 VanDerWaalsContact NE2-CB 3.28Å; Q1724-T1763 PolarHBondContact NE2-OG1 3.31Å; Q1724-T1763 PolarHBondContact O-N 3.43Å; Q1724-T1763 VanDerWaalsContact OE1-CB 3.3Å; Q1724-T1763 PolarHBondContact OE1-OG1 2.79Å; Q1724-T1763 VanDerWaalsContact OE1-OG1 3.04Å; Q1724-Q1764 HydrophobicContact CB-CB 3.81Å; Q1724-Q1764 HydrophobicContact CB-CG 3.86Å |
| 1725 | K | 51.5 | Low | 43.5 | Very low | 56 Ų | 56 | 105 Ų | 105 | 24% | 0.243 | 56% | 0.558 | C | S | . | * | S | Bend | 0 | 48.8 | 0 | -47.1 | -148.9 | 132.8 | -153.8 | 0 | 135.5 | F1761 A1762 T1763 L1765 N1766 S1767 | K1725-F1761 WeakPolarHBondContact CG-O 3.5Å; K1725-F1761 PolarHBondContact N-O 2.91Å; K1725-A1762 WeakPolarHBondContact CB-O 3.49Å; K1725-A1762 WeakPolarHBondContact CG-O 3.36Å; K1725-T1763 CarbonylContact C-O 3.52Å; K1725-T1763 WeakPolarHBondContact CA-O 3.48Å; K1725-T1763 VanDerWaalsContact CB-CA 3.47Å; K1725-T1763 CarbonylContact O-C 3.31Å; K1725-L1765 WeakPolarHBondContact CA-O 3.26Å; K1725-L1765 VanDerWaalsContact CB-O 3.27Å; K1725-L1765 WeakPolarHBondContact CB-O 3.16Å; K1725-L1765 VanDerWaalsContact CD-O 3.3Å; K1725-L1765 WeakPolarHBondContact CD-O 2.97Å; K1725-L1765 WeakPolarHBondContact CE-O 3.31Å; K1725-L1765 WeakPolarHBondContact CG-O 3.32Å; K1725-N1766 HydrophobicContact CB-CB 3.84Å; K1725-N1766 HydrophobicContact CD-CB 4.25Å; K1725-N1766 PolarHBondContact NZ-OD1 2.76Å; K1725-N1766 VanDerWaalsContact O-CB 3.3Å; K1725-N1766 WeakPolarHBondContact O-CB 3.23Å; K1725-N1766 PolarHBondContact O-N 3.07Å; K1725-S1767 PolarHBondContact O-N 3.38Å | |
| 1726 | E | 40.1 | Very low | 42.4 | Very low | 81 Ų | 81 | 101.9 Ų | 101.9 | 38% | 0.379 | 55% | 0.554 | S | S | . | * | S | Bend | trans | -171 | -82.3 | -165.9 | 166.9 | 143.2 | -85.7 | 0 | 0 | 110.4 | T1763 Q1764 S1767 | E1726-T1763 WeakPolarHBondContact CB-O 3.44Å; E1726-T1763 VanDerWaalsContact N-C 3.31Å; E1726-T1763 PolarHBondContact N-O 3.06Å; E1726-Q1764 CarbonylContact C-O 3.52Å; E1726-Q1764 WeakPolarHBondContact CA-O 3.46Å; E1726-Q1764 PolarHBondContact N-O 3.49Å; E1726-S1767 VanDerWaalsContact CD-OG 3.28Å; E1726-S1767 WeakPolarHBondContact CG-OG 3.47Å; E1726-S1767 WeakPolarHBondContact OE1-CB 3.49Å; E1726-S1767 PolarHBondContact OE1-OG 3.32Å |
| 1727 | L | 30.1 | Very low | 41.1 | Very low | 123 Ų | 123 | 103.4 Ų | 103.4 | 64% | 0.644 | 56% | 0.558 | S | S | * | * | trans | -103 | 128 | 176.2 | 174 | 167.3 | 0 | 0 | 0 | 115.3 | Q1764 | L1727-Q1764 CarbonylContact C-O 2.99Å; L1727-Q1764 WeakPolarHBondContact CA-O 3.14Å; L1727-Q1764 PolarHBondContact N-O 3.2Å; L1727-Q1764 CarbonylContact O-C 3.59Å; L1727-Q1764 WeakPolarHBondContact O-CA 3.33Å; L1727-Q1764 WeakPolarHBondContact O-CB 3.42Å; L1727-Q1764 WeakPolarHBondContact O-CG 3.32Å; L1727-Q1764 PolarHBondContact O-NE2 3.34Å | ||
| 1728 | D | 32.9 | Very low | 40.2 | Very low | 87 Ų | 87 | 104.1 Ų | 104.1 | 47% | 0.465 | 57% | 0.566 | S | S | . | * | trans | -145.6 | 141.8 | -179.8 | -177.8 | 18.6 | 0 | 0 | 0 | 111.5 | Q1764 L1765 | D1728-Q1764 PolarHBondContact N-O 2.74Å; D1728-L1765 HydrophobicContact CB-CB 4.44Å; D1728-L1765 HydrophobicContact CB-CD1 4.44Å | ||
| 1729 | L | 31.6 | Very low | 39.4 | Very low | 167 Ų | 167 | 103.6 Ų | 103.6 | 87% | 0.874 | 57% | 0.569 | S | S | * | * | trans | -154.5 | 136.7 | 174.6 | -85.3 | -175.4 | 0 | 0 | 0 | 112.6 | ||||
| 1730 | T | 33.8 | Very low | 38.4 | Very low | 114 Ų | 114 | 100.3 Ų | 100.3 | 70% | 0.699 | 57% | 0.565 | S | S | * | * | trans | -93.3 | 128.6 | -166.5 | 39.3 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 1731 | V | 35.5 | Very low | 37.9 | Very low | 150 Ų | 150 | 104.9 Ų | 104.9 | 91% | 0.909 | 58% | 0.58 | S | S | * | * | trans | -131.3 | 128.8 | 149.6 | -178 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 1732 | L | 27.4 | Very low | 37.4 | Very low | 148 Ų | 148 | 105.9 Ų | 105.9 | 78% | 0.775 | 59% | 0.587 | S | S | * | * | trans | -95.5 | 179.6 | -169.6 | -70 | 160.3 | 0 | 0 | 0 | 111.2 | ||||
| 1733 | P | 38.6 | Very low | 36.7 | Very low | 108 Ų | 108 | 107.4 Ų | 107.4 | 70% | 0.701 | 59% | 0.594 | S | S | * | * | cis | -137.5 | -171.9 | 3.8 | 28.4 | -2.6 | 0 | 0 | 0 | 116.4 | ||||
| 1734 | E | 28.6 | Very low | 36.4 | Very low | 166 Ų | 166 | 111 Ų | 111 | 78% | 0.776 | 60% | 0.603 | S | S | * | * | trans | 87.4 | 158.4 | 154.1 | -49.7 | -155.1 | 151.6 | 0 | 0 | 122.5 | ||||
| 1735 | F | 31.9 | Very low | 36.2 | Very low | 169 Ų | 169 | 117 Ų | 117 | 74% | 0.741 | 64% | 0.635 | S | S | * | * | trans | 74 | 68.8 | 173.4 | -72 | -82.9 | 0 | 0 | 0 | 121.3 | ||||
| 1736 | S | 38 | Very low | 35.4 | Very low | 72 Ų | 72 | 121.2 Ų | 121.2 | 50% | 0.503 | 66% | 0.661 | S | S | . | * | 62.7 | 133.7 | 113.3 | 68.9 | 0 | 0 | 0 | 0 | 122.4 | S1738 | S1736-S1738 VanDerWaalsContact C-N 3.27Å; S1736-S1738 PolarHBondContact O-N 3.07Å; S1736-S1738 VanDerWaalsContact O-N 3.09Å | |||
| 1737 | Q | 31.6 | Very low | 35 | Very low | 145 Ų | 145 | 121.7 Ų | 121.7 | 68% | 0.678 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.6 | -19.4 | 179.4 | -167.4 | 167.2 | -21.9 | 0 | 0 | 116.9 | T1739 I1740 | Q1737-T1739 VanDerWaalsContact C-N 3.31Å; Q1737-T1739 PolarHBondContact O-N 2.94Å; Q1737-I1740 WeakPolarHBondContact O-CB 3.44Å; Q1737-I1740 PolarHBondContact O-N 3.42Å; Q1737-I1740 VanDerWaalsContact O-N 3.13Å |
| 1738 | S | 39 | Very low | 35 | Very low | 72 Ų | 72 | 124.4 Ų | 124.4 | 50% | 0.503 | 67% | 0.674 | S | S | . | * | H | α-helix | trans | -63.9 | -28.8 | -175.8 | 51.9 | 0 | 0 | 0 | 0 | 114.6 | S1736 I1740 E1741 S1742 | S1736-S1738 VanDerWaalsContact C-N 3.27Å; S1736-S1738 PolarHBondContact O-N 3.07Å; S1736-S1738 VanDerWaalsContact O-N 3.09Å; S1738-I1740 VanDerWaalsContact C-N 3.27Å; S1738-I1740 PolarHBondContact O-N 2.9Å; S1738-E1741 PolarHBondContact O-N 3.38Å; S1738-S1742 PolarHBondContact O-N 3.34Å; S1738-S1742 VanDerWaalsContact O-N 3.16Å; S1738-S1742 PolarHBondContact O-OG 3.48Å |
| 1739 | T | 41.4 | Very low | 35.4 | Very low | 88 Ų | 88 | 125.6 Ų | 125.6 | 54% | 0.54 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -72.3 | -21.5 | 177.3 | -51.6 | 0 | 0 | 0 | 0 | 112.8 | Q1737 E1741 S1742 S1743 | Q1737-T1739 VanDerWaalsContact C-N 3.31Å; Q1737-T1739 PolarHBondContact O-N 2.94Å; T1739-E1741 VanDerWaalsContact C-N 3.35Å; T1739-S1742 WeakPolarHBondContact CA-OG 3.3Å; T1739-S1742 PolarHBondContact O-OG 3.49Å; T1739-S1743 PolarHBondContact O-OG 3.49Å |
| 1740 | I | 35.5 | Very low | 35.4 | Very low | 122 Ų | 122 | 125.5 Ų | 125.5 | 63% | 0.626 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -71.3 | -34.3 | 178.5 | -60.4 | 176.4 | 0 | 0 | 0 | 110.5 | Q1737 S1738 | Q1737-I1740 WeakPolarHBondContact O-CB 3.44Å; Q1737-I1740 PolarHBondContact O-N 3.42Å; Q1737-I1740 VanDerWaalsContact O-N 3.13Å; S1738-I1740 VanDerWaalsContact C-N 3.27Å; S1738-I1740 PolarHBondContact O-N 2.9Å |
| 1741 | E | 38.4 | Very low | 35.2 | Very low | 134 Ų | 134 | 125.7 Ų | 125.7 | 63% | 0.626 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -88.1 | -36.8 | -179.6 | -66.5 | 171.8 | 171.4 | 0 | 0 | 112 | S1738 T1739 S1743 L1744 | S1738-E1741 PolarHBondContact O-N 3.38Å; T1739-E1741 VanDerWaalsContact C-N 3.35Å; E1741-S1743 PolarHBondContact O-N 2.91Å; E1741-L1744 PolarHBondContact O-N 2.92Å |
| 1742 | S | 39.3 | Very low | 35 | Very low | 78 Ų | 78 | 126.5 Ų | 126.5 | 55% | 0.545 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -66.5 | -20 | -177.6 | 67.1 | 0 | 0 | 0 | 0 | 115.1 | S1738 T1739 | S1738-S1742 PolarHBondContact O-N 3.34Å; S1738-S1742 VanDerWaalsContact O-N 3.16Å; S1738-S1742 PolarHBondContact O-OG 3.48Å; T1739-S1742 WeakPolarHBondContact CA-OG 3.3Å; T1739-S1742 PolarHBondContact O-OG 3.49Å |
| 1743 | S | 36.8 | Very low | 35 | Very low | 81 Ų | 81 | 124.7 Ų | 124.7 | 57% | 0.566 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.4 | -8.4 | -177.8 | -63 | 0 | 0 | 0 | 0 | 114.4 | T1739 E1741 | T1739-S1743 PolarHBondContact O-OG 3.49Å; E1741-S1743 PolarHBondContact O-N 2.91Å |
| 1744 | L | 38.9 | Very low | 35 | Very low | 144 Ų | 144 | 123.1 Ų | 123.1 | 75% | 0.754 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -13.5 | 178.9 | -83.6 | 166.2 | 0 | 0 | 0 | 113.8 | E1741 | E1741-L1744 PolarHBondContact O-N 2.92Š|
| 1745 | L | 39.8 | Very low | 35.5 | Very low | 151 Ų | 151 | 122 Ų | 122 | 79% | 0.791 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -105.8 | 8.6 | -167.1 | -141.4 | 81.8 | 0 | 0 | 0 | 116 | ||
| 1746 | N | 34.6 | Very low | 36.3 | Very low | 146 Ų | 146 | 121.8 Ų | 121.8 | 78% | 0.781 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -140.1 | 28.2 | -178.6 | -92.9 | -52.8 | 0 | 0 | 0 | 114.5 | ||
| 1747 | L | 30.6 | Very low | 36.6 | Very low | 90 Ų | 90 | 127.1 Ų | 127.1 | 47% | 0.471 | 65% | 0.652 | S | S | . | * | trans | -119 | 72 | 170.7 | -68.7 | -174.6 | 0 | 0 | 0 | 112.5 | Y1750 Q1751 | L1747-Y1750 VanDerWaalsContact CD2-CB 3.5Å; L1747-Q1751 WeakPolarHBondContact CD2-O 3.38Å | ||
| 1748 | H | 30.6 | Very low | 37 | Very low | 180 Ų | 180 | 125.7 Ų | 125.7 | 83% | 0.833 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -144 | 126.9 | 140.1 | -145.1 | -86.9 | 0 | 0 | 0 | 107.7 | ||
| 1749 | P | 42.2 | Very low | 37.5 | Very low | 113 Ų | 113 | 125.9 Ų | 125.9 | 73% | 0.734 | 64% | 0.644 | S | S | * | * | S | Bend | cis | -110.6 | 62.7 | 5 | 39.7 | -27.4 | 0 | 0 | 0 | 112.5 | ||
| 1750 | Y | 30.5 | Very low | 37.9 | Very low | 165 Ų | 165 | 128.7 Ų | 128.7 | 65% | 0.647 | 65% | 0.649 | S | S | * | * | trans | -122.2 | 159.6 | 177.6 | -92.6 | -128.3 | 0 | 0 | 0 | 108.1 | L1747 | L1747-Y1750 VanDerWaalsContact CD2-CB 3.5Š| ||
| 1751 | Q | 30 | Very low | 38.1 | Very low | 117 Ų | 117 | 129.7 Ų | 129.7 | 55% | 0.547 | 65% | 0.649 | S | S | . | * | cis | 99.6 | 107.5 | 26 | -161.2 | 178.5 | 31.7 | 0 | 0 | 114.7 | L1747 | L1747-Q1751 WeakPolarHBondContact CD2-O 3.38Š| ||
| 1752 | Q | 30.6 | Very low | 38.3 | Very low | 167 Ų | 167 | 124.8 Ų | 124.8 | 78% | 0.78 | 63% | 0.632 | S | S | * | * | trans | 61.4 | 108.9 | 155.7 | -68 | 171.8 | -19.5 | 0 | 0 | 121.1 | ||||
| 1753 | C | 28.9 | Very low | 38.9 | Very low | 110 Ų | 110 | 121.2 Ų | 121.2 | 74% | 0.743 | 61% | 0.607 | S | S | * | * | -167.5 | 171.7 | 105.6 | -151.5 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 1754 | N | 37.2 | Very low | 39.2 | Very low | 76 Ų | 76 | 120.6 Ų | 120.6 | 41% | 0.406 | 60% | 0.595 | S | S | . | * | trans | 74.3 | 28.2 | 154.1 | -71.2 | -41.9 | 0 | 0 | 0 | 121.9 | E1756 R1757 L1758 | N1754-E1756 PolarHBondContact O-N 2.91Å; N1754-R1757 HydrophobicContact CB-CB 4.16Å; N1754-R1757 PolarHBondContact O-N 3.08Å; N1754-R1757 WeakPolarHBondContact OD1-CD 3.04Å; N1754-L1758 PolarHBondContact O-N 2.93Å | ||
| 1755 | Q | 40.4 | Very low | 39.3 | Very low | 141 Ų | 141 | 118 Ų | 118 | 66% | 0.659 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -55.7 | -36.6 | 160.6 | -163.5 | 72.3 | 33.9 | 0 | 0 | 111.7 | R1757 N1759 | Q1755-R1757 PolarHBondContact O-N 3.36Å; Q1755-N1759 VanDerWaalsContact O-CB 3.32Å; Q1755-N1759 WeakPolarHBondContact O-CB 3.44Å; Q1755-N1759 PolarHBondContact O-N 2.91Å |
| 1756 | E | 47.3 | Very low | 39.8 | Very low | 166 Ų | 166 | 113.5 Ų | 113.5 | 78% | 0.776 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -72.3 | -18.2 | 178.2 | -76.6 | -169.8 | 120.6 | 0 | 0 | 115.2 | N1754 N1759 K1760 | N1754-E1756 PolarHBondContact O-N 2.91Å; E1756-N1759 CarbonylContact O-C 3.6Å; E1756-K1760 WeakPolarHBondContact O-CB 3.15Å; E1756-K1760 PolarHBondContact O-N 2.84Å; E1756-K1760 VanDerWaalsContact O-N 3.09Å |
| 1757 | R | 45.4 | Very low | 40.5 | Very low | 183 Ų | 183 | 107.3 Ų | 107.3 | 69% | 0.691 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -90.2 | -31.4 | 174.1 | -82.4 | -175.5 | 165.6 | 178.6 | -6.9 | 112.5 | N1754 Q1755 N1759 K1760 F1761 | N1754-R1757 HydrophobicContact CB-CB 4.16Å; N1754-R1757 PolarHBondContact O-N 3.08Å; N1754-R1757 WeakPolarHBondContact OD1-CD 3.04Å; Q1755-R1757 PolarHBondContact O-N 3.36Å; R1757-N1759 VanDerWaalsContact C-N 3.33Å; R1757-K1760 VanDerWaalsContact C-N 3.34Å; R1757-K1760 CarbonylContact O-C 3.07Å; R1757-K1760 WeakPolarHBondContact O-CA 3.46Å; R1757-K1760 PolarHBondContact O-N 2.89Å; R1757-F1761 PolarHBondContact O-N 3.47Å; R1757-F1761 VanDerWaalsContact O-N 3.12Å |
| 1758 | L | 40.3 | Very low | 41.3 | Very low | 116 Ų | 116 | 108.1 Ų | 108.1 | 61% | 0.607 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.3 | -45.4 | 162.4 | -80.4 | 160.2 | 0 | 0 | 0 | 110 | Q1724 N1754 K1760 F1761 A1762 | Q1724-L1758 PolarHBondContact NE2-O 2.93Å; N1754-L1758 PolarHBondContact O-N 2.93Å; L1758-K1760 PolarHBondContact O-N 2.99Å; L1758-F1761 PolarHBondContact O-N 3.21Å; L1758-A1762 PolarHBondContact O-N 3.07Å |
| 1759 | N | 49.6 | Very low | 42.1 | Very low | 76 Ų | 76 | 104.3 Ų | 104.3 | 41% | 0.406 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76 | 27.4 | 164.6 | -61.9 | 2.4 | 0 | 0 | 0 | 113.2 | Q1724 Q1755 E1756 R1757 | Q1724-N1759 WeakPolarHBondContact CG-O 3.37Å; Q1724-N1759 PolarHBondContact NE2-O 3.38Å; Q1724-N1759 VanDerWaalsContact OE1-C 3.27Å; Q1724-N1759 PolarHBondContact OE1-O 3.33Å; Q1755-N1759 VanDerWaalsContact O-CB 3.32Å; Q1755-N1759 WeakPolarHBondContact O-CB 3.44Å; Q1755-N1759 PolarHBondContact O-N 2.91Å; E1756-N1759 CarbonylContact O-C 3.6Å; R1757-N1759 VanDerWaalsContact C-N 3.33Å |
| 1760 | K | 49.5 | Very low | 42.5 | Very low | 147 Ų | 147 | 104.8 Ų | 104.8 | 64% | 0.639 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -133.8 | 10.7 | 153.3 | -113.9 | 175.9 | -177.7 | 175.6 | 0 | 115.7 | Q1724 E1756 R1757 L1758 | Q1724-K1760 HydrophobicContact CB-CG 4.09Å; Q1724-K1760 HydrophobicContact CG-CB 4.47Å; Q1724-K1760 HydrophobicContact CG-CG 3.93Å; Q1724-K1760 VanDerWaalsContact NE2-C 3.28Å; Q1724-K1760 VanDerWaalsContact NE2-N 3.16Å; Q1724-K1760 CarbonylContact O-C 3.47Å; Q1724-K1760 VanDerWaalsContact O-C 3.3Å; E1756-K1760 WeakPolarHBondContact O-CB 3.15Å; E1756-K1760 PolarHBondContact O-N 2.84Å; E1756-K1760 VanDerWaalsContact O-N 3.09Å; R1757-K1760 VanDerWaalsContact C-N 3.34Å; R1757-K1760 CarbonylContact O-C 3.07Å; R1757-K1760 WeakPolarHBondContact O-CA 3.46Å; R1757-K1760 PolarHBondContact O-N 2.89Å; L1758-K1760 PolarHBondContact O-N 2.99Å |
| 1761 | F | 38.5 | Very low | 43.9 | Very low | 142 Ų | 142 | 103.8 Ų | 103.8 | 62% | 0.623 | 51% | 0.51 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.8 | -13.8 | 173.9 | -163.5 | -106.4 | 0 | 0 | 0 | 115.6 | Q1724 K1725 R1757 L1758 | Q1724-F1761 VanDerWaalsContact NE2-N 3.13Å; Q1724-F1761 CarbonylContact O-C 3.5Å; Q1724-F1761 WeakPolarHBondContact O-CA 3.47Å; Q1724-F1761 PolarHBondContact O-N 3.42Å; K1725-F1761 WeakPolarHBondContact CG-O 3.5Å; K1725-F1761 PolarHBondContact N-O 2.91Å; R1757-F1761 PolarHBondContact O-N 3.47Å; R1757-F1761 VanDerWaalsContact O-N 3.12Å; L1758-F1761 PolarHBondContact O-N 3.21Å |
| 1762 | A | 43.6 | Very low | 45 | Very low | 32 Ų | 32 | 101.5 Ų | 101.5 | 26% | 0.264 | 51% | 0.507 | S | S | . | . | S | Bend | trans | -87 | -4.9 | -172.5 | 0 | 0 | 0 | 0 | 0 | 119.2 | S1721 Q1724 K1725 L1758 | S1721-A1762 CarbonylContact C-O 3.6Å; S1721-A1762 WeakPolarHBondContact CA-O 3.36Å; S1721-A1762 WeakPolarHBondContact CB-O 3.45Å; S1721-A1762 PolarHBondContact OG-O 2.65Å; Q1724-A1762 PolarHBondContact O-N 3.03Å; K1725-A1762 WeakPolarHBondContact CB-O 3.49Å; K1725-A1762 WeakPolarHBondContact CG-O 3.36Å; L1758-A1762 PolarHBondContact O-N 3.07Å |
| 1763 | T | 51.4 | Low | 45.8 | Very low | 3 Ų | 3 | 98 Ų | 98 | 2% | 0.018 | 49% | 0.494 | C | S | . | . | S | Bend | trans | -139 | 0 | -152.5 | -32.1 | 0 | 0 | 0 | 0 | 126.7 | A1720 S1721 A1722 A1723 Q1724 K1725 E1726 | A1720-T1763 WeakPolarHBondContact O-CG2 3.16Å; A1720-T1763 PolarHBondContact O-OG1 3.09Å; S1721-T1763 VanDerWaalsContact C-CA 3.46Å; S1721-T1763 WeakPolarHBondContact CA-OG1 3.27Å; S1721-T1763 PolarHBondContact N-OG1 2.89Å; A1722-T1763 CarbonylContact C-O 3.58Å; A1722-T1763 WeakPolarHBondContact CA-O 3.34Å; A1722-T1763 VanDerWaalsContact N-CG2 3.28Å; A1723-T1763 CarbonylContact C-O 3.28Å; A1723-T1763 VanDerWaalsContact CA-C 3.44Å; A1723-T1763 WeakPolarHBondContact CA-O 3.13Å; A1723-T1763 HydrophobicContact CB-CG2 3.89Å; A1723-T1763 PolarHBondContact N-O 2.64Å; A1723-T1763 CarbonylContact O-C 3.48Å; Q1724-T1763 HydrophobicContact CG-CG2 4.03Å; Q1724-T1763 PolarHBondContact N-O 3.04Å; Q1724-T1763 VanDerWaalsContact NE2-CB 3.28Å; Q1724-T1763 PolarHBondContact NE2-OG1 3.31Å; Q1724-T1763 PolarHBondContact O-N 3.43Å; Q1724-T1763 VanDerWaalsContact OE1-CB 3.3Å; Q1724-T1763 PolarHBondContact OE1-OG1 2.79Å; Q1724-T1763 VanDerWaalsContact OE1-OG1 3.04Å; K1725-T1763 CarbonylContact C-O 3.52Å; K1725-T1763 WeakPolarHBondContact CA-O 3.48Å; K1725-T1763 VanDerWaalsContact CB-CA 3.47Å; K1725-T1763 CarbonylContact O-C 3.31Å; E1726-T1763 WeakPolarHBondContact CB-O 3.44Å; E1726-T1763 VanDerWaalsContact N-C 3.31Å; E1726-T1763 PolarHBondContact N-O 3.06Å |
| 1764 | Q | 43.6 | Very low | 47 | Very low | 68 Ų | 68 | 99.8 Ų | 99.8 | 32% | 0.318 | 49% | 0.488 | S | S | . | . | S | Bend | 0 | -71.6 | 0 | -64.1 | -164 | -104 | 0 | 0 | 128.4 | A1723 Q1724 E1726 L1727 D1728 | A1723-Q1764 WeakPolarHBondContact O-CG 3.25Å; A1723-Q1764 PolarHBondContact O-N 3.12Å; Q1724-Q1764 HydrophobicContact CB-CB 3.81Å; Q1724-Q1764 HydrophobicContact CB-CG 3.86Å; E1726-Q1764 CarbonylContact C-O 3.52Å; E1726-Q1764 WeakPolarHBondContact CA-O 3.46Å; E1726-Q1764 PolarHBondContact N-O 3.49Å; L1727-Q1764 CarbonylContact C-O 2.99Å; L1727-Q1764 WeakPolarHBondContact CA-O 3.14Å; L1727-Q1764 PolarHBondContact N-O 3.2Å; L1727-Q1764 CarbonylContact O-C 3.59Å; L1727-Q1764 WeakPolarHBondContact O-CA 3.33Å; L1727-Q1764 WeakPolarHBondContact O-CB 3.42Å; L1727-Q1764 WeakPolarHBondContact O-CG 3.32Å; L1727-Q1764 PolarHBondContact O-NE2 3.34Å; D1728-Q1764 PolarHBondContact N-O 2.74Å | |
| 1765 | L | 40.6 | Very low | 48.1 | Very low | 89 Ų | 89 | 99.2 Ų | 99.2 | 47% | 0.466 | 49% | 0.494 | S | S | . | . | S | Bend | trans | -94.1 | 88 | 150.3 | -174.9 | 113.9 | 0 | 0 | 0 | 118.9 | K1725 D1728 | K1725-L1765 WeakPolarHBondContact CA-O 3.26Å; K1725-L1765 VanDerWaalsContact CB-O 3.27Å; K1725-L1765 WeakPolarHBondContact CB-O 3.16Å; K1725-L1765 VanDerWaalsContact CD-O 3.3Å; K1725-L1765 WeakPolarHBondContact CD-O 2.97Å; K1725-L1765 WeakPolarHBondContact CE-O 3.31Å; K1725-L1765 WeakPolarHBondContact CG-O 3.32Å; D1728-L1765 HydrophobicContact CB-CB 4.44Å; D1728-L1765 HydrophobicContact CB-CD1 4.44Å |
| 1766 | N | 50.7 | Low | 48.8 | Very low | 56 Ų | 56 | 98.6 Ų | 98.6 | 30% | 0.299 | 49% | 0.492 | S | S | . | . | trans | -173.3 | -71.9 | 164.2 | -98 | 8.4 | 0 | 0 | 0 | 114.2 | K1725 N1768 I1769 | K1725-N1766 HydrophobicContact CB-CB 3.84Å; K1725-N1766 HydrophobicContact CD-CB 4.25Å; K1725-N1766 PolarHBondContact NZ-OD1 2.76Å; K1725-N1766 VanDerWaalsContact O-CB 3.3Å; K1725-N1766 WeakPolarHBondContact O-CB 3.23Å; K1725-N1766 PolarHBondContact O-N 3.07Å; N1766-N1768 CarbonylContact O-C 2.8Å; N1766-N1768 WeakPolarHBondContact O-CA 3.4Å; N1766-N1768 PolarHBondContact O-N 3.29Å; N1766-I1769 PolarHBondContact O-N 3.38Å | ||
| 1767 | S | 48.2 | Very low | 48.8 | Very low | 16 Ų | 16 | 96.5 Ų | 96.5 | 11% | 0.112 | 48% | 0.483 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -34.3 | -28.6 | -144.7 | 79.4 | 0 | 0 | 0 | 0 | 119.9 | K1725 E1726 I1769 L1770 K1771 | K1725-S1767 PolarHBondContact O-N 3.38Å; E1726-S1767 VanDerWaalsContact CD-OG 3.28Å; E1726-S1767 WeakPolarHBondContact CG-OG 3.47Å; E1726-S1767 WeakPolarHBondContact OE1-CB 3.49Å; E1726-S1767 PolarHBondContact OE1-OG 3.32Å; S1767-I1769 VanDerWaalsContact C-N 3.25Å; S1767-I1769 PolarHBondContact O-N 2.96Å; S1767-L1770 WeakPolarHBondContact O-CB 3.45Å; S1767-L1770 PolarHBondContact O-N 2.71Å; S1767-K1771 PolarHBondContact O-N 2.77Å |
| 1768 | N | 47.5 | Very low | 49.3 | Very low | 107 Ų | 107 | 91.1 Ų | 91.1 | 57% | 0.572 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -56.8 | -36 | 168.1 | -62 | -48.7 | 0 | 0 | 0 | 112.6 | N1766 K1771 S1772 | N1766-N1768 CarbonylContact O-C 2.8Å; N1766-N1768 WeakPolarHBondContact O-CA 3.4Å; N1766-N1768 PolarHBondContact O-N 3.29Å; N1768-K1771 PolarHBondContact O-N 2.89Å; N1768-S1772 PolarHBondContact O-N 3.04Å; N1768-S1772 VanDerWaalsContact O-N 3.13Å |
| 1769 | I | 48.3 | Very low | 49.9 | Very low | 100 Ų | 100 | 94.8 Ų | 94.8 | 51% | 0.513 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -60.7 | -44.8 | 170.1 | -64.8 | 174.4 | 0 | 0 | 0 | 110.6 | N1766 S1767 K1771 S1772 L1773 | N1766-I1769 PolarHBondContact O-N 3.38Å; S1767-I1769 VanDerWaalsContact C-N 3.25Å; S1767-I1769 PolarHBondContact O-N 2.96Å; I1769-K1771 VanDerWaalsContact C-N 3.34Å; I1769-K1771 PolarHBondContact O-N 2.8Å; I1769-S1772 PolarHBondContact O-N 3.36Å; I1769-L1773 HydrophobicContact CG2-CD1 3.98Å; I1769-L1773 PolarHBondContact O-N 3.33Å |
| 1770 | L | 50.2 | Low | 49.7 | Very low | 123 Ų | 123 | 96.3 Ų | 96.3 | 64% | 0.644 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -66.3 | -36 | -178.8 | -161.8 | 76.6 | 0 | 0 | 0 | 111.8 | S1767 K1774 | S1767-L1770 WeakPolarHBondContact O-CB 3.45Å; S1767-L1770 PolarHBondContact O-N 2.71Å; L1770-K1774 WeakPolarHBondContact O-CB 3.4Å; L1770-K1774 PolarHBondContact O-N 3.44Å; L1770-K1774 VanDerWaalsContact O-N 3.09Å |
| 1771 | K | 60.5 | Low | 49.6 | Very low | 144 Ų | 144 | 94.1 Ų | 94.1 | 63% | 0.626 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -66.1 | -42.2 | 173.5 | -78.6 | 173.8 | 178.5 | 161.7 | 0 | 112.4 | S1767 N1768 I1769 A1775 | S1767-K1771 PolarHBondContact O-N 2.77Å; N1768-K1771 PolarHBondContact O-N 2.89Å; I1769-K1771 VanDerWaalsContact C-N 3.34Å; I1769-K1771 PolarHBondContact O-N 2.8Å; K1771-A1775 PolarHBondContact O-N 3.33Å; K1771-A1775 VanDerWaalsContact O-N 3.12Å |
| 1772 | S | 53 | Low | 50 | Low | 70 Ų | 70 | 95 Ų | 95 | 49% | 0.49 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.9 | -47.3 | -179.8 | -165.5 | 0 | 0 | 0 | 0 | 112.4 | N1768 I1769 K1774 A1775 Q1776 | N1768-S1772 PolarHBondContact O-N 3.04Å; N1768-S1772 VanDerWaalsContact O-N 3.13Å; I1769-S1772 PolarHBondContact O-N 3.36Å; S1772-K1774 VanDerWaalsContact C-N 3.33Å; S1772-K1774 PolarHBondContact O-N 2.82Å; S1772-A1775 PolarHBondContact O-N 2.76Å; S1772-Q1776 PolarHBondContact O-N 3.3Å |
| 1773 | L | 46.1 | Very low | 49.9 | Very low | 94 Ų | 94 | 100.2 Ų | 100.2 | 49% | 0.492 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.7 | -40.7 | 176.4 | -93.1 | 160 | 0 | 0 | 0 | 111.9 | I1769 A1775 Q1776 M1777 | I1769-L1773 HydrophobicContact CG2-CD1 3.98Å; I1769-L1773 PolarHBondContact O-N 3.33Å; L1773-A1775 VanDerWaalsContact C-N 3.33Å; L1773-A1775 PolarHBondContact O-N 3.33Å; L1773-Q1776 PolarHBondContact O-N 2.74Å; L1773-Q1776 VanDerWaalsContact O-N 3.14Å; L1773-M1777 PolarHBondContact O-N 2.77Å |
| 1774 | K | 55.8 | Low | 49.5 | Very low | 146 Ų | 146 | 104.8 Ų | 104.8 | 64% | 0.635 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.1 | -35.2 | 177.9 | -166.3 | 166.6 | -171.4 | 172.5 | 0 | 112.6 | L1770 S1772 Q1776 T1778 | L1770-K1774 WeakPolarHBondContact O-CB 3.4Å; L1770-K1774 PolarHBondContact O-N 3.44Å; L1770-K1774 VanDerWaalsContact O-N 3.09Å; S1772-K1774 VanDerWaalsContact C-N 3.33Å; S1772-K1774 PolarHBondContact O-N 2.82Å; K1774-Q1776 VanDerWaalsContact C-N 3.29Å; K1774-Q1776 PolarHBondContact O-N 3.23Å; K1774-T1778 WeakPolarHBondContact O-CB 3.15Å; K1774-T1778 PolarHBondContact O-N 2.87Å; K1774-T1778 PolarHBondContact O-OG1 2.74Å; K1774-T1778 VanDerWaalsContact O-OG1 3.07Å |
| 1775 | A | 59.9 | Low | 49.6 | Very low | 64 Ų | 64 | 106.4 Ų | 106.4 | 53% | 0.529 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -69.1 | -24.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | K1771 S1772 L1773 | K1771-A1775 PolarHBondContact O-N 3.33Å; K1771-A1775 VanDerWaalsContact O-N 3.12Å; S1772-A1775 PolarHBondContact O-N 2.76Å; L1773-A1775 VanDerWaalsContact C-N 3.33Å; L1773-A1775 PolarHBondContact O-N 3.33Å |
| 1776 | Q | 54.4 | Low | 49.6 | Very low | 129 Ų | 129 | 110.1 Ų | 110.1 | 60% | 0.603 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -86.2 | -40.8 | 174.3 | -69.6 | -179.4 | -11.8 | 0 | 0 | 112.1 | S1772 L1773 K1774 T1778 R1779 L1780 | S1772-Q1776 PolarHBondContact O-N 3.3Å; L1773-Q1776 PolarHBondContact O-N 2.74Å; L1773-Q1776 VanDerWaalsContact O-N 3.14Å; K1774-Q1776 VanDerWaalsContact C-N 3.29Å; K1774-Q1776 PolarHBondContact O-N 3.23Å; Q1776-T1778 PolarHBondContact O-N 3.46Å; Q1776-R1779 PolarHBondContact O-N 3.42Å; Q1776-L1780 PolarHBondContact O-N 3.48Å |
| 1777 | M | 48 | Very low | 49 | Very low | 121 Ų | 121 | 113.8 Ų | 113.8 | 60% | 0.596 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -58.8 | -45.6 | 172 | -85.2 | 175.1 | 156.7 | 0 | 0 | 111.8 | L1773 R1779 L1780 D1781 | L1773-M1777 PolarHBondContact O-N 2.77Å; M1777-R1779 PolarHBondContact O-N 2.64Å; M1777-L1780 PolarHBondContact O-N 3.31Å; M1777-D1781 WeakPolarHBondContact O-CB 3.1Å; M1777-D1781 VanDerWaalsContact O-CG 3.26Å; M1777-D1781 PolarHBondContact O-N 2.91Å |
| 1778 | T | 56.6 | Low | 48.7 | Very low | 71 Ų | 71 | 118.2 Ų | 118.2 | 44% | 0.436 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -72.3 | 6.7 | 176.6 | -49.4 | 0 | 0 | 0 | 0 | 114.2 | K1774 Q1776 | K1774-T1778 WeakPolarHBondContact O-CB 3.15Å; K1774-T1778 PolarHBondContact O-N 2.87Å; K1774-T1778 PolarHBondContact O-OG1 2.74Å; K1774-T1778 VanDerWaalsContact O-OG1 3.07Å; Q1776-T1778 PolarHBondContact O-N 3.46Å |
| 1779 | R | 52.2 | Low | 48.3 | Very low | 192 Ų | 192 | 118.4 Ų | 118.4 | 73% | 0.725 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -97.4 | -47.5 | 159.3 | -79.8 | -175.7 | 168.4 | 177.4 | -4.7 | 111.5 | Q1776 M1777 D1781 K1782 E1783 | Q1776-R1779 PolarHBondContact O-N 3.42Å; M1777-R1779 PolarHBondContact O-N 2.64Å; R1779-D1781 VanDerWaalsContact C-N 3.33Å; R1779-D1781 PolarHBondContact O-N 2.63Å; R1779-K1782 WeakPolarHBondContact O-CA 3.47Å; R1779-K1782 WeakPolarHBondContact O-CB 3.11Å; R1779-K1782 PolarHBondContact O-N 3.23Å; R1779-E1783 PolarHBondContact O-N 3.19Å |
| 1780 | L | 44.6 | Very low | 47.9 | Very low | 108 Ų | 108 | 122 Ų | 122 | 57% | 0.565 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -58.6 | -43.2 | 175.8 | -127.1 | 73.8 | 0 | 0 | 0 | 112.2 | Q1776 M1777 K1782 E1783 I1784 | Q1776-L1780 PolarHBondContact O-N 3.48Å; M1777-L1780 PolarHBondContact O-N 3.31Å; L1780-K1782 PolarHBondContact O-N 2.95Å; L1780-E1783 PolarHBondContact O-N 2.81Å; L1780-E1783 VanDerWaalsContact O-N 3.16Å; L1780-I1784 WeakPolarHBondContact O-CG1 3.17Å; L1780-I1784 PolarHBondContact O-N 3.42Å; L1780-I1784 VanDerWaalsContact O-N 3.14Å |
| 1781 | D | 48.3 | Very low | 47.4 | Very low | 102 Ų | 102 | 120.1 Ų | 120.1 | 55% | 0.545 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -60.1 | -12.1 | 174.1 | -66.5 | -27.3 | 0 | 0 | 0 | 113.3 | M1777 R1779 D1785 | M1777-D1781 WeakPolarHBondContact O-CB 3.1Å; M1777-D1781 VanDerWaalsContact O-CG 3.26Å; M1777-D1781 PolarHBondContact O-N 2.91Å; R1779-D1781 VanDerWaalsContact C-N 3.33Å; R1779-D1781 PolarHBondContact O-N 2.63Å; D1781-D1785 WeakPolarHBondContact O-CB 3.42Å |
| 1782 | K | 47.1 | Very low | 46.5 | Very low | 160 Ų | 160 | 118.5 Ų | 118.5 | 70% | 0.696 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -107.6 | -13.6 | 178.9 | -75.9 | -162.9 | 166.9 | -154.3 | 0 | 114.8 | R1779 L1780 | R1779-K1782 WeakPolarHBondContact O-CA 3.47Å; R1779-K1782 WeakPolarHBondContact O-CB 3.11Å; R1779-K1782 PolarHBondContact O-N 3.23Å; L1780-K1782 PolarHBondContact O-N 2.95Å |
| 1783 | E | 41.2 | Very low | 46 | Very low | 142 Ų | 142 | 120.1 Ų | 120.1 | 66% | 0.664 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -90.9 | -26.2 | 170 | -71 | 170.7 | 142 | 0 | 0 | 110.4 | R1779 L1780 | R1779-E1783 PolarHBondContact O-N 3.19Å; L1780-E1783 PolarHBondContact O-N 2.81Å; L1780-E1783 VanDerWaalsContact O-N 3.16Å |
| 1784 | I | 43.7 | Very low | 45.9 | Very low | 99 Ų | 99 | 122 Ų | 122 | 51% | 0.508 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.8 | -22.8 | 175.7 | -64.1 | 169.3 | 0 | 0 | 0 | 112.8 | L1780 F1786 L1788 | L1780-I1784 WeakPolarHBondContact O-CG1 3.17Å; L1780-I1784 PolarHBondContact O-N 3.42Å; L1780-I1784 VanDerWaalsContact O-N 3.14Å; I1784-F1786 PolarHBondContact O-N 3.43Å; I1784-L1788 HydrophobicContact CG2-CD1 4.26Å |
| 1785 | D | 44.5 | Very low | 45.3 | Very low | 101 Ų | 101 | 120.9 Ų | 120.9 | 54% | 0.54 | 61% | 0.606 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.9 | 12.4 | -177 | -167.3 | 43.9 | 0 | 0 | 0 | 114.2 | D1781 K1789 | D1781-D1785 WeakPolarHBondContact O-CB 3.42Å; D1785-K1789 PolarHBondContact O-NZ 3.22Å; D1785-K1789 IonicContact OD1-NZ 2.83Å; D1785-K1789 PolarHBondContact OD1-NZ 3.48Å; D1785-K1789 IonicContact OD2-NZ 2.75Å; D1785-K1789 PolarHBondContact OD2-NZ 2.83Å; D1785-K1789 VanDerWaalsContact OD2-NZ 3.15Å |
| 1786 | F | 40.5 | Very low | 44.6 | Very low | 167 Ų | 167 | 123.9 Ų | 123.9 | 73% | 0.732 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.9 | -50.8 | 178 | -156.9 | -100.1 | 0 | 0 | 0 | 112 | I1784 L1788 K1789 | I1784-F1786 PolarHBondContact O-N 3.43Å; F1786-L1788 PolarHBondContact O-N 2.81Å; F1786-L1788 VanDerWaalsContact O-N 3.13Å; F1786-K1789 PolarHBondContact O-N 2.72Å |
| 1787 | D | 38.1 | Very low | 44.4 | Very low | 134 Ų | 134 | 122.1 Ų | 122.1 | 72% | 0.717 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | 0.4 | -175.2 | -64.9 | -2.3 | 0 | 0 | 0 | 114.7 | ||
| 1788 | L | 41.4 | Very low | 44.4 | Very low | 108 Ų | 108 | 122.4 Ų | 122.4 | 57% | 0.565 | 61% | 0.607 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.1 | 11.4 | 178.9 | -82.5 | 167.8 | 0 | 0 | 0 | 113.9 | I1784 F1786 | I1784-L1788 HydrophobicContact CG2-CD1 4.26Å; F1786-L1788 PolarHBondContact O-N 2.81Å; F1786-L1788 VanDerWaalsContact O-N 3.13Å |
| 1789 | K | 40.6 | Very low | 43.7 | Very low | 111 Ų | 111 | 122.1 Ų | 122.1 | 48% | 0.483 | 61% | 0.607 | S | S | . | * | S | Bend | trans | -111.2 | -1.1 | 178.3 | -68.7 | -164.7 | -178.3 | 73.8 | 0 | 115.2 | D1785 F1786 | D1785-K1789 PolarHBondContact O-NZ 3.22Å; D1785-K1789 IonicContact OD1-NZ 2.83Å; D1785-K1789 PolarHBondContact OD1-NZ 3.48Å; D1785-K1789 IonicContact OD2-NZ 2.75Å; D1785-K1789 PolarHBondContact OD2-NZ 2.83Å; D1785-K1789 VanDerWaalsContact OD2-NZ 3.15Å; F1786-K1789 PolarHBondContact O-N 2.72Å |
| 1790 | E | 39 | Very low | 43.8 | Very low | 176 Ų | 176 | 117.6 Ų | 117.6 | 82% | 0.822 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -104.2 | -9.6 | -177.5 | -156.9 | 162.7 | -142.5 | 0 | 0 | 113.2 | ||
| 1791 | T | 39.8 | Very low | 44 | Very low | 83 Ų | 83 | 117.4 Ų | 117.4 | 51% | 0.509 | 59% | 0.593 | S | S | . | * | S | Bend | trans | -87.2 | -45.7 | 172.6 | 47.4 | 0 | 0 | 0 | 0 | 112.9 | L1793 L1794 | T1791-L1793 VanDerWaalsContact C-N 3.25Å; T1791-L1793 PolarHBondContact O-N 3.35Å; T1791-L1794 PolarHBondContact O-N 3.14Å |
| 1792 | D | 42.1 | Very low | 44 | Very low | 110 Ų | 110 | 117.9 Ų | 117.9 | 59% | 0.588 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.5 | -25.7 | -169.9 | -62.9 | 15.9 | 0 | 0 | 0 | 112 | L1794 E1796 | D1792-L1794 VanDerWaalsContact C-N 3.28Å; D1792-L1794 PolarHBondContact O-N 3.41Å; D1792-E1796 PolarHBondContact O-N 3.44Å |
| 1793 | L | 43.3 | Very low | 44.3 | Very low | 104 Ų | 104 | 115.4 Ų | 115.4 | 55% | 0.545 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -73.8 | -10.5 | 174.4 | -78.7 | 171.2 | 0 | 0 | 0 | 114.1 | T1791 N1797 | T1791-L1793 VanDerWaalsContact C-N 3.25Å; T1791-L1793 PolarHBondContact O-N 3.35Å; L1793-N1797 PolarHBondContact O-ND2 3.01Å |
| 1794 | L | 42.5 | Very low | 44.9 | Very low | 133 Ų | 133 | 115.7 Ų | 115.7 | 70% | 0.696 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -85.8 | -44.1 | 179.4 | -146 | 77.6 | 0 | 0 | 0 | 111.8 | T1791 D1792 L1798 | T1791-L1794 PolarHBondContact O-N 3.14Å; D1792-L1794 VanDerWaalsContact C-N 3.28Å; D1792-L1794 PolarHBondContact O-N 3.41Å; L1794-L1798 PolarHBondContact O-N 2.89Å |
| 1795 | D | 43.7 | Very low | 45.3 | Very low | 124 Ų | 124 | 116.5 Ų | 116.5 | 66% | 0.663 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -71.7 | -35.4 | 178 | -69.2 | -14.8 | 0 | 0 | 0 | 111.8 | N1797 L1798 C1799 | D1795-N1797 VanDerWaalsContact C-N 3.34Å; D1795-N1797 PolarHBondContact O-N 3.11Å; D1795-L1798 PolarHBondContact O-N 3Å; D1795-C1799 PolarHBondContact O-N 2.57Å |
| 1796 | E | 46 | Very low | 45.5 | Very low | 127 Ų | 127 | 119.4 Ų | 119.4 | 59% | 0.593 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -67.7 | -31.5 | 180 | -163.4 | 169 | -127.7 | 0 | 0 | 112.6 | D1792 L1800 | D1792-E1796 PolarHBondContact O-N 3.44Å; E1796-L1800 WeakPolarHBondContact O-CG 3.3Å; E1796-L1800 PolarHBondContact O-N 3.08Å |
| 1797 | N | 49.4 | Very low | 45.9 | Very low | 91 Ų | 91 | 117.5 Ų | 117.5 | 49% | 0.487 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -76 | -36.1 | 173.2 | -80.8 | -75.2 | 0 | 0 | 0 | 112.8 | L1793 D1795 C1799 L1800 E1801 | L1793-N1797 PolarHBondContact O-ND2 3.01Å; D1795-N1797 VanDerWaalsContact C-N 3.34Å; D1795-N1797 PolarHBondContact O-N 3.11Å; N1797-C1799 VanDerWaalsContact C-N 3.29Å; N1797-C1799 PolarHBondContact O-N 3.26Å; N1797-L1800 PolarHBondContact O-N 3.02Å; N1797-E1801 PolarHBondContact O-N 3.23Å |
| 1798 | L | 47.9 | Very low | 46.3 | Very low | 127 Ų | 127 | 117.5 Ų | 117.5 | 67% | 0.665 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.7 | -39.6 | 178.4 | -157.2 | 78.2 | 0 | 0 | 0 | 111.3 | L1794 D1795 E1802 | L1794-L1798 PolarHBondContact O-N 2.89Å; D1795-L1798 PolarHBondContact O-N 3Å; L1798-E1802 PolarHBondContact O-N 3.44Å |
| 1799 | C | 42 | Very low | 46.6 | Very low | 65 Ų | 65 | 120 Ų | 120 | 44% | 0.439 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.2 | -34.2 | 177.4 | -167.4 | 0 | 0 | 0 | 0 | 113 | D1795 N1797 Q1803 | D1795-C1799 PolarHBondContact O-N 2.57Å; N1797-C1799 VanDerWaalsContact C-N 3.29Å; N1797-C1799 PolarHBondContact O-N 3.26Å; C1799-Q1803 WeakPolarHBondContact O-CG 3.47Å; C1799-Q1803 PolarHBondContact O-N 2.78Å |
| 1800 | L | 53.7 | Low | 46.7 | Very low | 97 Ų | 97 | 121.4 Ų | 121.4 | 51% | 0.508 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -70.8 | -36.7 | 177.8 | -76.6 | 168.2 | 0 | 0 | 0 | 112.9 | E1796 N1797 Q1803 R1804 | E1796-L1800 WeakPolarHBondContact O-CG 3.3Å; E1796-L1800 PolarHBondContact O-N 3.08Å; N1797-L1800 PolarHBondContact O-N 3.02Å; L1800-Q1803 PolarHBondContact O-N 2.75Å; L1800-R1804 PolarHBondContact O-N 2.81Å; L1800-R1804 VanDerWaalsContact O-N 3.12Å |
| 1801 | E | 50.3 | Low | 46.9 | Very low | 104 Ų | 104 | 120.9 Ų | 120.9 | 49% | 0.486 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -71.4 | -36.5 | 176.4 | -135.4 | 71.7 | -132.5 | 0 | 0 | 111.6 | N1797 R1804 L1805 | N1797-E1801 PolarHBondContact O-N 3.23Å; E1801-R1804 WeakPolarHBondContact O-CB 3.33Å; E1801-R1804 PolarHBondContact O-N 3.18Å; E1801-R1804 IonicContact OE1-NH1 3.48Å; E1801-R1804 PolarHBondContact OE1-NH1 3.41Å; E1801-L1805 PolarHBondContact O-N 3.39Å; E1801-L1805 VanDerWaalsContact O-N 3.15Å |
| 1802 | E | 47.9 | Very low | 47.1 | Very low | 112 Ų | 112 | 123.7 Ų | 123.7 | 52% | 0.523 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.5 | -40.3 | 170.6 | -77.7 | -158.8 | 142.7 | 0 | 0 | 113 | L1798 R1804 L1805 R1806 | L1798-E1802 PolarHBondContact O-N 3.44Å; E1802-R1804 VanDerWaalsContact C-N 3.26Å; E1802-R1804 PolarHBondContact O-N 2.87Å; E1802-L1805 PolarHBondContact O-N 2.97Å; E1802-R1806 WeakPolarHBondContact O-CG 3.19Å; E1802-R1806 PolarHBondContact O-N 2.72Å; E1802-R1806 VanDerWaalsContact O-N 3.1Å |
| 1803 | Q | 52.2 | Low | 47.1 | Very low | 108 Ų | 108 | 127 Ų | 127 | 51% | 0.505 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.3 | -34.9 | 175.9 | -78.6 | -177.4 | -0.3 | 0 | 0 | 111.8 | C1799 L1800 R1806 Q1807 | C1799-Q1803 WeakPolarHBondContact O-CG 3.47Å; C1799-Q1803 PolarHBondContact O-N 2.78Å; L1800-Q1803 PolarHBondContact O-N 2.75Å; Q1803-R1806 PolarHBondContact O-N 2.93Å; Q1803-Q1807 WeakPolarHBondContact O-CG 3.35Å; Q1803-Q1807 PolarHBondContact O-N 3.39Å |
| 1804 | R | 55.4 | Low | 46.7 | Very low | 149 Ų | 149 | 128.7 Ų | 128.7 | 56% | 0.562 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -62.4 | -49.5 | 174.1 | -122.8 | 173.8 | 169.9 | -177.1 | -5.6 | 112.7 | L1800 E1801 E1802 R1806 Q1807 E1808 | L1800-R1804 PolarHBondContact O-N 2.81Å; L1800-R1804 VanDerWaalsContact O-N 3.12Å; E1801-R1804 WeakPolarHBondContact O-CB 3.33Å; E1801-R1804 PolarHBondContact O-N 3.18Å; E1801-R1804 IonicContact OE1-NH1 3.48Å; E1801-R1804 PolarHBondContact OE1-NH1 3.41Å; E1802-R1804 VanDerWaalsContact C-N 3.26Å; E1802-R1804 PolarHBondContact O-N 2.87Å; R1804-R1806 PolarHBondContact O-N 3.49Å; R1804-Q1807 PolarHBondContact O-N 3.4Å; R1804-Q1807 VanDerWaalsContact O-N 3.15Å; R1804-E1808 PolarHBondContact O-N 3.35Å |
| 1805 | L | 51.4 | Low | 46.5 | Very low | 116 Ų | 116 | 131 Ų | 131 | 61% | 0.607 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -68 | -17.6 | 178.7 | -72.2 | 168.4 | 0 | 0 | 0 | 113.7 | E1801 E1802 | E1801-L1805 PolarHBondContact O-N 3.39Å; E1801-L1805 VanDerWaalsContact O-N 3.15Å; E1802-L1805 PolarHBondContact O-N 2.97Å |
| 1806 | R | 47.6 | Very low | 45.8 | Very low | 162 Ų | 162 | 131.8 Ų | 131.8 | 61% | 0.611 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -82.5 | -43.7 | 168 | -68.2 | 178.5 | -167.8 | -119.5 | 4.1 | 111.7 | E1802 Q1803 R1804 E1808 K1809 E1810 | E1802-R1806 WeakPolarHBondContact O-CG 3.19Å; E1802-R1806 PolarHBondContact O-N 2.72Å; E1802-R1806 VanDerWaalsContact O-N 3.1Å; Q1803-R1806 PolarHBondContact O-N 2.93Å; R1804-R1806 PolarHBondContact O-N 3.49Å; R1806-E1808 PolarHBondContact O-N 2.91Å; R1806-K1809 PolarHBondContact O-N 2.91Å; R1806-E1810 PolarHBondContact O-N 2.81Å |
| 1807 | Q | 49.1 | Very low | 45.2 | Very low | 126 Ų | 126 | 134.7 Ų | 134.7 | 59% | 0.589 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -63.2 | -40.9 | 177.8 | -75 | -175 | -30.6 | 0 | 0 | 112.8 | Q1803 R1804 K1809 E1810 E1811 | Q1803-Q1807 WeakPolarHBondContact O-CG 3.35Å; Q1803-Q1807 PolarHBondContact O-N 3.39Å; R1804-Q1807 PolarHBondContact O-N 3.4Å; R1804-Q1807 VanDerWaalsContact O-N 3.15Å; Q1807-K1809 PolarHBondContact O-N 2.86Å; Q1807-E1810 PolarHBondContact O-N 2.88Å; Q1807-E1811 PolarHBondContact O-N 3.18Å |
| 1808 | E | 46.6 | Very low | 44.4 | Very low | 134 Ų | 134 | 136.7 Ų | 136.7 | 63% | 0.626 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -67.7 | -10.7 | 174.4 | -70.9 | -178.6 | 160.5 | 0 | 0 | 113.5 | R1804 R1806 | R1804-E1808 PolarHBondContact O-N 3.35Å; R1806-E1808 PolarHBondContact O-N 2.91Å |
| 1809 | K | 48 | Very low | 43.8 | Very low | 162 Ų | 162 | 137.4 Ų | 137.4 | 70% | 0.704 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -95 | -33.5 | 168.8 | -90.2 | -168.3 | 166.8 | -165.4 | 0 | 113.8 | R1806 Q1807 | R1806-K1809 PolarHBondContact O-N 2.91Å; Q1807-K1809 PolarHBondContact O-N 2.86Å |
| 1810 | E | 42.7 | Very low | 43.3 | Very low | 140 Ų | 140 | 138.8 Ų | 138.8 | 65% | 0.654 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -77.9 | -18.9 | -177.7 | -71.6 | -178.2 | 148.6 | 0 | 0 | 113.6 | R1806 Q1807 | R1806-E1810 PolarHBondContact O-N 2.81Å; Q1807-E1810 PolarHBondContact O-N 2.88Å |
| 1811 | E | 44.1 | Very low | 42.3 | Very low | 165 Ų | 165 | 142.1 Ų | 142.1 | 77% | 0.771 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.3 | -24.2 | 177.7 | -70.1 | -161.8 | 144.7 | 0 | 0 | 114.6 | Q1807 | Q1807-E1811 PolarHBondContact O-N 3.18Š|
| 1812 | D | 44.1 | Very low | 41.5 | Very low | 142 Ų | 142 | 142.5 Ų | 142.5 | 76% | 0.759 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -27.7 | -177.1 | -92 | -19 | 0 | 0 | 0 | 114.5 | N1814 | D1812-N1814 VanDerWaalsContact C-N 3.31Å; D1812-N1814 PolarHBondContact O-N 3.4Å |
| 1813 | E | 41.7 | Very low | 40.8 | Very low | 178 Ų | 178 | 145.9 Ų | 145.9 | 83% | 0.832 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.8 | -4.5 | -174.3 | -67.3 | -166.5 | 155.4 | 0 | 0 | 114.9 | ||
| 1814 | N | 35.2 | Very low | 39.9 | Very low | 140 Ų | 140 | 148.9 Ų | 148.9 | 75% | 0.749 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.5 | 20.3 | -170.2 | -94.4 | -66 | 0 | 0 | 0 | 116.5 | D1812 | D1812-N1814 VanDerWaalsContact C-N 3.31Å; D1812-N1814 PolarHBondContact O-N 3.4Å |
| 1815 | Q | 38.3 | Very low | 39.1 | Very low | 182 Ų | 182 | 150.8 Ų | 150.8 | 85% | 0.85 | 75% | 0.745 | S | S | * | * | trans | -108.4 | 104.5 | 165.8 | -68 | -162.3 | 33 | 0 | 0 | 112.5 | F1817 | Q1815-F1817 PolarHBondContact O-N 2.79Š| ||
| 1816 | T | 28.4 | Very low | 38.7 | Very low | 141 Ų | 141 | 148.6 Ų | 148.6 | 87% | 0.865 | 74% | 0.739 | S | S | * | * | trans | -73.8 | 119 | 179.5 | 27.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 1817 | F | 32.3 | Very low | 38.9 | Very low | 187 Ų | 187 | 146.3 Ų | 146.3 | 82% | 0.82 | 74% | 0.735 | S | S | * | * | trans | -140 | 122 | 166.4 | -120 | -86.6 | 0 | 0 | 0 | 112.4 | Q1815 L1819 | Q1815-F1817 PolarHBondContact O-N 2.79Å; F1817-L1819 PolarHBondContact O-N 2.97Å | ||
| 1818 | D | 33.4 | Very low | 39.2 | Very low | 134 Ų | 134 | 147.2 Ų | 147.2 | 72% | 0.717 | 74% | 0.74 | S | S | * | * | trans | -69 | 114.8 | 173.9 | 174.8 | -9.5 | 0 | 0 | 0 | 109.9 | S1820 | D1818-S1820 WeakPolarHBondContact OD1-CB 3.4Å; D1818-S1820 PolarHBondContact OD1-N 3.17Å; D1818-S1820 VanDerWaalsContact OD1-N 3.09Å; D1818-S1820 PolarHBondContact OD1-OG 3.34Å | ||
| 1819 | L | 36.1 | Very low | 39.5 | Very low | 141 Ų | 141 | 145.5 Ų | 145.5 | 74% | 0.738 | 73% | 0.732 | S | S | * | * | trans | -117.6 | 51 | 180 | -94.4 | 170.3 | 0 | 0 | 0 | 113.2 | F1817 K1821 | F1817-L1819 PolarHBondContact O-N 2.97Å; L1819-K1821 PolarHBondContact O-N 3.38Å | ||
| 1820 | S | 30 | Very low | 39.6 | Very low | 95 Ų | 95 | 143.2 Ų | 143.2 | 66% | 0.664 | 72% | 0.719 | S | S | * | * | trans | -65.9 | 45.7 | 156.7 | 51.3 | 0 | 0 | 0 | 0 | 113.5 | D1818 | D1818-S1820 WeakPolarHBondContact OD1-CB 3.4Å; D1818-S1820 PolarHBondContact OD1-N 3.17Å; D1818-S1820 VanDerWaalsContact OD1-N 3.09Å; D1818-S1820 PolarHBondContact OD1-OG 3.34Å | ||
| 1821 | K | 34.4 | Very low | 40.4 | Very low | 167 Ų | 167 | 144.7 Ų | 144.7 | 73% | 0.726 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -161.4 | 128.7 | 174.5 | -110.6 | 145.2 | -167 | 159.7 | 0 | 116.8 | L1819 | L1819-K1821 PolarHBondContact O-N 3.38Š|
| 1822 | S | 31.7 | Very low | 41.3 | Very low | 111 Ų | 111 | 142.8 Ų | 142.8 | 78% | 0.776 | 71% | 0.707 | S | S | * | * | trans | 55.7 | 112.6 | 148.5 | 54 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 1823 | Q | 33.7 | Very low | 41.6 | Very low | 183 Ų | 183 | 142.6 Ų | 142.6 | 86% | 0.855 | 70% | 0.702 | S | S | * | * | trans | -38.7 | 161.4 | 145.9 | -58.9 | 161.4 | -43.5 | 0 | 0 | 114 | ||||
| 1824 | L | 34.3 | Very low | 42.4 | Very low | 171 Ų | 171 | 139.1 Ų | 139.1 | 90% | 0.895 | 69% | 0.686 | S | S | * | * | trans | 100.2 | 80.7 | 175.7 | -59.2 | 167.8 | 0 | 0 | 0 | 115.4 | ||||
| 1825 | F | 38.2 | Very low | 43.8 | Very low | 189 Ų | 189 | 139.1 Ų | 139.1 | 83% | 0.829 | 68% | 0.681 | S | S | * | * | trans | -115 | 159 | 152.2 | -103.4 | -89.4 | 0 | 0 | 0 | 110.3 | E1829 | F1825-E1829 WeakPolarHBondContact CD1-OE2 3.39Š| ||
| 1826 | S | 41.8 | Very low | 44.6 | Very low | 70 Ų | 70 | 136.6 Ų | 136.6 | 49% | 0.49 | 67% | 0.673 | S | S | . | * | trans | -81.2 | 145.3 | -162.8 | 14.2 | 0 | 0 | 0 | 0 | 115.5 | E1828 E1829 | S1826-E1828 PolarHBondContact O-N 3Å; S1826-E1829 PolarHBondContact O-N 2.84Å; S1826-E1829 PolarHBondContact OG-OE2 3.45Å; S1826-E1829 VanDerWaalsContact OG-OE2 3.09Å | ||
| 1827 | E | 51.8 | Low | 45.6 | Very low | 114 Ų | 114 | 135.2 Ų | 135.2 | 53% | 0.533 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -51.3 | -22.6 | 174.5 | -153.4 | 92.3 | -127.7 | 0 | 0 | 114.5 | R1830 R1831 | E1827-R1830 IonicContact OE1-CZ 2.75Å; E1827-R1830 VanDerWaalsContact OE1-CZ 3.23Å; E1827-R1830 IonicContact OE1-NH1 3.04Å; E1827-R1830 PolarHBondContact OE1-NH1 3.37Å; E1827-R1830 IonicContact OE1-NH2 3.82Å; E1827-R1830 PolarHBondContact OE1-NH2 2.93Å; E1827-R1831 WeakPolarHBondContact O-CG 3.47Å; E1827-R1831 PolarHBondContact O-N 2.9Å |
| 1828 | E | 56.7 | Low | 46.9 | Very low | 146 Ų | 146 | 130.4 Ų | 130.4 | 68% | 0.682 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -89.8 | -13.2 | -170.7 | -164.4 | 160.2 | -163.6 | 0 | 0 | 114.1 | S1826 | S1826-E1828 PolarHBondContact O-N 3Å |
| 1829 | E | 52.4 | Low | 48 | Very low | 97 Ų | 97 | 128.9 Ų | 128.9 | 45% | 0.453 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -89 | -44.9 | 170.1 | -75.8 | 157.5 | 140.2 | 0 | 0 | 110.6 | F1825 S1826 R1831 K1832 E1833 | F1825-E1829 WeakPolarHBondContact CD1-OE2 3.39Å; S1826-E1829 PolarHBondContact O-N 2.84Å; S1826-E1829 PolarHBondContact OG-OE2 3.45Å; S1826-E1829 VanDerWaalsContact OG-OE2 3.09Å; E1829-R1831 PolarHBondContact O-N 3.38Å; E1829-R1831 VanDerWaalsContact O-N 3.17Å; E1829-K1832 WeakPolarHBondContact O-CB 3.49Å; E1829-K1832 PolarHBondContact O-N 3.32Å; E1829-E1833 PolarHBondContact O-N 3.26Å |
| 1830 | R | 49.7 | Very low | 48.4 | Very low | 115 Ų | 115 | 124.9 Ų | 124.9 | 43% | 0.434 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -53.7 | -38.6 | 173.6 | -154.1 | -150.5 | -49.8 | 127.2 | 6.6 | 112.2 | E1827 K1832 E1833 E1834 | E1827-R1830 IonicContact OE1-CZ 2.75Å; E1827-R1830 VanDerWaalsContact OE1-CZ 3.23Å; E1827-R1830 IonicContact OE1-NH1 3.04Å; E1827-R1830 PolarHBondContact OE1-NH1 3.37Å; E1827-R1830 IonicContact OE1-NH2 3.82Å; E1827-R1830 PolarHBondContact OE1-NH2 2.93Å; R1830-K1832 VanDerWaalsContact C-N 3.3Å; R1830-K1832 PolarHBondContact O-N 3.29Å; R1830-E1833 PolarHBondContact O-N 3.07Å; R1830-E1834 VanDerWaalsContact CD-OE1 3.24Å; R1830-E1834 WeakPolarHBondContact CD-OE1 3.3Å; R1830-E1834 WeakPolarHBondContact O-CB 3.4Å; R1830-E1834 WeakPolarHBondContact O-CG 3.28Å; R1830-E1834 PolarHBondContact O-N 3.4Å |
| 1831 | R | 60.7 | Low | 49.3 | Very low | 170 Ų | 170 | 126.7 Ų | 126.7 | 64% | 0.642 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -62.1 | -30.6 | 175.2 | -85.1 | -176.3 | 173.3 | -174.3 | -0.7 | 114.3 | E1827 E1829 E1835 | E1827-R1831 WeakPolarHBondContact O-CG 3.47Å; E1827-R1831 PolarHBondContact O-N 2.9Å; E1829-R1831 PolarHBondContact O-N 3.38Å; E1829-R1831 VanDerWaalsContact O-N 3.17Å; R1831-E1835 VanDerWaalsContact O-CB 3.22Å; R1831-E1835 WeakPolarHBondContact O-CB 3.3Å; R1831-E1835 PolarHBondContact O-N 2.88Å |
| 1832 | K | 61.4 | Low | 50.4 | Low | 126 Ų | 126 | 125.1 Ų | 125.1 | 55% | 0.548 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -78.8 | -34.7 | 178.4 | -70.5 | 174.6 | -177.2 | 165.4 | 0 | 111.8 | E1829 R1830 E1835 L1836 | E1829-K1832 WeakPolarHBondContact O-CB 3.49Å; E1829-K1832 PolarHBondContact O-N 3.32Å; R1830-K1832 VanDerWaalsContact C-N 3.3Å; R1830-K1832 PolarHBondContact O-N 3.29Å; K1832-E1835 PolarHBondContact O-N 3.28Å; K1832-L1836 WeakPolarHBondContact O-CB 3.24Å; K1832-L1836 WeakPolarHBondContact O-CG 3.42Å; K1832-L1836 PolarHBondContact O-N 3.44Å |
| 1833 | E | 50.9 | Low | 51 | Low | 137 Ų | 137 | 125.8 Ų | 125.8 | 64% | 0.64 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -67.1 | -45 | 170.5 | -64.2 | -179.8 | 126.6 | 0 | 0 | 110.9 | E1829 R1830 E1835 L1836 L1837 | E1829-E1833 PolarHBondContact O-N 3.26Å; R1830-E1833 PolarHBondContact O-N 3.07Å; E1833-E1835 VanDerWaalsContact C-N 3.33Å; E1833-E1835 PolarHBondContact O-N 3.47Å; E1833-L1836 PolarHBondContact O-N 3.31Å; E1833-L1837 WeakPolarHBondContact O-CB 3.5Å; E1833-L1837 PolarHBondContact O-N 3.3Å |
| 1834 | E | 58.6 | Low | 51.6 | Low | 106 Ų | 106 | 122.1 Ų | 122.1 | 50% | 0.495 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -58.7 | -41 | 173 | -74.7 | 171.1 | -176.6 | 0 | 0 | 112 | R1830 L1838 | R1830-E1834 VanDerWaalsContact CD-OE1 3.24Å; R1830-E1834 WeakPolarHBondContact CD-OE1 3.3Å; R1830-E1834 WeakPolarHBondContact O-CB 3.4Å; R1830-E1834 WeakPolarHBondContact O-CG 3.28Å; R1830-E1834 PolarHBondContact O-N 3.4Å; E1834-L1838 WeakPolarHBondContact O-CB 3.33Å; E1834-L1838 PolarHBondContact O-N 3.4Å |
| 1835 | E | 64.5 | Low | 52.2 | Low | 140 Ų | 140 | 119.8 Ų | 119.8 | 65% | 0.654 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -71.1 | -40.3 | 178.9 | -168.7 | 163.4 | -128 | 0 | 0 | 112.5 | R1831 K1832 E1833 E1839 | R1831-E1835 VanDerWaalsContact O-CB 3.22Å; R1831-E1835 WeakPolarHBondContact O-CB 3.3Å; R1831-E1835 PolarHBondContact O-N 2.88Å; K1832-E1835 PolarHBondContact O-N 3.28Å; E1833-E1835 VanDerWaalsContact C-N 3.33Å; E1833-E1835 PolarHBondContact O-N 3.47Å; E1835-E1839 WeakPolarHBondContact O-CB 3.32Å; E1835-E1839 PolarHBondContact O-N 3.48Å |
| 1836 | L | 55.7 | Low | 53 | Low | 129 Ų | 129 | 113.7 Ų | 113.7 | 68% | 0.675 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.6 | -39.4 | 173.6 | -78.4 | 168.4 | 0 | 0 | 0 | 112.8 | K1832 E1833 E1839 S1840 | K1832-L1836 WeakPolarHBondContact O-CB 3.24Å; K1832-L1836 WeakPolarHBondContact O-CG 3.42Å; K1832-L1836 PolarHBondContact O-N 3.44Å; E1833-L1836 PolarHBondContact O-N 3.31Å; L1836-E1839 PolarHBondContact O-N 3.21Å; L1836-S1840 PolarHBondContact O-N 3.22Å; L1836-S1840 PolarHBondContact O-OG 2.85Å |
| 1837 | L | 49.2 | Very low | 53 | Low | 111 Ų | 111 | 117.2 Ų | 117.2 | 58% | 0.581 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -74.2 | -28.6 | 179.3 | -163.1 | 149.4 | 0 | 0 | 0 | 111.8 | E1833 S1840 K1841 | E1833-L1837 WeakPolarHBondContact O-CB 3.5Å; E1833-L1837 PolarHBondContact O-N 3.3Å; L1837-S1840 PolarHBondContact O-OG 3.06Å; L1837-S1840 VanDerWaalsContact O-OG 3.13Å; L1837-K1841 WeakPolarHBondContact O-CB 3.43Å; L1837-K1841 PolarHBondContact O-N 3.03Å; L1837-K1841 VanDerWaalsContact O-N 3.13Å |
| 1838 | L | 58.9 | Low | 52.8 | Low | 86 Ų | 86 | 116 Ų | 116 | 45% | 0.45 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -70.1 | -40.3 | 169 | -173.8 | 64.6 | 0 | 0 | 0 | 111.9 | E1834 K1841 R1842 | E1834-L1838 WeakPolarHBondContact O-CB 3.33Å; E1834-L1838 PolarHBondContact O-N 3.4Å; L1838-K1841 PolarHBondContact O-N 3.02Å; L1838-R1842 WeakPolarHBondContact O-CG 3.25Å; L1838-R1842 PolarHBondContact O-N 3.32Å |
| 1839 | E | 57.8 | Low | 52.6 | Low | 103 Ų | 103 | 113.6 Ų | 113.6 | 48% | 0.481 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -72.3 | -35.7 | 178.6 | -158.1 | 71.2 | 171.4 | 0 | 0 | 112.2 | E1835 L1836 R1842 L1843 | E1835-E1839 WeakPolarHBondContact O-CB 3.32Å; E1835-E1839 PolarHBondContact O-N 3.48Å; L1836-E1839 PolarHBondContact O-N 3.21Å; E1839-R1842 PolarHBondContact O-N 3.08Å; E1839-R1842 WeakPolarHBondContact OE2-CD 3.33Å; E1839-R1842 IonicContact OE2-CZ 3.62Å; E1839-R1842 IonicContact OE2-NE 2.7Å; E1839-R1842 IonicContact OE2-NH1 3.98Å; E1839-R1842 PolarHBondContact OE2-NH1 2.73Å; E1839-L1843 PolarHBondContact O-N 2.78Å |
| 1840 | S | 43.8 | Very low | 52.4 | Low | 57 Ų | 57 | 113.5 Ų | 113.5 | 40% | 0.399 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -66.2 | -40 | 171.9 | 72.4 | 0 | 0 | 0 | 0 | 112.1 | L1836 L1837 R1842 L1843 I1844 | L1836-S1840 PolarHBondContact O-N 3.22Å; L1836-S1840 PolarHBondContact O-OG 2.85Å; L1837-S1840 PolarHBondContact O-OG 3.06Å; L1837-S1840 VanDerWaalsContact O-OG 3.13Å; S1840-R1842 PolarHBondContact O-N 3.5Å; S1840-L1843 PolarHBondContact O-N 3.47Å; S1840-I1844 WeakPolarHBondContact O-CG1 3.15Å; S1840-I1844 PolarHBondContact O-N 3.03Å |
| 1841 | K | 49.4 | Very low | 52.3 | Low | 132 Ų | 132 | 110.8 Ų | 110.8 | 57% | 0.574 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -57.1 | -47.2 | 170 | -100.2 | -173.8 | 171.2 | -178.3 | 0 | 112.3 | L1837 L1838 L1843 I1844 E1845 | L1837-K1841 WeakPolarHBondContact O-CB 3.43Å; L1837-K1841 PolarHBondContact O-N 3.03Å; L1837-K1841 VanDerWaalsContact O-N 3.13Å; L1838-K1841 PolarHBondContact O-N 3.02Å; K1841-L1843 VanDerWaalsContact C-N 3.27Å; K1841-L1843 PolarHBondContact O-N 3.12Å; K1841-I1844 PolarHBondContact O-N 2.92Å; K1841-E1845 WeakPolarHBondContact O-CB 3.24Å; K1841-E1845 WeakPolarHBondContact O-CG 3.41Å; K1841-E1845 PolarHBondContact O-N 3.09Å |
| 1842 | R | 57.1 | Low | 51.7 | Low | 135 Ų | 135 | 106.4 Ų | 106.4 | 51% | 0.509 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.6 | -36.6 | 176.3 | -74.6 | 164.8 | 174.8 | 164.5 | 3.5 | 112.6 | L1838 E1839 S1840 A1846 | L1838-R1842 WeakPolarHBondContact O-CG 3.25Å; L1838-R1842 PolarHBondContact O-N 3.32Å; E1839-R1842 PolarHBondContact O-N 3.08Å; E1839-R1842 WeakPolarHBondContact OE2-CD 3.33Å; E1839-R1842 IonicContact OE2-CZ 3.62Å; E1839-R1842 IonicContact OE2-NE 2.7Å; E1839-R1842 IonicContact OE2-NH1 3.98Å; E1839-R1842 PolarHBondContact OE2-NH1 2.73Å; S1840-R1842 PolarHBondContact O-N 3.5Å; R1842-A1846 WeakPolarHBondContact O-CB 3.47Å; R1842-A1846 PolarHBondContact O-N 3.03Å |
| 1843 | L | 44 | Very low | 50.9 | Low | 125 Ų | 125 | 106.2 Ų | 106.2 | 65% | 0.654 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -72 | -38.6 | 179.5 | -132.1 | 158.6 | 0 | 0 | 0 | 111.8 | E1839 S1840 K1841 A1846 F1847 | E1839-L1843 PolarHBondContact O-N 2.78Å; S1840-L1843 PolarHBondContact O-N 3.47Å; K1841-L1843 VanDerWaalsContact C-N 3.27Å; K1841-L1843 PolarHBondContact O-N 3.12Å; L1843-A1846 PolarHBondContact O-N 3.42Å; L1843-F1847 PolarHBondContact O-N 3.01Å |
| 1844 | I | 46.6 | Very low | 50.5 | Low | 106 Ų | 106 | 106.7 Ų | 106.7 | 54% | 0.544 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.8 | -48.6 | 172.5 | -65.9 | 167.7 | 0 | 0 | 0 | 110.6 | S1840 K1841 A1846 F1847 D1848 | S1840-I1844 WeakPolarHBondContact O-CG1 3.15Å; S1840-I1844 PolarHBondContact O-N 3.03Å; K1841-I1844 PolarHBondContact O-N 2.92Å; I1844-A1846 VanDerWaalsContact C-N 3.28Å; I1844-A1846 PolarHBondContact O-N 3.01Å; I1844-F1847 PolarHBondContact O-N 3.49Å; I1844-D1848 PolarHBondContact O-N 3.19Å |
| 1845 | E | 46.7 | Very low | 49.9 | Very low | 122 Ų | 122 | 107.9 Ų | 107.9 | 57% | 0.57 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -59 | -38.2 | 175.1 | -75.7 | -172.5 | 125.9 | 0 | 0 | 112.1 | K1841 F1847 N1849 | K1841-E1845 WeakPolarHBondContact O-CB 3.24Å; K1841-E1845 WeakPolarHBondContact O-CG 3.41Å; K1841-E1845 PolarHBondContact O-N 3.09Å; E1845-F1847 VanDerWaalsContact C-N 3.35Å; E1845-N1849 VanDerWaalsContact O-CB 3.29Å; E1845-N1849 WeakPolarHBondContact O-CB 3.36Å; E1845-N1849 PolarHBondContact O-N 2.71Å; E1845-N1849 PolarHBondContact O-ND2 3.09Å |
| 1846 | A | 54.6 | Low | 48.9 | Very low | 61 Ų | 61 | 107.4 Ų | 107.4 | 50% | 0.504 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.7 | -37.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | R1842 L1843 I1844 H1850 | R1842-A1846 WeakPolarHBondContact O-CB 3.47Å; R1842-A1846 PolarHBondContact O-N 3.03Å; L1843-A1846 PolarHBondContact O-N 3.42Å; I1844-A1846 VanDerWaalsContact C-N 3.28Å; I1844-A1846 PolarHBondContact O-N 3.01Å; A1846-H1850 WeakPolarHBondContact O-CB 3.46Å; A1846-H1850 PolarHBondContact O-N 3.4Å; A1846-H1850 VanDerWaalsContact O-N 3.09Å |
| 1847 | F | 42.9 | Very low | 48.2 | Very low | 143 Ų | 143 | 106.6 Ų | 106.6 | 63% | 0.627 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -70.2 | -46.5 | 177.5 | -158.5 | -95.2 | 0 | 0 | 0 | 111.7 | L1843 I1844 E1845 N1849 H1850 V1851 | L1843-F1847 PolarHBondContact O-N 3.01Å; I1844-F1847 PolarHBondContact O-N 3.49Å; E1845-F1847 VanDerWaalsContact C-N 3.35Å; F1847-N1849 PolarHBondContact O-N 3.47Å; F1847-H1850 WeakPolarHBondContact O-CB 3.31Å; F1847-H1850 PolarHBondContact O-N 2.78Å; F1847-H1850 VanDerWaalsContact O-N 3.1Å; F1847-V1851 HydrophobicContact CD1-CG2 4.01Å; F1847-V1851 HydrophobicContact CE1-CG2 3.95Å; F1847-V1851 WeakPolarHBondContact O-CG2 3.37Å; F1847-V1851 PolarHBondContact O-N 2.8Å |
| 1848 | D | 47.4 | Very low | 48 | Very low | 88 Ų | 88 | 108.4 Ų | 108.4 | 47% | 0.471 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.3 | -41.7 | 175.7 | -91.4 | -29.5 | 0 | 0 | 0 | 112.1 | I1844 H1850 V1851 I1852 | I1844-D1848 PolarHBondContact O-N 3.19Å; D1848-H1850 VanDerWaalsContact C-N 3.26Å; D1848-H1850 PolarHBondContact O-N 2.97Å; D1848-V1851 PolarHBondContact O-N 3.12Å; D1848-I1852 WeakPolarHBondContact O-CB 3.24Å; D1848-I1852 VanDerWaalsContact O-CG1 3.23Å; D1848-I1852 WeakPolarHBondContact O-CG1 3.21Å; D1848-I1852 PolarHBondContact O-N 3.16Å |
| 1849 | N | 52.7 | Low | 47.1 | Very low | 96 Ų | 96 | 108.8 Ų | 108.8 | 51% | 0.513 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.8 | -35.1 | 172.9 | -83.5 | -73.8 | 0 | 0 | 0 | 112.1 | E1845 F1847 M1853 | E1845-N1849 VanDerWaalsContact O-CB 3.29Å; E1845-N1849 WeakPolarHBondContact O-CB 3.36Å; E1845-N1849 PolarHBondContact O-N 2.71Å; E1845-N1849 PolarHBondContact O-ND2 3.09Å; F1847-N1849 PolarHBondContact O-N 3.47Å; N1849-M1853 WeakPolarHBondContact O-CB 3.2Å; N1849-M1853 WeakPolarHBondContact O-CG 3.26Å; N1849-M1853 PolarHBondContact O-N 2.67Å |
| 1850 | H | 47.6 | Very low | 46.1 | Very low | 95 Ų | 95 | 110.4 Ų | 110.4 | 44% | 0.44 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -72.1 | -38.3 | 174.2 | -167.5 | 49.3 | 0 | 0 | 0 | 112.9 | A1846 F1847 D1848 M1853 R1854 | A1846-H1850 WeakPolarHBondContact O-CB 3.46Å; A1846-H1850 PolarHBondContact O-N 3.4Å; A1846-H1850 VanDerWaalsContact O-N 3.09Å; F1847-H1850 WeakPolarHBondContact O-CB 3.31Å; F1847-H1850 PolarHBondContact O-N 2.78Å; F1847-H1850 VanDerWaalsContact O-N 3.1Å; D1848-H1850 VanDerWaalsContact C-N 3.26Å; D1848-H1850 PolarHBondContact O-N 2.97Å; H1850-M1853 PolarHBondContact O-N 3.02Å; H1850-R1854 WeakPolarHBondContact O-CB 3.25Å; H1850-R1854 WeakPolarHBondContact O-CG 3.37Å; H1850-R1854 PolarHBondContact O-N 2.87Å |
| 1851 | V | 47 | Very low | 45.9 | Very low | 58 Ų | 58 | 113.2 Ų | 113.2 | 35% | 0.352 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.8 | -41.2 | 174.4 | 171.7 | 0 | 0 | 0 | 0 | 110.9 | F1847 D1848 R1854 K1855 | F1847-V1851 HydrophobicContact CD1-CG2 4.01Å; F1847-V1851 HydrophobicContact CE1-CG2 3.95Å; F1847-V1851 WeakPolarHBondContact O-CG2 3.37Å; F1847-V1851 PolarHBondContact O-N 2.8Å; D1848-V1851 PolarHBondContact O-N 3.12Å; V1851-R1854 CarbonylContact O-C 3.15Å; V1851-R1854 PolarHBondContact O-N 2.87Å; V1851-K1855 PolarHBondContact O-N 3.12Å |
| 1852 | I | 49 | Very low | 45.7 | Very low | 79 Ų | 79 | 112.9 Ų | 112.9 | 41% | 0.405 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.7 | -42 | 175.2 | -68.9 | 166.6 | 0 | 0 | 0 | 110.9 | D1848 K1855 K1856 | D1848-I1852 WeakPolarHBondContact O-CB 3.24Å; D1848-I1852 VanDerWaalsContact O-CG1 3.23Å; D1848-I1852 WeakPolarHBondContact O-CG1 3.21Å; D1848-I1852 PolarHBondContact O-N 3.16Å; I1852-K1855 PolarHBondContact O-N 3.05Å; I1852-K1856 HydrophobicContact CG2-CD 4.26Å; I1852-K1856 WeakPolarHBondContact O-CG 3.39Å; I1852-K1856 PolarHBondContact O-N 2.98Å |
| 1853 | M | 44.8 | Very low | 44.7 | Very low | 122 Ų | 122 | 113 Ų | 113 | 60% | 0.601 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -58.3 | -46.4 | 169.5 | -81.1 | -154.8 | -162 | 0 | 0 | 111.5 | N1849 H1850 K1855 K1856 L1857 | N1849-M1853 WeakPolarHBondContact O-CB 3.2Å; N1849-M1853 WeakPolarHBondContact O-CG 3.26Å; N1849-M1853 PolarHBondContact O-N 2.67Å; H1850-M1853 PolarHBondContact O-N 3.02Å; M1853-K1855 VanDerWaalsContact C-N 3.3Å; M1853-K1855 PolarHBondContact O-N 2.71Å; M1853-K1856 PolarHBondContact O-N 3.43Å; M1853-L1857 WeakPolarHBondContact O-CB 3.29Å; M1853-L1857 WeakPolarHBondContact O-CG 3.49Å; M1853-L1857 PolarHBondContact O-N 3.49Å |
| 1854 | R | 42.2 | Very low | 44.4 | Very low | 147 Ų | 147 | 110.7 Ų | 110.7 | 56% | 0.555 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -69.4 | -20.4 | 178 | -73.3 | -159.8 | -167.5 | -155.5 | 10.8 | 113.9 | H1850 V1851 R1858 | H1850-R1854 WeakPolarHBondContact O-CB 3.25Å; H1850-R1854 WeakPolarHBondContact O-CG 3.37Å; H1850-R1854 PolarHBondContact O-N 2.87Å; V1851-R1854 CarbonylContact O-C 3.15Å; V1851-R1854 PolarHBondContact O-N 2.87Å; R1854-R1858 PolarHBondContact O-NE 3.24Å; R1854-R1858 PolarHBondContact O-NH2 3.14Å |
| 1855 | K | 45.6 | Very low | 44 | Very low | 131 Ų | 131 | 112.9 Ų | 112.9 | 57% | 0.57 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -72.9 | -58.5 | 166.4 | -86.8 | -176 | 172.5 | 176.7 | 0 | 109.7 | V1851 I1852 M1853 L1857 R1858 D1859 | V1851-K1855 PolarHBondContact O-N 3.12Å; I1852-K1855 PolarHBondContact O-N 3.05Å; M1853-K1855 VanDerWaalsContact C-N 3.3Å; M1853-K1855 PolarHBondContact O-N 2.71Å; K1855-L1857 VanDerWaalsContact C-N 3.31Å; K1855-L1857 PolarHBondContact O-N 2.9Å; K1855-R1858 WeakPolarHBondContact O-CA 3.47Å; K1855-R1858 PolarHBondContact O-N 3.09Å; K1855-D1859 PolarHBondContact O-N 3.2Å; K1855-D1859 VanDerWaalsContact O-OD2 3.14Å |
| 1856 | K | 43.1 | Very low | 43.6 | Very low | 129 Ų | 129 | 118 Ų | 118 | 56% | 0.561 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -51.9 | -44.8 | -179.6 | -70 | 178.3 | 177.9 | 177.7 | 0 | 113.2 | I1852 M1853 R1858 D1859 E1860 | I1852-K1856 HydrophobicContact CG2-CD 4.26Å; I1852-K1856 WeakPolarHBondContact O-CG 3.39Å; I1852-K1856 PolarHBondContact O-N 2.98Å; M1853-K1856 PolarHBondContact O-N 3.43Å; K1856-R1858 VanDerWaalsContact C-N 3.29Å; K1856-R1858 PolarHBondContact O-N 2.98Å; K1856-D1859 PolarHBondContact O-N 2.86Å; K1856-E1860 WeakPolarHBondContact O-CB 3.42Å; K1856-E1860 WeakPolarHBondContact O-CG 3.31Å; K1856-E1860 PolarHBondContact O-N 3.25Å |
| 1857 | L | 42.6 | Very low | 42.4 | Very low | 112 Ų | 112 | 124 Ų | 124 | 59% | 0.586 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -65.4 | -24 | 177 | -78.1 | 165.1 | 0 | 0 | 0 | 114.6 | M1853 K1855 | M1853-L1857 WeakPolarHBondContact O-CB 3.29Å; M1853-L1857 WeakPolarHBondContact O-CG 3.49Å; M1853-L1857 PolarHBondContact O-N 3.49Å; K1855-L1857 VanDerWaalsContact C-N 3.31Å; K1855-L1857 PolarHBondContact O-N 2.9Å |
| 1858 | R | 44.3 | Very low | 41.7 | Very low | 149 Ų | 149 | 123.2 Ų | 123.2 | 56% | 0.562 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -86.4 | -36.7 | 174.4 | -79.2 | 179.7 | -73.7 | -166.6 | -0.1 | 111.9 | R1854 K1855 K1856 E1861 I1862 | R1854-R1858 PolarHBondContact O-NE 3.24Å; R1854-R1858 PolarHBondContact O-NH2 3.14Å; K1855-R1858 WeakPolarHBondContact O-CA 3.47Å; K1855-R1858 PolarHBondContact O-N 3.09Å; K1856-R1858 VanDerWaalsContact C-N 3.29Å; K1856-R1858 PolarHBondContact O-N 2.98Å; R1858-E1861 PolarHBondContact O-N 3.23Å; R1858-I1862 WeakPolarHBondContact O-CG1 3.43Å; R1858-I1862 PolarHBondContact O-N 3.32Å |
| 1859 | D | 39.5 | Very low | 40.8 | Very low | 94 Ų | 94 | 124.8 Ų | 124.8 | 50% | 0.503 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -69.6 | -36.8 | 178.2 | -58.1 | -38.6 | 0 | 0 | 0 | 111.4 | K1855 K1856 I1863 | K1855-D1859 PolarHBondContact O-N 3.2Å; K1855-D1859 VanDerWaalsContact O-OD2 3.14Å; K1856-D1859 PolarHBondContact O-N 2.86Å; D1859-I1863 WeakPolarHBondContact O-CG1 3.4Å |
| 1860 | E | 37.9 | Very low | 39.6 | Very low | 138 Ų | 138 | 129 Ų | 129 | 65% | 0.645 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -70.5 | -35.1 | 175 | -72.1 | -179.9 | 169.9 | 0 | 0 | 113.3 | K1856 A1864 | K1856-E1860 WeakPolarHBondContact O-CB 3.42Å; K1856-E1860 WeakPolarHBondContact O-CG 3.31Å; K1856-E1860 PolarHBondContact O-N 3.25Å; E1860-A1864 PolarHBondContact O-N 3.37Å |
| 1861 | E | 38.5 | Very low | 38.5 | Very low | 115 Ų | 115 | 131 Ų | 131 | 54% | 0.537 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -74 | -30.5 | -179 | -162.3 | -178.1 | 174.7 | 0 | 0 | 113 | R1858 K1865 | R1858-E1861 PolarHBondContact O-N 3.23Å; E1861-K1865 IonicContact OE1-NZ 3.55Å; E1861-K1865 PolarHBondContact OE1-NZ 3.11Å |
| 1862 | I | 45.1 | Very low | 37.6 | Very low | 125 Ų | 125 | 133.7 Ų | 133.7 | 64% | 0.641 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -70.5 | -41.6 | 177.7 | -69.8 | 170.9 | 0 | 0 | 0 | 111.1 | R1858 A1864 | R1858-I1862 WeakPolarHBondContact O-CG1 3.43Å; R1858-I1862 PolarHBondContact O-N 3.32Å; I1862-A1864 VanDerWaalsContact C-N 3.29Å; I1862-A1864 PolarHBondContact O-N 3.44Å |
| 1863 | I | 37.4 | Very low | 36.5 | Very low | 138 Ų | 138 | 137.4 Ų | 137.4 | 71% | 0.708 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -71.7 | -24.1 | -178.1 | -65.7 | 173.7 | 0 | 0 | 0 | 111.9 | D1859 K1865 | D1859-I1863 WeakPolarHBondContact O-CG1 3.4Å; I1863-K1865 VanDerWaalsContact C-N 3.32Å; I1863-K1865 PolarHBondContact O-N 2.88Å |
| 1864 | A | 36.3 | Very low | 35.6 | Very low | 77 Ų | 77 | 136.2 Ų | 136.2 | 64% | 0.636 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.5 | -17.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.4 | E1860 I1862 | E1860-A1864 PolarHBondContact O-N 3.37Å; I1862-A1864 VanDerWaalsContact C-N 3.29Å; I1862-A1864 PolarHBondContact O-N 3.44Å |
| 1865 | K | 39.4 | Very low | 34.8 | Very low | 152 Ų | 152 | 137.3 Ų | 137.3 | 66% | 0.661 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.2 | -8.5 | -168.5 | -88.4 | 165.8 | -178.4 | 149.2 | 0 | 116.9 | E1861 I1863 | E1861-K1865 IonicContact OE1-NZ 3.55Å; E1861-K1865 PolarHBondContact OE1-NZ 3.11Å; I1863-K1865 VanDerWaalsContact C-N 3.32Å; I1863-K1865 PolarHBondContact O-N 2.88Å |
| 1866 | Y | 37.4 | Very low | 33.9 | Very low | 230 Ų | 230 | 138 Ų | 138 | 90% | 0.902 | 69% | 0.691 | S | S | * | * | trans | -126 | 91.4 | 176.6 | -91.1 | -86.1 | 0 | 0 | 0 | 112.7 | ||||
| 1867 | K | 29.1 | Very low | 33.3 | Very low | 186 Ų | 186 | 138.9 Ų | 138.9 | 81% | 0.809 | 70% | 0.703 | S | S | * | * | trans | -123.9 | 146.1 | -179.5 | -139.9 | 168 | -171.8 | 168 | 0 | 110.5 | ||||
| 1868 | T | 29.1 | Very low | 32.4 | Very low | 127 Ų | 127 | 139.2 Ų | 139.2 | 78% | 0.779 | 71% | 0.705 | S | S | * | * | trans | 57.4 | 110.8 | 170.9 | 47.6 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 1869 | T | 29.1 | Very low | 31.6 | Very low | 120 Ų | 120 | 139 Ų | 139 | 74% | 0.736 | 72% | 0.715 | S | S | * | * | 175.8 | 118.9 | 81 | -69.9 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 1870 | K | 26.6 | Very low | 31.1 | Very low | 184 Ų | 184 | 139.6 Ų | 139.6 | 80% | 0.8 | 72% | 0.718 | S | S | * | * | trans | 43.1 | 145.5 | 135.1 | -74.7 | -172.8 | 173.8 | -174.8 | 0 | 122.4 | ||||
| 1871 | I | 25.4 | Very low | 30.5 | Very low | 137 Ų | 137 | 139.6 Ų | 139.6 | 70% | 0.703 | 72% | 0.716 | S | S | * | * | cis | -173.6 | 163.2 | -6.6 | -146.8 | 170.8 | 0 | 0 | 0 | 111.4 | ||||
| 1872 | V | 27.5 | Very low | 29.9 | Very low | 116 Ų | 116 | 142.4 Ų | 142.4 | 70% | 0.703 | 73% | 0.727 | S | S | * | * | trans | 70.4 | 138.8 | 159.3 | 157.1 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 1873 | H | 25.8 | Very low | 29.1 | Very low | 157 Ų | 157 | 144.5 Ų | 144.5 | 73% | 0.727 | 74% | 0.739 | S | S | * | * | cis | -150.5 | 157.4 | 3.9 | -132.3 | -2.8 | 0 | 0 | 0 | 112.5 | ||||
| 1874 | C | 25.3 | Very low | 28.5 | Very low | 96 Ų | 96 | 145.4 Ų | 145.4 | 65% | 0.649 | 75% | 0.745 | S | S | * | * | trans | 49.7 | 146.6 | 157 | -59 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 1875 | E | 25.7 | Very low | 28 | Very low | 170 Ų | 170 | 151 Ų | 151 | 79% | 0.794 | 76% | 0.755 | S | S | * | * | cis | -149 | 125.1 | 10.8 | -147.1 | 158 | -120.8 | 0 | 0 | 110.5 | ||||
| 1876 | V | 27.5 | Very low | 27.5 | Very low | 145 Ų | 145 | 147.3 Ų | 147.3 | 88% | 0.879 | 75% | 0.748 | S | S | * | * | trans | -148 | 138.5 | 166.9 | -179.3 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 1877 | N | 30 | Very low | 26.9 | Very low | 149 Ų | 149 | 142.3 Ų | 142.3 | 80% | 0.797 | 75% | 0.747 | S | S | * | * | trans | -78.8 | 158.9 | -174.5 | -69.4 | -36 | 0 | 0 | 0 | 113.8 | ||||
| 1878 | N | 24.3 | Very low | 26.8 | Very low | 118 Ų | 118 | 139 Ų | 139 | 63% | 0.631 | 74% | 0.743 | S | S | * | * | trans | -79.5 | 177.4 | 160.6 | -47.4 | -75.7 | 0 | 0 | 0 | 109.1 | K1881 | N1878-K1881 PolarHBondContact OD1-NZ 2.61Š| ||
| 1879 | D | 26.3 | Very low | 26.7 | Very low | 144 Ų | 144 | 140.5 Ų | 140.5 | 77% | 0.77 | 74% | 0.739 | S | S | * | * | cis | -140.3 | 177.2 | 12.7 | -54.4 | -77.9 | 0 | 0 | 0 | 108.7 | ||||
| 1880 | D | 28.7 | Very low | 26.8 | Very low | 108 Ų | 108 | 142.2 Ų | 142.2 | 58% | 0.578 | 74% | 0.742 | S | S | * | * | cis | -143.1 | 131.6 | -42.5 | -115.6 | 5.1 | 0 | 0 | 0 | 106.4 | ||||
| 1881 | K | 26.7 | Very low | 26.9 | Very low | 137 Ų | 137 | 141.9 Ų | 141.9 | 60% | 0.596 | 75% | 0.748 | S | S | * | * | 59.2 | 138.6 | 85.4 | -58.4 | -168.5 | -160.4 | 86.1 | 0 | 114.5 | N1878 | N1878-K1881 PolarHBondContact OD1-NZ 2.61Š| |||
| 1882 | F | 24.6 | Very low | 27.1 | Very low | 174 Ų | 174 | 142 Ų | 142 | 76% | 0.763 | 75% | 0.749 | S | S | * | * | cis | -163 | 141.2 | -2 | -134.6 | -135.9 | 0 | 0 | 0 | 108.2 | ||||
| 1883 | N | 28.3 | Very low | 27.2 | Very low | 170 Ų | 170 | 145 Ų | 145 | 91% | 0.909 | 75% | 0.752 | S | S | * | * | trans | -162.6 | 97.7 | 154.8 | -120.8 | -27.8 | 0 | 0 | 0 | 113.4 | ||||
| 1884 | L | 24.9 | Very low | 27.4 | Very low | 157 Ų | 157 | 145.8 Ų | 145.8 | 82% | 0.822 | 76% | 0.761 | S | S | * | * | trans | -154.1 | 91.3 | 169.4 | -153.8 | 172.3 | 0 | 0 | 0 | 109.5 | ||||
| 1885 | F | 25.9 | Very low | 27.7 | Very low | 195 Ų | 195 | 151.4 Ų | 151.4 | 86% | 0.855 | 77% | 0.77 | S | S | * | * | trans | -152.3 | 142 | 171.6 | -117.7 | -81.2 | 0 | 0 | 0 | 112.3 | ||||
| 1886 | S | 28.9 | Very low | 27.9 | Very low | 73 Ų | 73 | 151.8 Ų | 151.8 | 51% | 0.51 | 77% | 0.765 | S | S | . | * | trans | 62.9 | 63.5 | 164.8 | -171.5 | 0 | 0 | 0 | 0 | 118.4 | T1888 | S1886-T1888 PolarHBondContact O-N 3.13Š| ||
| 1887 | S | 24.2 | Very low | 28.1 | Very low | 126 Ų | 126 | 153.6 Ų | 153.6 | 88% | 0.881 | 76% | 0.764 | S | S | * | * | trans | -83.7 | 72.9 | 142.3 | -166.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 1888 | T | 27 | Very low | 28.3 | Very low | 117 Ų | 117 | 151.1 Ų | 151.1 | 72% | 0.718 | 76% | 0.759 | S | S | * | * | trans | -153.9 | 25.4 | -174.3 | -25.6 | 0 | 0 | 0 | 0 | 113.1 | S1886 | S1886-T1888 PolarHBondContact O-N 3.13Š| ||
| 1889 | F | 28.4 | Very low | 28.8 | Very low | 158 Ų | 158 | 149.4 Ų | 149.4 | 69% | 0.693 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -139.5 | 2.3 | -172.5 | -124.9 | -88.9 | 0 | 0 | 0 | 116.5 | ||
| 1890 | I | 31 | Very low | 29.2 | Very low | 156 Ų | 156 | 148.9 Ų | 148.9 | 80% | 0.8 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -98.3 | -5.6 | -171.2 | -65.4 | 177.8 | 0 | 0 | 0 | 113.3 | ||
| 1891 | L | 27.8 | Very low | 29.6 | Very low | 177 Ų | 177 | 152.3 Ų | 152.3 | 93% | 0.927 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -95.4 | 14.8 | 176 | -91 | 165.9 | 0 | 0 | 0 | 115 | ||
| 1892 | I | 30.5 | Very low | 29.9 | Very low | 140 Ų | 140 | 150.9 Ų | 150.9 | 72% | 0.718 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -125.7 | 38.5 | 178.2 | -40.9 | -176.9 | 0 | 0 | 0 | 111 | ||
| 1893 | F | 29.4 | Very low | 30.4 | Very low | 178 Ų | 178 | 150.8 Ų | 150.8 | 78% | 0.781 | 75% | 0.748 | S | S | * | * | S | Bend | trans | -129.3 | 3.6 | 178.5 | -121.5 | -91.2 | 0 | 0 | 0 | 115.5 | ||
| 1894 | L | 30.5 | Very low | 30.8 | Very low | 173 Ų | 173 | 147.4 Ų | 147.4 | 91% | 0.906 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -112.8 | 33.2 | 177.6 | -70.3 | 175.5 | 0 | 0 | 0 | 113.1 | ||
| 1895 | Y | 30.3 | Very low | 31.4 | Very low | 214 Ų | 214 | 144.2 Ų | 144.2 | 84% | 0.839 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -148.9 | 15.7 | -179.7 | -137.3 | -96.2 | 0 | 0 | 0 | 116.4 | ||
| 1896 | Y | 29.7 | Very low | 31.7 | Very low | 179 Ų | 179 | 141 Ų | 141 | 70% | 0.702 | 70% | 0.701 | S | S | * | * | trans | -136.4 | 8.2 | -173.7 | -106.5 | -80.3 | 0 | 0 | 0 | 118.3 | S1898 V1899 | Y1896-S1898 VanDerWaalsContact C-N 3.31Å; Y1896-S1898 PolarHBondContact O-N 3.29Å; Y1896-V1899 HydrophobicContact CD1-CB 4.37Å; Y1896-V1899 HydrophobicContact CD1-CG2 4.2Å; Y1896-V1899 HydrophobicContact CE1-CB 4.38Å; Y1896-V1899 HydrophobicContact CE1-CG2 4.06Å | ||
| 1897 | E | 31.6 | Very low | 32 | Very low | 182 Ų | 182 | 144.3 Ų | 144.3 | 85% | 0.85 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | 1.3 | 174.6 | -72.4 | -129.2 | 113 | 0 | 0 | 114.8 | ||
| 1898 | S | 34.2 | Very low | 32.5 | Very low | 98 Ų | 98 | 144.7 Ų | 144.7 | 69% | 0.685 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.5 | -0.7 | -179.4 | -48.7 | 0 | 0 | 0 | 0 | 114.9 | Y1896 | Y1896-S1898 VanDerWaalsContact C-N 3.31Å; Y1896-S1898 PolarHBondContact O-N 3.29Å |
| 1899 | V | 35.2 | Very low | 32.7 | Very low | 82 Ų | 82 | 145.4 Ų | 145.4 | 50% | 0.497 | 70% | 0.699 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -104.9 | -32.9 | -174.5 | -176.8 | 0 | 0 | 0 | 0 | 112.5 | Y1896 L1902 W1903 | Y1896-V1899 HydrophobicContact CD1-CB 4.37Å; Y1896-V1899 HydrophobicContact CD1-CG2 4.2Å; Y1896-V1899 HydrophobicContact CE1-CB 4.38Å; Y1896-V1899 HydrophobicContact CE1-CG2 4.06Å; V1899-L1902 PolarHBondContact O-N 3.43Å; V1899-W1903 PolarHBondContact O-N 3.13Å |
| 1900 | L | 35.3 | Very low | 33 | Very low | 132 Ų | 132 | 142 Ų | 142 | 69% | 0.691 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -72.5 | -37.7 | -176.8 | -154.4 | 71.2 | 0 | 0 | 0 | 112.7 | L1902 W1903 L1904 | L1900-L1902 VanDerWaalsContact C-N 3.31Å; L1900-L1902 PolarHBondContact O-N 3.36Å; L1900-W1903 PolarHBondContact O-N 3.44Å; L1900-L1904 PolarHBondContact O-N 3.4Å |
| 1901 | Y | 36.8 | Very low | 33.1 | Very low | 180 Ų | 180 | 140.9 Ų | 140.9 | 71% | 0.706 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -62.6 | -37.8 | 172.2 | -109.9 | -89.4 | 0 | 0 | 0 | 112.3 | I1905 | Y1901-I1905 HydrophobicContact CD1-CD1 4.44Å; Y1901-I1905 WeakPolarHBondContact O-CB 3.2Å; Y1901-I1905 VanDerWaalsContact O-CG1 3.3Å; Y1901-I1905 WeakPolarHBondContact O-CG1 3.35Å; Y1901-I1905 PolarHBondContact O-N 2.82Å |
| 1902 | L | 34.2 | Very low | 33.1 | Very low | 108 Ų | 108 | 141.9 Ų | 141.9 | 57% | 0.565 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -70.9 | -34.7 | 177.2 | -114.2 | 160.6 | 0 | 0 | 0 | 112 | V1899 L1900 M1906 | V1899-L1902 PolarHBondContact O-N 3.43Å; L1900-L1902 VanDerWaalsContact C-N 3.31Å; L1900-L1902 PolarHBondContact O-N 3.36Å; L1902-M1906 WeakPolarHBondContact O-CB 3.42Å; L1902-M1906 WeakPolarHBondContact O-CG 3.41Å; L1902-M1906 PolarHBondContact O-N 3.17Å |
| 1903 | W | 34.7 | Very low | 33.1 | Very low | 172 Ų | 172 | 140.9 Ų | 140.9 | 65% | 0.652 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -66.1 | -43.5 | 173.2 | -168.8 | 69.5 | 0 | 0 | 0 | 112.2 | V1899 L1900 I1905 M1906 M1907 | V1899-W1903 PolarHBondContact O-N 3.13Å; L1900-W1903 PolarHBondContact O-N 3.44Å; W1903-I1905 PolarHBondContact O-N 3.01Å; W1903-M1906 PolarHBondContact O-N 2.9Å; W1903-M1907 PolarHBondContact O-N 3.12Å |
| 1904 | L | 36 | Very low | 33.1 | Very low | 98 Ų | 98 | 136.7 Ų | 136.7 | 51% | 0.513 | 70% | 0.696 | S | S | . | * | H | α-helix | trans | -65.1 | -39.4 | 177.4 | -156.5 | 75.6 | 0 | 0 | 0 | 112.2 | L1900 M1907 I1908 | L1900-L1904 PolarHBondContact O-N 3.4Å; L1904-M1907 PolarHBondContact O-N 3.06Å; L1904-I1908 WeakPolarHBondContact O-CG1 3.42Å; L1904-I1908 PolarHBondContact O-N 3.15Å |
| 1905 | I | 37.7 | Very low | 33 | Very low | 90 Ų | 90 | 134.8 Ų | 134.8 | 46% | 0.462 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -70.2 | -37.6 | 176.2 | -69.4 | 169 | 0 | 0 | 0 | 111.5 | Y1901 W1903 M1907 I1908 I1909 | Y1901-I1905 HydrophobicContact CD1-CD1 4.44Å; Y1901-I1905 WeakPolarHBondContact O-CB 3.2Å; Y1901-I1905 VanDerWaalsContact O-CG1 3.3Å; Y1901-I1905 WeakPolarHBondContact O-CG1 3.35Å; Y1901-I1905 PolarHBondContact O-N 2.82Å; W1903-I1905 PolarHBondContact O-N 3.01Å; I1905-M1907 VanDerWaalsContact C-N 3.28Å; I1905-M1907 PolarHBondContact O-N 2.89Å; I1905-I1908 PolarHBondContact O-N 2.9Å; I1905-I1909 HydrophobicContact CG2-CD1 4.02Å; I1905-I1909 PolarHBondContact O-N 3.47Å; I1905-I1909 VanDerWaalsContact O-N 3.15Å |
| 1906 | M | 33.5 | Very low | 33 | Very low | 129 Ų | 129 | 132.9 Ų | 132.9 | 64% | 0.635 | 69% | 0.686 | S | S | * | * | H | α-helix | trans | -65.3 | -28.3 | 173.1 | -79.4 | -161 | 73.8 | 0 | 0 | 113.4 | L1902 W1903 I1908 | L1902-M1906 WeakPolarHBondContact O-CB 3.42Å; L1902-M1906 WeakPolarHBondContact O-CG 3.41Å; L1902-M1906 PolarHBondContact O-N 3.17Å; W1903-M1906 PolarHBondContact O-N 2.9Å; M1906-I1908 VanDerWaalsContact C-N 3.33Å |
| 1907 | M | 33.9 | Very low | 32.9 | Very low | 142 Ų | 142 | 130 Ų | 130 | 70% | 0.7 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -76.7 | -18.9 | 175.8 | -168 | 170.2 | 175.5 | 0 | 0 | 113.4 | W1903 L1904 I1905 | W1903-M1907 PolarHBondContact O-N 3.12Å; L1904-M1907 PolarHBondContact O-N 3.06Å; I1905-M1907 VanDerWaalsContact C-N 3.28Å; I1905-M1907 PolarHBondContact O-N 2.89Å |
| 1908 | I | 34.9 | Very low | 32.7 | Very low | 134 Ų | 134 | 128.4 Ų | 128.4 | 69% | 0.687 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -100.9 | -19.9 | -176.8 | -67.9 | 172.3 | 0 | 0 | 0 | 112.5 | L1904 I1905 M1906 | L1904-I1908 WeakPolarHBondContact O-CG1 3.42Å; L1904-I1908 PolarHBondContact O-N 3.15Å; I1905-I1908 PolarHBondContact O-N 2.9Å; M1906-I1908 VanDerWaalsContact C-N 3.33Å |
| 1909 | I | 31.3 | Very low | 32.4 | Very low | 131 Ų | 131 | 132.1 Ų | 132.1 | 67% | 0.672 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -116.3 | 53.3 | -179.7 | -43.9 | -178.4 | 0 | 0 | 0 | 111 | I1905 | I1905-I1909 HydrophobicContact CG2-CD1 4.02Å; I1905-I1909 PolarHBondContact O-N 3.47Å; I1905-I1909 VanDerWaalsContact O-N 3.15Å |
| 1910 | S | 35.5 | Very low | 32.1 | Very low | 88 Ų | 88 | 133.4 Ų | 133.4 | 62% | 0.615 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -152.2 | 127.6 | 166.9 | -81.8 | 0 | 0 | 0 | 0 | 112.3 | ||
| 1911 | S | 31.6 | Very low | 32.2 | Very low | 131 Ų | 131 | 134.2 Ų | 134.2 | 92% | 0.916 | 70% | 0.697 | S | S | * | * | trans | 60.7 | 92.2 | 176.9 | -66.7 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 1912 | K | 27.6 | Very low | 32.1 | Very low | 199 Ų | 199 | 130.2 Ų | 130.2 | 87% | 0.865 | 69% | 0.694 | S | S | * | * | trans | -126.7 | 133.2 | 146.4 | -155.8 | -165.9 | 179.9 | 179.6 | 0 | 108.6 | ||||
| 1913 | V | 30.6 | Very low | 31.7 | Very low | 118 Ų | 118 | 133.2 Ų | 133.2 | 72% | 0.715 | 71% | 0.705 | S | S | * | * | trans | 69.9 | 123.1 | 170.7 | -164.6 | 0 | 0 | 0 | 0 | 118.1 | D1915 | V1913-D1915 VanDerWaalsContact CG1-OD2 3.27Å; V1913-D1915 WeakPolarHBondContact CG1-OD2 3.46Å | ||
| 1914 | A | 31 | Very low | 31.2 | Very low | 90 Ų | 90 | 131.5 Ų | 131.5 | 74% | 0.744 | 71% | 0.707 | S | S | * | * | trans | 139.2 | 89.5 | 148.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 1915 | D | 28.1 | Very low | 30.7 | Very low | 133 Ų | 133 | 134.6 Ų | 134.6 | 71% | 0.711 | 72% | 0.72 | S | S | * | * | cis | 80.1 | 152.6 | 49.5 | -59 | -43.8 | 0 | 0 | 0 | 115.1 | V1913 | V1913-D1915 VanDerWaalsContact CG1-OD2 3.27Å; V1913-D1915 WeakPolarHBondContact CG1-OD2 3.46Å | ||
| 1916 | Q | 30.6 | Very low | 30.2 | Very low | 174 Ų | 174 | 133.3 Ų | 133.3 | 81% | 0.813 | 73% | 0.728 | S | S | * | * | trans | 85 | 137.5 | 169.4 | -50.9 | -143.1 | -81.3 | 0 | 0 | 119.7 | ||||
| 1917 | D | 26.8 | Very low | 30 | Very low | 118 Ų | 118 | 136 Ų | 136 | 63% | 0.631 | 74% | 0.737 | S | S | * | * | cis | -163.2 | 167.1 | -29.4 | -114.8 | -33.4 | 0 | 0 | 0 | 113.9 | ||||
| 1918 | E | 27.6 | Very low | 29.6 | Very low | 150 Ų | 150 | 137.1 Ų | 137.1 | 70% | 0.701 | 74% | 0.74 | S | S | * | * | trans | 29.7 | 130.5 | 151.3 | -60.6 | -168.9 | 125.5 | 0 | 0 | 123.4 | ||||
| 1919 | L | 28.8 | Very low | 29.3 | Very low | 176 Ų | 176 | 138.1 Ų | 138.1 | 92% | 0.921 | 74% | 0.742 | S | S | * | * | trans | -155.6 | 118.1 | 139.6 | -156.7 | 143.3 | 0 | 0 | 0 | 110.3 | ||||
| 1920 | V | 28.8 | Very low | 29 | Very low | 108 Ų | 108 | 137.5 Ų | 137.5 | 66% | 0.655 | 74% | 0.744 | S | S | * | * | cis | -175.3 | 142.4 | -20.2 | 124.2 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 1921 | I | 36.5 | Very low | 28.6 | Very low | 149 Ų | 149 | 137.5 Ų | 137.5 | 76% | 0.764 | 75% | 0.749 | S | S | * | * | trans | -77.3 | 143.3 | 177.5 | -65.1 | 148.8 | 0 | 0 | 0 | 109.8 | ||||
| 1922 | P | 34.2 | Very low | 28.3 | Very low | 97 Ų | 97 | 139.6 Ų | 139.6 | 63% | 0.63 | 75% | 0.745 | S | S | * | * | -161.6 | 157 | 108.4 | 40.7 | -20.2 | 0 | 0 | 0 | 120 | |||||
| 1923 | E | 25.9 | Very low | 28.1 | Very low | 171 Ų | 171 | 137.4 Ų | 137.4 | 80% | 0.799 | 74% | 0.742 | S | S | * | * | trans | 62.5 | 157.9 | 135.8 | -68.8 | 174.9 | -177.6 | 0 | 0 | 120.8 | ||||
| 1924 | L | 25 | Very low | 28 | Very low | 135 Ų | 135 | 138.6 Ų | 138.6 | 71% | 0.707 | 75% | 0.749 | S | S | * | * | cis | -163.9 | 171.6 | -3.1 | -111.9 | 166.6 | 0 | 0 | 0 | 106.6 | ||||
| 1925 | E | 24.3 | Very low | 27.7 | Very low | 164 Ų | 164 | 141.1 Ų | 141.1 | 77% | 0.766 | 75% | 0.751 | S | S | * | * | cis | -159.8 | 154.9 | 2.5 | -172.3 | 176.6 | 111.9 | 0 | 0 | 110.3 | ||||
| 1926 | G | 28.3 | Very low | 27.7 | Very low | 62 Ų | 62 | 142 Ų | 142 | 64% | 0.639 | 75% | 0.754 | S | S | * | * | trans | 90 | 149 | 155.4 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 1927 | F | 29.5 | Very low | 27.5 | Very low | 187 Ų | 187 | 141.9 Ų | 141.9 | 82% | 0.82 | 75% | 0.753 | S | S | * | * | cis | -136 | 139.6 | -7.6 | -92.5 | -107.1 | 0 | 0 | 0 | 106.7 | ||||
| 1928 | Q | 24 | Very low | 27.6 | Very low | 165 Ų | 165 | 144.6 Ų | 144.6 | 77% | 0.771 | 76% | 0.762 | S | S | * | * | 76.4 | 140 | 50.7 | -85.9 | -160.5 | -6.6 | 0 | 0 | 117.4 | |||||
| 1929 | H | 29.7 | Very low | 27.7 | Very low | 155 Ų | 155 | 142.9 Ų | 142.9 | 72% | 0.718 | 76% | 0.762 | S | S | * | * | trans | 71.6 | 124.4 | -173.5 | -64.2 | -63.2 | 0 | 0 | 0 | 116.5 | ||||
| 1930 | T | 24.5 | Very low | 27.8 | Very low | 118 Ų | 118 | 142.9 Ų | 142.9 | 72% | 0.724 | 76% | 0.757 | S | S | * | * | cis | 96.8 | 138.4 | 19.4 | 71.9 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 1931 | A | 27.2 | Very low | 27.8 | Very low | 87 Ų | 87 | 145.6 Ų | 145.6 | 72% | 0.719 | 77% | 0.767 | S | S | * | * | trans | 70.6 | 152.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 1932 | E | 25.2 | Very low | 27.2 | Very low | 176 Ų | 176 | 141.5 Ų | 141.5 | 82% | 0.822 | 76% | 0.762 | S | S | * | * | cis | -162.5 | 171.5 | -22.7 | -115.3 | 175.4 | 147.7 | 0 | 0 | 107.1 | ||||
| 1933 | N | 24.3 | Very low | 27 | Very low | 152 Ų | 152 | 145.5 Ų | 145.5 | 81% | 0.813 | 77% | 0.772 | S | S | * | * | trans | -35.1 | 136.6 | 178 | -48.3 | -36 | 0 | 0 | 0 | 116.6 | ||||
| 1934 | V | 28.7 | Very low | 27.2 | Very low | 143 Ų | 143 | 143.1 Ų | 143.1 | 87% | 0.867 | 77% | 0.769 | S | S | * | * | trans | -166 | 135.3 | 134.1 | 133.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 1935 | D | 23.3 | Very low | 27.2 | Very low | 144 Ų | 144 | 144.1 Ų | 144.1 | 77% | 0.77 | 77% | 0.774 | S | S | * | * | trans | -69.9 | 158 | 171 | -64.1 | -76.9 | 0 | 0 | 0 | 112.3 | ||||
| 1936 | L | 28.8 | Very low | 27.4 | Very low | 151 Ų | 151 | 141.4 Ų | 141.4 | 79% | 0.791 | 77% | 0.769 | S | S | * | * | 157.2 | 124.3 | 119.9 | -80.7 | 168.9 | 0 | 0 | 0 | 110 | |||||
| 1937 | H | 25.6 | Very low | 27.3 | Very low | 171 Ų | 171 | 146.5 Ų | 146.5 | 79% | 0.792 | 78% | 0.776 | S | S | * | * | trans | 26.8 | 142.1 | 150.2 | -64 | -80.9 | 0 | 0 | 0 | 120.5 | ||||
| 1938 | E | 28.7 | Very low | 27 | Very low | 176 Ų | 176 | 143.5 Ų | 143.5 | 82% | 0.822 | 77% | 0.773 | S | S | * | * | -161.1 | 177.1 | 52.4 | -158.2 | 164.5 | -140.5 | 0 | 0 | 113.4 | |||||
| 1939 | V | 31.5 | Very low | 27.2 | Very low | 113 Ų | 113 | 141.1 Ų | 141.1 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 85.1 | 94.2 | 173.1 | -167.2 | 0 | 0 | 0 | 0 | 116.8 | ||
| 1940 | E | 29.2 | Very low | 26.9 | Very low | 176 Ų | 176 | 139.9 Ų | 139.9 | 82% | 0.822 | 77% | 0.769 | S | S | * | * | trans | 56.6 | 120.9 | 142.8 | -61.1 | 173.3 | 178 | 0 | 0 | 119.1 | ||||
| 1941 | L | 29.3 | Very low | 27 | Very low | 165 Ų | 165 | 141.5 Ų | 141.5 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | cis | -153.9 | 177.2 | 1.1 | -95.1 | 170.9 | 0 | 0 | 0 | 107.6 | ||||
| 1942 | G | 24.3 | Very low | 26.9 | Very low | 64 Ų | 64 | 145.3 Ų | 145.3 | 66% | 0.66 | 77% | 0.771 | S | S | * | * | cis | 102.1 | 133.8 | 10.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 1943 | E | 29.7 | Very low | 27.1 | Very low | 181 Ų | 181 | 145 Ų | 145 | 85% | 0.846 | 77% | 0.77 | S | S | * | * | cis | -162.5 | 160.9 | -11.9 | -156.8 | 175.9 | -148 | 0 | 0 | 108.2 | ||||
| 1944 | V | 30.9 | Very low | 27.2 | Very low | 121 Ų | 121 | 146.1 Ų | 146.1 | 73% | 0.733 | 77% | 0.77 | S | S | * | * | trans | 64 | 116 | 169.4 | -172.7 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 1945 | L | 24.2 | Very low | 27.1 | Very low | 155 Ų | 155 | 145.9 Ų | 145.9 | 81% | 0.812 | 76% | 0.759 | S | S | * | * | cis | 79.4 | 153 | 13 | -109.3 | 177.5 | 0 | 0 | 0 | 118.1 | ||||
| 1946 | T | 29.5 | Very low | 27.5 | Very low | 107 Ų | 107 | 144 Ų | 144 | 66% | 0.656 | 75% | 0.746 | S | S | * | * | trans | 64.5 | 118.2 | -178.8 | 41.6 | 0 | 0 | 0 | 0 | 116 | ||||
| 1947 | E | 24.6 | Very low | 27.4 | Very low | 169 Ų | 169 | 144.6 Ų | 144.6 | 79% | 0.79 | 75% | 0.749 | S | S | * | * | 70.5 | 106.1 | 84.8 | -75.4 | -177.9 | 145.2 | 0 | 0 | 112.4 | |||||
| 1948 | V | 24 | Very low | 27.5 | Very low | 124 Ų | 124 | 142.2 Ų | 142.2 | 75% | 0.752 | 74% | 0.737 | S | S | * | * | 98.4 | 159.2 | 67.6 | 157.6 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 1949 | T | 27.7 | Very low | 27.6 | Very low | 116 Ų | 116 | 143 Ų | 143 | 71% | 0.712 | 74% | 0.741 | S | S | * | * | trans | 78.3 | 115.1 | -163.3 | 65.9 | 0 | 0 | 0 | 0 | 113 | ||||
| 1950 | D | 24.8 | Very low | 27.5 | Very low | 129 Ų | 129 | 145.3 Ų | 145.3 | 69% | 0.69 | 75% | 0.748 | S | S | * | * | 81.1 | 139.9 | 61.6 | -54.8 | -24.2 | 0 | 0 | 0 | 109.6 | |||||
| 1951 | E | 25.2 | Very low | 27.3 | Very low | 152 Ų | 152 | 146.4 Ų | 146.4 | 71% | 0.71 | 75% | 0.753 | S | S | * | * | cis | -159.3 | 175.2 | 8.2 | -126 | 154 | 176 | 0 | 0 | 109.2 | ||||
| 1952 | E | 26.2 | Very low | 27.2 | Very low | 167 Ų | 167 | 146.5 Ų | 146.5 | 78% | 0.78 | 75% | 0.75 | S | S | * | * | trans | 65.4 | 145.3 | 152.4 | -74.9 | 161.6 | 179.9 | 0 | 0 | 119.4 | ||||
| 1953 | E | 28.6 | Very low | 27.5 | Very low | 170 Ų | 170 | 150.3 Ų | 150.3 | 79% | 0.794 | 76% | 0.76 | S | S | * | * | cis | -124.8 | 156.8 | -3.2 | -86 | 145.1 | 154.5 | 0 | 0 | 108.3 | ||||
| 1954 | E | 26 | Very low | 27.3 | Very low | 175 Ų | 175 | 150.6 Ų | 150.6 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | cis | 64 | 152.8 | 49 | -66.3 | -163.7 | 159.3 | 0 | 0 | 114.8 | ||||
| 1955 | E | 28.3 | Very low | 27.2 | Very low | 138 Ų | 138 | 152.8 Ų | 152.8 | 65% | 0.645 | 76% | 0.763 | S | S | * | * | cis | -125.1 | 168.6 | -37.1 | -120.3 | -146.4 | 134.4 | 0 | 0 | 105.1 | K1958 | E1955-K1958 VanDerWaalsContact CD-NZ 3.28Å; E1955-K1958 IonicContact OE1-NZ 2.71Å; E1955-K1958 PolarHBondContact OE1-NZ 3.11Å; E1955-K1958 IonicContact OE2-NZ 2.66Å; E1955-K1958 PolarHBondContact OE2-NZ 3.22Å | ||
| 1956 | E | 30 | Very low | 27.4 | Very low | 105 Ų | 105 | 150.7 Ų | 150.7 | 49% | 0.491 | 75% | 0.753 | S | S | . | * | cis | -127.3 | -112.9 | 25.2 | -164.8 | -173.7 | -131.6 | 0 | 0 | 112.4 | K1958 | E1956-K1958 VanDerWaalsContact CD-N 3.3Å; E1956-K1958 HydrophobicContact CG-CB 4.27Å; E1956-K1958 HydrophobicContact CG-CD 4.37Å; E1956-K1958 HydrophobicContact CG-CG 3.83Å; E1956-K1958 VanDerWaalsContact OE1-CD 3.26Å; E1956-K1958 WeakPolarHBondContact OE1-CD 3.39Å; E1956-K1958 WeakPolarHBondContact OE1-CG 3.3Å; E1956-K1958 IonicContact OE1-NZ 2.87Å; E1956-K1958 PolarHBondContact OE1-NZ 3.29Å; E1956-K1958 PolarHBondContact OE2-N 3.46Å | ||
| 1957 | D | 27.9 | Very low | 27.3 | Very low | 162 Ų | 162 | 154 Ų | 154 | 87% | 0.866 | 77% | 0.766 | S | S | * | * | cis | -113.6 | 134.6 | 4.3 | -54.9 | -51.1 | 0 | 0 | 0 | 111.1 | ||||
| 1958 | K | 27.3 | Very low | 27.4 | Very low | 122 Ų | 122 | 157.5 Ų | 157.5 | 53% | 0.53 | 77% | 0.772 | S | S | . | * | trans | -119.4 | 116.2 | 171.2 | -63.2 | 174.3 | -161.4 | 73.9 | 0 | 109.8 | E1955 E1956 | E1955-K1958 VanDerWaalsContact CD-NZ 3.28Å; E1955-K1958 IonicContact OE1-NZ 2.71Å; E1955-K1958 PolarHBondContact OE1-NZ 3.11Å; E1955-K1958 IonicContact OE2-NZ 2.66Å; E1955-K1958 PolarHBondContact OE2-NZ 3.22Å; E1956-K1958 VanDerWaalsContact CD-N 3.3Å; E1956-K1958 HydrophobicContact CG-CB 4.27Å; E1956-K1958 HydrophobicContact CG-CD 4.37Å; E1956-K1958 HydrophobicContact CG-CG 3.83Å; E1956-K1958 VanDerWaalsContact OE1-CD 3.26Å; E1956-K1958 WeakPolarHBondContact OE1-CD 3.39Å; E1956-K1958 WeakPolarHBondContact OE1-CG 3.3Å; E1956-K1958 IonicContact OE1-NZ 2.87Å; E1956-K1958 PolarHBondContact OE1-NZ 3.29Å; E1956-K1958 PolarHBondContact OE2-N 3.46Å | ||
| 1959 | E | 30.1 | Very low | 27.6 | Very low | 192 Ų | 192 | 159.8 Ų | 159.8 | 90% | 0.897 | 77% | 0.771 | S | S | * | * | trans | 177.1 | 104.5 | 134.5 | -102.3 | 175.9 | -172.1 | 0 | 0 | 111.8 | ||||
| 1960 | L | 30.2 | Very low | 27.6 | Very low | 162 Ų | 162 | 159.4 Ų | 159.4 | 85% | 0.848 | 77% | 0.774 | S | S | * | * | 179.9 | 102.3 | 117.4 | -98.1 | 165.5 | 0 | 0 | 0 | 110.7 | E1962 | L1960-E1962 VanDerWaalsContact C-N 3.29Å; L1960-E1962 PolarHBondContact O-N 3.01Å | |||
| 1961 | E | 24.6 | Very low | 27.7 | Very low | 198 Ų | 198 | 160.2 Ų | 160.2 | 93% | 0.925 | 78% | 0.783 | S | S | * | * | trans | -87.1 | 55.8 | 176.8 | -165.7 | 179.3 | -175.9 | 0 | 0 | 111.3 | ||||
| 1962 | E | 28.2 | Very low | 27.8 | Very low | 168 Ų | 168 | 163.5 Ų | 163.5 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -147.6 | 78.7 | 179.5 | -150.6 | 166.4 | -130.4 | 0 | 0 | 115.1 | L1960 | L1960-E1962 VanDerWaalsContact C-N 3.29Å; L1960-E1962 PolarHBondContact O-N 3.01Å | ||
| 1963 | T | 29.2 | Very low | 27.8 | Very low | 143 Ų | 143 | 162.9 Ų | 162.9 | 88% | 0.877 | 80% | 0.796 | S | S | * | * | trans | -172.8 | 57.5 | 147.7 | 15.4 | 0 | 0 | 0 | 0 | 110.2 | E1965 | T1963-E1965 PolarHBondContact O-N 3.25Š| ||
| 1964 | H | 26.1 | Very low | 27.8 | Very low | 187 Ų | 187 | 164.5 Ų | 164.5 | 87% | 0.866 | 80% | 0.801 | S | S | * | * | trans | -85.4 | 40.7 | -170.4 | -154.1 | -62.3 | 0 | 0 | 0 | 114.4 | ||||
| 1965 | E | 29.1 | Very low | 27.8 | Very low | 167 Ų | 167 | 160.5 Ų | 160.5 | 78% | 0.78 | 79% | 0.792 | S | S | * | * | S | Bend | trans | -137.7 | 159.9 | 179.2 | -157.4 | 63.1 | -105.5 | 0 | 0 | 111.3 | T1963 L1967 | T1963-E1965 PolarHBondContact O-N 3.25Å; E1965-L1967 PolarHBondContact O-N 3.1Å |
| 1966 | D | 28.1 | Very low | 27.7 | Very low | 111 Ų | 111 | 164.8 Ų | 164.8 | 59% | 0.594 | 80% | 0.802 | S | S | * | * | S | Bend | trans | 63.3 | 11.8 | 170.5 | -100.8 | -11.5 | 0 | 0 | 0 | 122 | K1969 | D1966-K1969 IonicContact OD1-NZ 3.58Å; D1966-K1969 PolarHBondContact OD1-NZ 3.03Å |
| 1967 | L | 27.1 | Very low | 27.6 | Very low | 177 Ų | 177 | 168.2 Ų | 168.2 | 93% | 0.927 | 82% | 0.823 | S | S | * | * | trans | -98.6 | 18.8 | 162.6 | -114.8 | 172.6 | 0 | 0 | 0 | 115.5 | E1965 | E1965-L1967 PolarHBondContact O-N 3.1Š| ||
| 1968 | R | 27.5 | Very low | 27.5 | Very low | 243 Ų | 243 | 166.8 Ų | 166.8 | 92% | 0.917 | 82% | 0.815 | S | S | * | * | trans | -112 | 27 | -177.1 | -142.1 | 176.7 | -166.5 | 171.1 | 8 | 115.8 | ||||
| 1969 | K | 27.4 | Very low | 27.6 | Very low | 171 Ų | 171 | 165.4 Ų | 165.4 | 74% | 0.743 | 81% | 0.812 | S | S | * | * | trans | -127.4 | 39.5 | -177.9 | -67.7 | -179.3 | -167.6 | 130.4 | 0 | 116.4 | D1966 | D1966-K1969 IonicContact OD1-NZ 3.58Å; D1966-K1969 PolarHBondContact OD1-NZ 3.03Å | ||
| 1970 | S | 26.9 | Very low | 27.6 | Very low | 109 Ų | 109 | 161.8 Ų | 161.8 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -143.9 | 83.6 | 161.2 | -161.4 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 1971 | T | 27.1 | Very low | 27.5 | Very low | 145 Ų | 145 | 160.5 Ų | 160.5 | 89% | 0.89 | 79% | 0.792 | S | S | * | * | trans | -148.4 | 57.2 | 169 | -38.6 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 1972 | R | 27.2 | Very low | 27.6 | Very low | 222 Ų | 222 | 154.5 Ų | 154.5 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | trans | -138.3 | 19.5 | -176.8 | -132.4 | 176.7 | -170.6 | -176.3 | 2.8 | 117.2 | K1974 | R1972-K1974 PolarHBondContact O-N 3.18Š| ||
| 1973 | V | 27.2 | Very low | 27.7 | Very low | 153 Ų | 153 | 152.1 Ų | 152.1 | 93% | 0.927 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.2 | 64.8 | 170.5 | -168.4 | 0 | 0 | 0 | 0 | 110.9 | ||
| 1974 | K | 27.8 | Very low | 27.7 | Very low | 204 Ų | 204 | 152 Ų | 152 | 89% | 0.887 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -146.4 | 22.2 | 170.8 | -141.8 | 165.8 | -171.9 | 168.8 | 0 | 114 | R1972 | R1972-K1974 PolarHBondContact O-N 3.18Š|
| 1975 | S | 26.3 | Very low | 27.8 | Very low | 91 Ų | 91 | 151.6 Ų | 151.6 | 64% | 0.636 | 74% | 0.743 | S | S | * | * | trans | -143.8 | 50.6 | -175.7 | -58.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 1976 | R | 26.3 | Very low | 27.7 | Very low | 228 Ų | 228 | 152.1 Ų | 152.1 | 86% | 0.86 | 75% | 0.745 | S | S | * | * | trans | -127.5 | 29.6 | 172.2 | -94.8 | -171.2 | 172.8 | -177.7 | -1.5 | 114.5 | ||||
| 1977 | L | 27.6 | Very low | 27.6 | Very low | 178 Ų | 178 | 150.9 Ų | 150.9 | 93% | 0.932 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -111.5 | 31.8 | 171.7 | -157.4 | 77.8 | 0 | 0 | 0 | 112.4 | ||
| 1978 | L | 27.4 | Very low | 27.7 | Very low | 131 Ų | 131 | 150.4 Ų | 150.4 | 69% | 0.686 | 74% | 0.742 | S | S | * | * | S | Bend | trans | -150.8 | 25.3 | -174.1 | -129 | 153.3 | 0 | 0 | 0 | 113.6 | ||
| 1979 | I | 29 | Very low | 27.5 | Very low | 93 Ų | 93 | 141.9 Ų | 141.9 | 48% | 0.477 | 73% | 0.73 | S | S | . | * | S | Bend | trans | -116.4 | -22.5 | 177.6 | -67.8 | 175.9 | 0 | 0 | 0 | 111.6 | H1981 L1983 | I1979-H1981 VanDerWaalsContact C-N 3.27Å; I1979-H1981 PolarHBondContact O-N 3.35Å; I1979-L1983 HydrophobicContact CG2-CD1 3.69Å; I1979-L1983 HydrophobicContact CG2-CG 4.3Å; I1979-L1983 PolarHBondContact O-N 3.26Å |
| 1980 | V | 30 | Very low | 27.5 | Very low | 117 Ų | 117 | 141.7 Ų | 141.7 | 71% | 0.709 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | -11.1 | 177.8 | -177.3 | 0 | 0 | 0 | 0 | 112.8 | ||
| 1981 | H | 27.8 | Very low | 27.4 | Very low | 134 Ų | 134 | 143 Ų | 143 | 62% | 0.62 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.2 | -22.1 | -177.4 | -165.4 | -79.7 | 0 | 0 | 0 | 114.2 | I1979 | I1979-H1981 VanDerWaalsContact C-N 3.27Å; I1979-H1981 PolarHBondContact O-N 3.35Å |
| 1982 | D | 27.3 | Very low | 27.3 | Very low | 72 Ų | 72 | 145.6 Ų | 145.6 | 39% | 0.385 | 72% | 0.724 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -106.9 | -25.7 | 179.9 | -65.9 | -52.8 | 0 | 0 | 0 | 113.2 | L1984 R1985 | D1982-L1984 PolarHBondContact O-N 3.04Å; D1982-L1984 VanDerWaalsContact O-N 3.16Å; D1982-R1985 WeakPolarHBondContact O-CB 3.43Å; D1982-R1985 PolarHBondContact O-N 3.32Å; D1982-R1985 IonicContact OD1-NH1 3.16Å; D1982-R1985 PolarHBondContact OD1-NH1 3.15Å |
| 1983 | L | 29.3 | Very low | 27.3 | Very low | 118 Ų | 118 | 142.3 Ų | 142.3 | 62% | 0.618 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.6 | -17.5 | 167.7 | -73.1 | 175.1 | 0 | 0 | 0 | 113.7 | I1979 R1985 S1987 | I1979-L1983 HydrophobicContact CG2-CD1 3.69Å; I1979-L1983 HydrophobicContact CG2-CG 4.3Å; I1979-L1983 PolarHBondContact O-N 3.26Å; L1983-R1985 VanDerWaalsContact C-N 3.31Å; L1983-S1987 PolarHBondContact O-OG 3.3Å; L1983-S1987 VanDerWaalsContact O-OG 3.07Å |
| 1984 | L | 29.7 | Very low | 27.4 | Very low | 142 Ų | 142 | 142.9 Ų | 142.9 | 74% | 0.743 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | 6.4 | 170.6 | -82.7 | 170.4 | 0 | 0 | 0 | 113.8 | D1982 | D1982-L1984 PolarHBondContact O-N 3.04Å; D1982-L1984 VanDerWaalsContact O-N 3.16Å |
| 1985 | R | 28.3 | Very low | 27.4 | Very low | 178 Ų | 178 | 142.9 Ų | 142.9 | 67% | 0.672 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115 | -20.5 | 180 | 179.7 | 169.5 | -80.4 | 155.1 | -8.7 | 114 | D1982 L1983 | D1982-R1985 WeakPolarHBondContact O-CB 3.43Å; D1982-R1985 PolarHBondContact O-N 3.32Å; D1982-R1985 IonicContact OD1-NH1 3.16Å; D1982-R1985 PolarHBondContact OD1-NH1 3.15Å; L1983-R1985 VanDerWaalsContact C-N 3.31Å |
| 1986 | E | 26 | Very low | 27.5 | Very low | 178 Ų | 178 | 144.8 Ų | 144.8 | 83% | 0.832 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -105.1 | 2.8 | -177.2 | -96 | 175.1 | 168.3 | 0 | 0 | 115.3 | ||
| 1987 | S | 27.3 | Very low | 27.6 | Very low | 85 Ų | 85 | 138.4 Ų | 138.4 | 59% | 0.594 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -102.1 | 14.8 | -172.7 | 44.1 | 0 | 0 | 0 | 0 | 115.7 | L1983 | L1983-S1987 PolarHBondContact O-OG 3.3Å; L1983-S1987 VanDerWaalsContact O-OG 3.07Å |
| 1988 | I | 28 | Very low | 27.6 | Very low | 167 Ų | 167 | 135.4 Ų | 135.4 | 86% | 0.856 | 70% | 0.699 | S | S | * | * | trans | -136.6 | 95.5 | 173 | -52.7 | -179.2 | 0 | 0 | 0 | 110.6 | ||||
| 1989 | G | 23.5 | Very low | 27.7 | Very low | 64 Ų | 64 | 132.6 Ų | 132.6 | 66% | 0.66 | 69% | 0.694 | S | S | * | * | trans | -144.5 | 132.9 | 166.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 1990 | L | 27.9 | Very low | 27.8 | Very low | 166 Ų | 166 | 135.2 Ų | 135.2 | 87% | 0.869 | 70% | 0.703 | S | S | * | * | trans | 64.3 | 146.9 | -173.6 | -57.1 | 170.6 | 0 | 0 | 0 | 114.6 | ||||
| 1991 | E | 24.6 | Very low | 27.8 | Very low | 137 Ų | 137 | 134.2 Ų | 134.2 | 64% | 0.64 | 70% | 0.697 | S | S | * | * | cis | -146 | -149.5 | -34.6 | -140.5 | -159.7 | 166.3 | 0 | 0 | 111 | ||||
| 1992 | R | 25.8 | Very low | 27.9 | Very low | 200 Ų | 200 | 137 Ų | 137 | 76% | 0.755 | 70% | 0.702 | S | S | * | * | trans | -68.9 | 158 | -163.5 | -63.7 | 155.2 | -175.6 | 168.9 | 2.4 | 114.8 | ||||
| 1993 | N | 27.3 | Very low | 28.1 | Very low | 153 Ų | 153 | 137.2 Ų | 137.2 | 82% | 0.818 | 71% | 0.709 | S | S | * | * | trans | 72.5 | 89.7 | 160.7 | -62.9 | -33.4 | 0 | 0 | 0 | 119.3 | ||||
| 1994 | L | 29.3 | Very low | 28.1 | Very low | 164 Ų | 164 | 139.2 Ų | 139.2 | 86% | 0.859 | 71% | 0.71 | S | S | * | * | trans | -145.4 | 127.7 | 143.3 | -126.3 | 127.4 | 0 | 0 | 0 | 112.4 | I1996 | L1994-I1996 PolarHBondContact O-N 3.17Š| ||
| 1995 | K | 26.6 | Very low | 28.2 | Very low | 204 Ų | 204 | 139.2 Ų | 139.2 | 89% | 0.887 | 70% | 0.704 | S | S | * | * | trans | -84.4 | 93 | 179.6 | -74.1 | 177.4 | 178.9 | 169.7 | 0 | 110.6 | ||||
| 1996 | I | 28 | Very low | 28.4 | Very low | 131 Ų | 131 | 133.7 Ų | 133.7 | 67% | 0.672 | 69% | 0.686 | S | S | * | * | trans | -81.6 | 125.6 | 172 | -58.3 | 179.8 | 0 | 0 | 0 | 109.5 | L1994 F2000 | L1994-I1996 PolarHBondContact O-N 3.17Å; I1996-F2000 HydrophobicContact CG2-CB 4.22Å | ||
| 1997 | T | 29 | Very low | 28.8 | Very low | 94 Ų | 94 | 130.1 Ų | 130.1 | 58% | 0.577 | 67% | 0.672 | S | S | * | * | trans | -88.9 | 155.5 | -178 | 54.4 | 0 | 0 | 0 | 0 | 112.3 | A1999 F2000 | T1997-A1999 PolarHBondContact O-N 3.45Å; T1997-F2000 PolarHBondContact O-N 3.18Å | ||
| 1998 | P | 27.2 | Very low | 28.9 | Very low | 116 Ų | 116 | 131.2 Ų | 131.2 | 75% | 0.753 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | -12.2 | -172.9 | -26.9 | 36.1 | 0 | 0 | 0 | 116.7 | F2000 | P1998-F2000 VanDerWaalsContact C-N 3.31Å; P1998-F2000 PolarHBondContact O-N 2.9Å |
| 1999 | A | 29.8 | Very low | 29.1 | Very low | 71 Ų | 71 | 131.7 Ų | 131.7 | 59% | 0.587 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -65.1 | -31.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | T1997 W2002 S2003 | T1997-A1999 PolarHBondContact O-N 3.45Å; A1999-W2002 PolarHBondContact O-N 3.26Å; A1999-S2003 PolarHBondContact O-N 2.68Å |
| 2000 | F | 30.7 | Very low | 29.3 | Very low | 148 Ų | 148 | 136.6 Ų | 136.6 | 65% | 0.649 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -69.8 | -41.8 | -175.7 | -155.5 | -102.3 | 0 | 0 | 0 | 112.1 | I1996 T1997 P1998 W2002 S2003 Y2004 | I1996-F2000 HydrophobicContact CG2-CB 4.22Å; T1997-F2000 PolarHBondContact O-N 3.18Å; P1998-F2000 VanDerWaalsContact C-N 3.31Å; P1998-F2000 PolarHBondContact O-N 2.9Å; F2000-W2002 VanDerWaalsContact C-N 3.34Å; F2000-W2002 PolarHBondContact O-N 3.29Å; F2000-S2003 PolarHBondContact O-N 3.47Å; F2000-Y2004 PolarHBondContact O-N 3.01Å; F2000-Y2004 VanDerWaalsContact O-N 3.16Å |
| 2001 | V | 30.6 | Very low | 29.4 | Very low | 97 Ų | 97 | 135.5 Ų | 135.5 | 59% | 0.588 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -63.9 | -38.9 | 178.2 | -178.5 | 0 | 0 | 0 | 0 | 111.4 | F2005 | V2001-F2005 PolarHBondContact O-N 3.16Å; V2001-F2005 VanDerWaalsContact O-N 3.12Å |
| 2002 | W | 29.8 | Very low | 29.4 | Very low | 191 Ų | 191 | 135.2 Ų | 135.2 | 72% | 0.723 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -70.2 | -38.1 | 179.3 | -160.5 | 59.3 | 0 | 0 | 0 | 112.5 | A1999 F2000 F2005 E2006 | A1999-W2002 PolarHBondContact O-N 3.26Å; F2000-W2002 VanDerWaalsContact C-N 3.34Å; F2000-W2002 PolarHBondContact O-N 3.29Å; W2002-F2005 PolarHBondContact O-N 3.12Å; W2002-E2006 PolarHBondContact O-N 3.28Å |
| 2003 | S | 31 | Very low | 29.5 | Very low | 78 Ų | 78 | 133.3 Ų | 133.3 | 55% | 0.545 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -64 | -41.2 | 176.4 | -155.5 | 0 | 0 | 0 | 0 | 111.9 | A1999 F2000 L2007 | A1999-S2003 PolarHBondContact O-N 2.68Å; F2000-S2003 PolarHBondContact O-N 3.47Å; S2003-L2007 WeakPolarHBondContact O-CB 3.5Å; S2003-L2007 PolarHBondContact O-N 3.13Å |
| 2004 | Y | 30.1 | Very low | 29.5 | Very low | 159 Ų | 159 | 136.3 Ų | 136.3 | 62% | 0.624 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -66.8 | -40.3 | 177.4 | -150.8 | -99.4 | 0 | 0 | 0 | 112.1 | F2000 L2007 L2008 | F2000-Y2004 PolarHBondContact O-N 3.01Å; F2000-Y2004 VanDerWaalsContact O-N 3.16Å; Y2004-L2007 PolarHBondContact O-N 2.83Å; Y2004-L2008 HydrophobicContact CD1-CD1 3.93Å; Y2004-L2008 HydrophobicContact CE1-CD1 4.03Å; Y2004-L2008 PolarHBondContact O-N 3.44Å; Y2004-L2008 VanDerWaalsContact O-N 3.15Å |
| 2005 | F | 32.2 | Very low | 29.4 | Very low | 142 Ų | 142 | 135.2 Ų | 135.2 | 62% | 0.623 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -66.5 | -41.5 | 177.1 | -124.6 | -94 | 0 | 0 | 0 | 112.7 | V2001 W2002 L2007 L2008 R2009 | V2001-F2005 PolarHBondContact O-N 3.16Å; V2001-F2005 VanDerWaalsContact O-N 3.12Å; W2002-F2005 PolarHBondContact O-N 3.12Å; F2005-L2007 VanDerWaalsContact C-N 3.25Å; F2005-L2007 PolarHBondContact O-N 3.04Å; F2005-L2008 PolarHBondContact O-N 2.8Å; F2005-R2009 VanDerWaalsContact O-CB 3.29Å; F2005-R2009 WeakPolarHBondContact O-CB 3.47Å; F2005-R2009 PolarHBondContact O-N 3.09Å |
| 2006 | E | 32.7 | Very low | 29.5 | Very low | 62 Ų | 62 | 133.6 Ų | 133.6 | 29% | 0.29 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -76 | -13.2 | -179.6 | -155.8 | 65.7 | -168.8 | 0 | 0 | 113 | W2002 R2009 | W2002-E2006 PolarHBondContact O-N 3.28Å; E2006-R2009 VanDerWaalsContact CD-NE 3.34Å; E2006-R2009 IonicContact OE1-CZ 2.76Å; E2006-R2009 IonicContact OE1-NE 2.62Å; E2006-R2009 PolarHBondContact OE1-NE 3.43Å; E2006-R2009 IonicContact OE1-NH2 2.79Å; E2006-R2009 PolarHBondContact OE1-NH2 3.35Å; E2006-R2009 IonicContact OE2-CZ 2.79Å; E2006-R2009 IonicContact OE2-NE 2.67Å; E2006-R2009 PolarHBondContact OE2-NE 3.16Å; E2006-R2009 IonicContact OE2-NH2 3.86Å |
| 2007 | L | 32.5 | Very low | 29.4 | Very low | 103 Ų | 103 | 134.3 Ų | 134.3 | 54% | 0.539 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -81.7 | -44.8 | 170.4 | -143.2 | 163.5 | 0 | 0 | 0 | 110.8 | S2003 Y2004 F2005 R2009 K2010 M2011 | S2003-L2007 WeakPolarHBondContact O-CB 3.5Å; S2003-L2007 PolarHBondContact O-N 3.13Å; Y2004-L2007 PolarHBondContact O-N 2.83Å; F2005-L2007 VanDerWaalsContact C-N 3.25Å; F2005-L2007 PolarHBondContact O-N 3.04Å; L2007-R2009 VanDerWaalsContact C-N 3.32Å; L2007-R2009 PolarHBondContact O-N 3.47Å; L2007-K2010 PolarHBondContact O-N 3.19Å; L2007-M2011 HydrophobicContact CD2-CE 3.76Å |
| 2008 | L | 30.3 | Very low | 29.4 | Very low | 108 Ų | 108 | 135 Ų | 135 | 57% | 0.565 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -64.1 | -35.5 | 171.5 | -71.3 | 168.1 | 0 | 0 | 0 | 112.2 | Y2004 F2005 K2010 M2011 | Y2004-L2008 HydrophobicContact CD1-CD1 3.93Å; Y2004-L2008 HydrophobicContact CE1-CD1 4.03Å; Y2004-L2008 PolarHBondContact O-N 3.44Å; Y2004-L2008 VanDerWaalsContact O-N 3.15Å; F2005-L2008 PolarHBondContact O-N 2.8Å; L2008-K2010 PolarHBondContact O-N 3.47Å; L2008-K2010 VanDerWaalsContact O-N 3.1Å; L2008-M2011 PolarHBondContact O-N 3.4Å |
| 2009 | R | 31.8 | Very low | 29.3 | Very low | 178 Ų | 178 | 135.6 Ų | 135.6 | 67% | 0.672 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | -4.7 | 176.1 | -154.6 | 168.1 | 84.6 | 93.2 | 1.9 | 114.4 | F2005 E2006 L2007 | F2005-R2009 VanDerWaalsContact O-CB 3.29Å; F2005-R2009 WeakPolarHBondContact O-CB 3.47Å; F2005-R2009 PolarHBondContact O-N 3.09Å; E2006-R2009 VanDerWaalsContact CD-NE 3.34Å; E2006-R2009 IonicContact OE1-CZ 2.76Å; E2006-R2009 IonicContact OE1-NE 2.62Å; E2006-R2009 PolarHBondContact OE1-NE 3.43Å; E2006-R2009 IonicContact OE1-NH2 2.79Å; E2006-R2009 PolarHBondContact OE1-NH2 3.35Å; E2006-R2009 IonicContact OE2-CZ 2.79Å; E2006-R2009 IonicContact OE2-NE 2.67Å; E2006-R2009 PolarHBondContact OE2-NE 3.16Å; E2006-R2009 IonicContact OE2-NH2 3.86Å; L2007-R2009 VanDerWaalsContact C-N 3.32Å; L2007-R2009 PolarHBondContact O-N 3.47Å |
| 2010 | K | 28.9 | Very low | 29.1 | Very low | 167 Ų | 167 | 137.5 Ų | 137.5 | 73% | 0.726 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | -8.8 | 179.7 | -86.6 | 178.2 | 176.4 | 173.9 | 0 | 115.4 | L2007 L2008 | L2007-K2010 PolarHBondContact O-N 3.19Å; L2008-K2010 PolarHBondContact O-N 3.47Å; L2008-K2010 VanDerWaalsContact O-N 3.1Å |
| 2011 | M | 28.8 | Very low | 29 | Very low | 142 Ų | 142 | 134.8 Ų | 134.8 | 70% | 0.7 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -107.9 | -5 | -171.4 | -81.3 | -169.2 | -78.4 | 0 | 0 | 116.6 | L2007 L2008 | L2007-M2011 HydrophobicContact CD2-CE 3.76Å; L2008-M2011 PolarHBondContact O-N 3.4Å |
| 2012 | D | 25.3 | Very low | 28.8 | Very low | 132 Ų | 132 | 137.5 Ų | 137.5 | 71% | 0.706 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -137.4 | 76.8 | 175.2 | -163.2 | 5.6 | 0 | 0 | 0 | 114.1 | ||
| 2013 | N | 28.5 | Very low | 29.2 | Very low | 160 Ų | 160 | 133.6 Ų | 133.6 | 86% | 0.856 | 70% | 0.699 | S | S | * | * | trans | -166.2 | 73.1 | 148.4 | -117.2 | -83.7 | 0 | 0 | 0 | 112 | ||||
| 2014 | K | 27.3 | Very low | 29 | Very low | 215 Ų | 215 | 133.3 Ų | 133.3 | 94% | 0.935 | 71% | 0.709 | S | S | * | * | trans | -149.1 | 75.6 | 159.4 | -143.5 | -176.5 | -176.2 | -167.5 | 0 | 112.6 | ||||
| 2015 | L | 26.2 | Very low | 28.9 | Very low | 141 Ų | 141 | 132.8 Ų | 132.8 | 74% | 0.738 | 72% | 0.716 | S | S | * | * | trans | -95 | 157.2 | 176.2 | -111.6 | 169 | 0 | 0 | 0 | 111.4 | ||||
| 2016 | Q | 28.9 | Very low | 28.7 | Very low | 170 Ų | 170 | 133 Ų | 133 | 79% | 0.794 | 72% | 0.724 | S | S | * | * | trans | 72.6 | 152.6 | 166.3 | -59.2 | 173.8 | 8.1 | 0 | 0 | 119.2 | ||||
| 2017 | L | 26.7 | Very low | 28.4 | Very low | 146 Ų | 146 | 135 Ų | 135 | 76% | 0.764 | 74% | 0.737 | S | S | * | * | cis | -177.9 | 135.1 | -44.7 | -115.9 | 167.3 | 0 | 0 | 0 | 110.7 | ||||
| 2018 | S | 28 | Very low | 28.1 | Very low | 109 Ų | 109 | 140.1 Ų | 140.1 | 76% | 0.762 | 75% | 0.749 | S | S | * | * | trans | 151.6 | 133 | 159.4 | 44.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 2019 | V | 24.5 | Very low | 28 | Very low | 129 Ų | 129 | 143.2 Ų | 143.2 | 78% | 0.782 | 76% | 0.762 | S | S | * | * | cis | 74.7 | 120.5 | 20.4 | -171.1 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 2020 | S | 25.5 | Very low | 27.9 | Very low | 110 Ų | 110 | 140.8 Ų | 140.8 | 77% | 0.769 | 76% | 0.763 | S | S | * | * | cis | -152.4 | -179.8 | 16.6 | 55 | 0 | 0 | 0 | 0 | 114 | ||||
| 2021 | A | 29.8 | Very low | 27.8 | Very low | 92 Ų | 92 | 137.7 Ų | 137.7 | 76% | 0.76 | 76% | 0.762 | S | S | * | * | trans | 84 | 116.4 | 164.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 2022 | D | 25.5 | Very low | 27.8 | Very low | 154 Ų | 154 | 136 Ų | 136 | 82% | 0.824 | 76% | 0.764 | S | S | * | * | cis | 91.4 | 147.5 | 20.9 | -155.4 | 53.3 | 0 | 0 | 0 | 113.9 | ||||
| 2023 | P | 38.6 | Very low | 27.8 | Very low | 109 Ų | 109 | 137.6 Ų | 137.6 | 71% | 0.708 | 77% | 0.772 | S | S | * | * | cis | -129.5 | -176.3 | 3.8 | 43.4 | -28.1 | 0 | 0 | 0 | 116.5 | ||||
| 2024 | G | 26.9 | Very low | 27.7 | Very low | 72 Ų | 72 | 136.8 Ų | 136.8 | 74% | 0.742 | 77% | 0.768 | S | S | * | * | trans | 162.7 | 80.4 | 161.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 2025 | D | 28.6 | Very low | 27.9 | Very low | 147 Ų | 147 | 132.3 Ų | 132.3 | 79% | 0.786 | 76% | 0.758 | S | S | * | * | trans | -69.7 | 172.4 | 172.4 | -49 | -77.7 | 0 | 0 | 0 | 112.1 | ||||
| 2026 | D | 28.6 | Very low | 27.9 | Very low | 146 Ų | 146 | 133.3 Ų | 133.3 | 78% | 0.781 | 76% | 0.762 | S | S | * | * | cis | -168.5 | 158.5 | 41.3 | -154.3 | -1.1 | 0 | 0 | 0 | 115.6 | ||||
| 2027 | D | 25.7 | Very low | 27.9 | Very low | 106 Ų | 106 | 134.8 Ų | 134.8 | 57% | 0.567 | 78% | 0.783 | S | S | * | * | trans | 63.5 | 140.2 | 150.2 | -133.2 | 4 | 0 | 0 | 0 | 125.7 | ||||
| 2028 | R | 25.3 | Very low | 28 | Very low | 210 Ų | 210 | 134.3 Ų | 134.3 | 79% | 0.792 | 78% | 0.784 | S | S | * | * | trans | 62.5 | 97.6 | 160 | -67.7 | 163.8 | -142.5 | -126.4 | -10.3 | 122.2 | ||||
| 2029 | M | 28.4 | Very low | 28 | Very low | 172 Ų | 172 | 135.6 Ų | 135.6 | 85% | 0.847 | 79% | 0.785 | S | S | * | * | -169.3 | 145.9 | 100.7 | -109.9 | -171 | 173.1 | 0 | 0 | 114.6 | |||||
| 2030 | N | 29.3 | Very low | 28.2 | Very low | 128 Ų | 128 | 135.9 Ų | 135.9 | 68% | 0.684 | 79% | 0.785 | S | S | * | * | trans | 64.2 | 98.9 | 147.5 | -66.4 | 13.7 | 0 | 0 | 0 | 122 | ||||
| 2031 | S | 27.3 | Very low | 28.3 | Very low | 101 Ų | 101 | 137.5 Ų | 137.5 | 71% | 0.706 | 79% | 0.786 | S | S | * | * | -23.6 | 152.6 | 116.9 | 48.3 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 2032 | S | 29.2 | Very low | 28.2 | Very low | 107 Ų | 107 | 140.3 Ų | 140.3 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | cis | -158.2 | 157.6 | -6.9 | -88.7 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 2033 | L | 25.6 | Very low | 28.4 | Very low | 165 Ų | 165 | 139.4 Ų | 139.4 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | trans | -144.9 | 72.4 | 170.2 | -146 | 171.7 | 0 | 0 | 0 | 109.5 | ||||
| 2034 | D | 26.7 | Very low | 27.7 | Very low | 143 Ų | 143 | 141.6 Ų | 141.6 | 77% | 0.765 | 79% | 0.791 | S | S | * | * | trans | -94.2 | 153.1 | 166.8 | -91.9 | -55.4 | 0 | 0 | 0 | 109.8 | ||||
| 2035 | V | 29.7 | Very low | 27.8 | Very low | 122 Ų | 122 | 146.9 Ų | 146.9 | 74% | 0.739 | 80% | 0.795 | S | S | * | * | trans | 67.9 | 123.8 | -171.8 | -167.7 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 2036 | I | 28.1 | Very low | 27.7 | Very low | 161 Ų | 161 | 146.9 Ų | 146.9 | 83% | 0.826 | 80% | 0.795 | S | S | * | * | cis | -103.6 | 138.9 | 20.4 | -64 | 171.8 | 0 | 0 | 0 | 113.3 | ||||
| 2037 | V | 28.5 | Very low | 27.6 | Very low | 202 Ų | 202 | 147 Ų | 147 | 100% | 1.224 | 80% | 0.797 | S | S | * | * | trans | -112.4 | 0 | 161.8 | 166.2 | 0 | 0 | 0 | 0 | 108.5 |
Retrieved 2,037 of 2,037 residues in 2132.7 ms
(Link to these results)