| 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 | 42.2 | Very low | 53.9 | Low | 250 Ų | 250 | 152.9 Ų | 152.9 | 100% | 1.232 | 83% | 0.829 | S | S | * | * | 0 | 116.1 | 0 | -101.4 | 169 | 164.9 | 0 | 0 | 107.6 | |||||
| 2 | A | 54.4 | Low | 53.9 | Low | 92 Ų | 92 | 147.2 Ų | 147.2 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | trans | -83.9 | 153.1 | 168.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 3 | T | 52.4 | Low | 53.4 | Low | 118 Ų | 118 | 145.4 Ų | 145.4 | 72% | 0.724 | 81% | 0.806 | S | S | * | * | trans | -180 | 111.1 | 140.7 | 27.9 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 4 | E | 55.3 | Low | 53.2 | Low | 166 Ų | 166 | 149.8 Ų | 149.8 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | 92.2 | 102.6 | 108.8 | -77.7 | -178.9 | 108.6 | 0 | 0 | 112.2 | |||||
| 5 | S | 59.8 | Low | 53 | Low | 97 Ų | 97 | 143.7 Ų | 143.7 | 68% | 0.678 | 79% | 0.791 | S | S | * | * | 60.5 | 101 | 79.6 | 74.2 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 6 | I | 64.5 | Low | 53 | Low | 168 Ų | 168 | 144.6 Ų | 144.6 | 86% | 0.862 | 79% | 0.794 | S | S | * | * | trans | -152.7 | 135.3 | 140.7 | -149.3 | 68.2 | 0 | 0 | 0 | 112 | ||||
| 7 | R | 51.3 | Low | 52.6 | Low | 226 Ų | 226 | 148.1 Ų | 148.1 | 85% | 0.853 | 80% | 0.803 | S | S | * | * | trans | -69.2 | 153.5 | 177.3 | -57.7 | 169.9 | 165 | -175.6 | -6.3 | 109.8 | ||||
| 8 | M | 55.7 | Low | 52.6 | Low | 191 Ų | 191 | 146.2 Ų | 146.2 | 94% | 0.941 | 81% | 0.811 | S | S | * | * | 178.1 | 135.8 | 104.9 | -108.1 | 162.5 | 152.5 | 0 | 0 | 112.9 | |||||
| 9 | N | 54.9 | Low | 52.5 | Low | 157 Ų | 157 | 141.7 Ų | 141.7 | 84% | 0.84 | 80% | 0.802 | S | S | * | * | trans | -58.2 | 153.2 | 169.9 | 179.3 | 62.8 | 0 | 0 | 0 | 113.6 | ||||
| 10 | G | 51.7 | Low | 52.3 | Low | 60 Ų | 60 | 144.4 Ų | 144.4 | 62% | 0.619 | 81% | 0.807 | S | S | * | * | trans | 149.6 | 86.6 | 165.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 11 | D | 50.9 | Low | 52 | Low | 157 Ų | 157 | 146.8 Ų | 146.8 | 84% | 0.84 | 81% | 0.81 | S | S | * | * | 80.7 | 144.3 | 94 | -105.5 | -44.2 | 0 | 0 | 0 | 113.9 | |||||
| 12 | A | 53.7 | Low | 52.2 | Low | 84 Ų | 84 | 142.5 Ų | 142.5 | 69% | 0.694 | 79% | 0.786 | S | S | * | * | trans | 86.2 | 107.1 | 162.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 13 | D | 47.3 | Very low | 51.9 | Low | 124 Ų | 124 | 149.4 Ų | 149.4 | 66% | 0.663 | 79% | 0.793 | S | S | * | * | 71.8 | 131.4 | 121.3 | -131.7 | 39.4 | 0 | 0 | 0 | 115.4 | |||||
| 14 | R | 50.2 | Low | 51.4 | Low | 207 Ų | 207 | 152 Ų | 152 | 78% | 0.781 | 80% | 0.797 | S | S | * | * | cis | 176.7 | 143.2 | 15.3 | -156.1 | -176.8 | -170.2 | 101.8 | -3.5 | 105.6 | ||||
| 15 | G | 51.1 | Low | 50.6 | Low | 58 Ų | 58 | 149.6 Ų | 149.6 | 60% | 0.598 | 79% | 0.789 | S | S | * | * | trans | 65.3 | 125.1 | 156.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 16 | D | 52.6 | Low | 49.9 | Very low | 159 Ų | 159 | 155.4 Ų | 155.4 | 85% | 0.85 | 80% | 0.796 | S | S | * | * | cis | -167.7 | 100.8 | 46.5 | -70.3 | -49.5 | 0 | 0 | 0 | 107.7 | ||||
| 17 | E | 46.7 | Very low | 49.1 | Very low | 203 Ų | 203 | 154.9 Ų | 154.9 | 95% | 0.949 | 79% | 0.793 | S | S | * | * | trans | -127.4 | 36.6 | 168 | -67.9 | -157.2 | 127.3 | 0 | 0 | 111.5 | G19 | E17-G19 VanDerWaalsContact C-N 3.32Å; E17-G19 PolarHBondContact O-N 2.96Å | ||
| 18 | A | 52.3 | Low | 48.9 | Very low | 114 Ų | 114 | 150.1 Ų | 150.1 | 94% | 0.942 | 78% | 0.782 | S | S | * | * | trans | -89.5 | 69.2 | 169.1 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 19 | G | 50.5 | Low | 48.5 | Very low | 62 Ų | 62 | 152.4 Ų | 152.4 | 64% | 0.639 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -123.2 | -48.9 | -173 | 0 | 0 | 0 | 0 | 0 | 116.9 | E17 | E17-G19 VanDerWaalsContact C-N 3.32Å; E17-G19 PolarHBondContact O-N 2.96Å |
| 20 | E | 48.1 | Very low | 48.1 | Very low | 194 Ų | 194 | 156.6 Ų | 156.6 | 91% | 0.907 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -140.4 | 30.2 | -159.9 | -72 | -163.4 | 114.2 | 0 | 0 | 116.1 | ||
| 21 | F | 45.6 | Very low | 47.8 | Very low | 196 Ų | 196 | 162.9 Ų | 162.9 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -118.5 | 27.8 | 167.8 | -132.6 | -94 | 0 | 0 | 0 | 113.8 | ||
| 22 | H | 47 | Very low | 47.9 | Very low | 159 Ų | 159 | 157.8 Ų | 157.8 | 74% | 0.736 | 77% | 0.774 | S | S | * | * | trans | -126.1 | 39.8 | -173.7 | -120.1 | -108.1 | 0 | 0 | 0 | 113.9 | ||||
| 23 | R | 47.8 | Very low | 47.5 | Very low | 237 Ų | 237 | 159.7 Ų | 159.7 | 89% | 0.894 | 78% | 0.779 | S | S | * | * | S | Bend | trans | -122.3 | 3.2 | 169.5 | -133.8 | -178.3 | 178.2 | -173.9 | -0.2 | 116.1 | ||
| 24 | E | 41.8 | Very low | 47.6 | Very low | 173 Ų | 173 | 160.7 Ų | 160.7 | 81% | 0.808 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -119.8 | 10 | 177.2 | -146.5 | 172.6 | 127.1 | 0 | 0 | 114.2 | ||
| 25 | N | 39.2 | Very low | 47.8 | Very low | 115 Ų | 115 | 156.7 Ų | 156.7 | 62% | 0.615 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -102.7 | 14.1 | 172.8 | -95.4 | -33.1 | 0 | 0 | 0 | 113.9 | ||
| 26 | R | 44.7 | Very low | 47.7 | Very low | 220 Ų | 220 | 161.1 Ų | 161.1 | 83% | 0.83 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -95.3 | 1.6 | 177.9 | -135.1 | -172.4 | -70.1 | -124.2 | 3.1 | 114.4 | ||
| 27 | I | 47.3 | Very low | 47.7 | Very low | 156 Ų | 156 | 155.4 Ų | 155.4 | 80% | 0.8 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -99.9 | -14.4 | 178.5 | -55.3 | -177.6 | 0 | 0 | 0 | 111.9 | ||
| 28 | M | 48.8 | Very low | 47.9 | Very low | 126 Ų | 126 | 151.2 Ų | 151.2 | 62% | 0.621 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -113.5 | 28.1 | -168.9 | -132.3 | 158.8 | 174.3 | 0 | 0 | 114.7 | ||
| 29 | R | 46 | Very low | 47.6 | Very low | 240 Ų | 240 | 155.4 Ų | 155.4 | 91% | 0.906 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -120.9 | 24.7 | 172.2 | -98.8 | -172.3 | 167.1 | 174.3 | -2.2 | 114.6 | ||
| 30 | R | 46 | Very low | 47.6 | Very low | 245 Ų | 245 | 155 Ų | 155 | 93% | 0.925 | 72% | 0.718 | S | S | * | * | trans | -123.7 | 28.4 | 163 | -74.7 | -163.7 | -173.9 | -154.7 | 4 | 113 | G32 | R30-G32 VanDerWaalsContact C-N 3.27Å; R30-G32 PolarHBondContact O-N 2.99Å | ||
| 31 | R | 46.1 | Very low | 47.7 | Very low | 192 Ų | 192 | 149.2 Ų | 149.2 | 73% | 0.725 | 69% | 0.693 | S | S | * | * | trans | -87.3 | 83.9 | 155.1 | -73 | -177.3 | 179.9 | 177.5 | -0 | 106.3 | ||||
| 32 | G | 53.8 | Low | 47.8 | Very low | 49 Ų | 49 | 146.2 Ų | 146.2 | 51% | 0.505 | 68% | 0.68 | S | S | . | * | trans | -51.2 | 159.5 | 154.2 | 0 | 0 | 0 | 0 | 0 | 109 | R30 L34 | R30-G32 VanDerWaalsContact C-N 3.27Å; R30-G32 PolarHBondContact O-N 2.99Å; G32-L34 PolarHBondContact O-N 3.27Å; G32-L34 VanDerWaalsContact O-N 3.11Å | ||
| 33 | P | 45.8 | Very low | 47.9 | Very low | 124 Ų | 124 | 145.8 Ų | 145.8 | 81% | 0.805 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -45 | 127.5 | -177.3 | 21.5 | -32.6 | 0 | 0 | 0 | 108.4 | N35 | P33-N35 PolarHBondContact O-N 3.41Š|
| 34 | L | 47.9 | Very low | 48.1 | Very low | 145 Ų | 145 | 136.8 Ų | 136.8 | 76% | 0.759 | 65% | 0.649 | S | S | * | * | trans | -45.4 | 110 | -179.4 | -77.6 | 172.9 | 0 | 0 | 0 | 107.6 | G32 M36 | G32-L34 PolarHBondContact O-N 3.27Å; G32-L34 VanDerWaalsContact O-N 3.11Å; L34-M36 PolarHBondContact O-N 3.38Å | ||
| 35 | N | 54.3 | Low | 48.7 | Very low | 124 Ų | 124 | 131.5 Ų | 131.5 | 66% | 0.663 | 64% | 0.635 | S | S | * | * | trans | -66.9 | 78.7 | 177.3 | -104 | -22.7 | 0 | 0 | 0 | 107.2 | P33 N37 H38 | P33-N35 PolarHBondContact O-N 3.41Å; N35-N37 PolarHBondContact O-N 2.87Å; N35-N37 VanDerWaalsContact O-N 3.1Å; N35-H38 PolarHBondContact O-N 3.03Å | ||
| 36 | M | 50.5 | Low | 49.6 | Very low | 150 Ų | 150 | 129 Ų | 129 | 74% | 0.739 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.8 | -22.9 | 171.9 | -163.3 | 70 | 74.5 | 0 | 0 | 110.3 | L34 H38 | L34-M36 PolarHBondContact O-N 3.38Å; M36-H38 VanDerWaalsContact C-N 3.3Å; M36-H38 PolarHBondContact O-N 3.33Å |
| 37 | N | 51.4 | Low | 50.2 | Low | 40 Ų | 40 | 121.6 Ų | 121.6 | 21% | 0.214 | 61% | 0.605 | C | S | . | * | H | α-helix | trans | -64.3 | -18.9 | 171.8 | -103.6 | 11.7 | 0 | 0 | 0 | 115.9 | N35 N41 E107 | N35-N37 PolarHBondContact O-N 2.87Å; N35-N37 VanDerWaalsContact O-N 3.1Å; N37-N41 WeakPolarHBondContact O-CB 3.41Å; N37-N41 VanDerWaalsContact O-CG 3.26Å; N37-N41 PolarHBondContact O-N 2.68Å; N37-E107 VanDerWaalsContact CG-CD 3.48Å; N37-E107 PolarHBondContact ND2-OE1 2.83Å; N37-E107 PolarHBondContact ND2-OE2 3.26Å; N37-E107 PolarHBondContact OD1-OE1 3.35Å |
| 38 | H | 51.3 | Low | 50.9 | Low | 114 Ų | 114 | 116.2 Ų | 116.2 | 53% | 0.528 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -79.7 | -22.4 | -179 | -159.1 | 74.2 | 0 | 0 | 0 | 113.6 | N35 M36 K42 | N35-H38 PolarHBondContact O-N 3.03Å; M36-H38 VanDerWaalsContact C-N 3.3Å; M36-H38 PolarHBondContact O-N 3.33Å; H38-K42 WeakPolarHBondContact NE2-CE 3.48Å; H38-K42 PolarHBondContact NE2-NZ 2.94Å; H38-K42 WeakPolarHBondContact O-CG 3.2Å |
| 39 | Y | 46.3 | Very low | 51.9 | Low | 203 Ų | 203 | 117 Ų | 117 | 80% | 0.796 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -91.4 | -38.3 | 175.5 | -114.6 | -94.4 | 0 | 0 | 0 | 111.8 | K43 | Y39-K43 PolarHBondContact O-N 3.48Å |
| 40 | A | 50.7 | Low | 52.8 | Low | 54 Ų | 54 | 110.5 Ų | 110.5 | 45% | 0.446 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.1 | -45 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | K42 K43 S44 | A40-K42 PolarHBondContact O-N 3.27Å; A40-K43 PolarHBondContact O-N 3.41Å; A40-S44 WeakPolarHBondContact O-CB 3.33Å; A40-S44 PolarHBondContact O-N 3.28Å |
| 41 | N | 49.7 | Very low | 54 | Low | 71 Ų | 71 | 100.4 Ų | 100.4 | 38% | 0.38 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -70.6 | -28.7 | -179.5 | -74.9 | 4.3 | 0 | 0 | 0 | 113.7 | N37 A45 | N37-N41 WeakPolarHBondContact O-CB 3.41Å; N37-N41 VanDerWaalsContact O-CG 3.26Å; N37-N41 PolarHBondContact O-N 2.68Å; N41-A45 WeakPolarHBondContact O-CB 3.45Å; N41-A45 PolarHBondContact O-N 3.13Å |
| 42 | K | 46.6 | Very low | 54.9 | Low | 133 Ų | 133 | 94.5 Ų | 94.5 | 58% | 0.578 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -72 | -35.3 | 176.8 | -83.9 | -178.4 | 164.4 | 175.5 | 0 | 112.5 | H38 A40 A46 | H38-K42 WeakPolarHBondContact NE2-CE 3.48Å; H38-K42 PolarHBondContact NE2-NZ 2.94Å; H38-K42 WeakPolarHBondContact O-CG 3.2Å; A40-K42 PolarHBondContact O-N 3.27Å; K42-A46 WeakPolarHBondContact O-CB 3.38Å; K42-A46 PolarHBondContact O-N 2.98Å |
| 43 | K | 49.2 | Very low | 55.7 | Low | 151 Ų | 151 | 94.9 Ų | 94.9 | 66% | 0.657 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -70.7 | -49.8 | 175 | -164.2 | -178.4 | 177.8 | -157.1 | 0 | 110.5 | Y39 A40 A45 A46 E47 | Y39-K43 PolarHBondContact O-N 3.48Å; A40-K43 PolarHBondContact O-N 3.41Å; K43-A45 PolarHBondContact O-N 3.42Å; K43-A46 PolarHBondContact O-N 3.33Å; K43-E47 WeakPolarHBondContact O-CB 3.33Å; K43-E47 PolarHBondContact O-N 3.03Å |
| 44 | S | 53 | Low | 56.6 | Low | 47 Ų | 47 | 92.5 Ų | 92.5 | 33% | 0.329 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63 | -36.2 | 178.7 | -171.5 | 0 | 0 | 0 | 0 | 113.2 | A40 S48 | A40-S44 WeakPolarHBondContact O-CB 3.33Å; A40-S44 PolarHBondContact O-N 3.28Å; S44-S48 WeakPolarHBondContact O-CB 3.48Å; S44-S48 PolarHBondContact O-N 3.25Å |
| 45 | A | 53.8 | Low | 57.3 | Low | 62 Ų | 62 | 88.1 Ų | 88.1 | 51% | 0.512 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -69.9 | -40.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | N41 K43 M49 | N41-A45 WeakPolarHBondContact O-CB 3.45Å; N41-A45 PolarHBondContact O-N 3.13Å; K43-A45 PolarHBondContact O-N 3.42Å; A45-M49 WeakPolarHBondContact O-CB 3.38Å; A45-M49 PolarHBondContact O-N 3.41Å |
| 46 | A | 58.8 | Low | 58.1 | Low | 62 Ų | 62 | 88.6 Ų | 88.6 | 51% | 0.512 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -70.6 | -39.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | K42 K43 M49 L50 | K42-A46 WeakPolarHBondContact O-CB 3.38Å; K42-A46 PolarHBondContact O-N 2.98Å; K43-A46 PolarHBondContact O-N 3.33Å; A46-M49 PolarHBondContact O-N 2.95Å; A46-L50 PolarHBondContact O-N 3.41Å |
| 47 | E | 57.7 | Low | 58.8 | Low | 66 Ų | 66 | 83.6 Ų | 83.6 | 31% | 0.308 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62 | -48.5 | 174.2 | -170.6 | 160.9 | -173.1 | 0 | 0 | 110.9 | K43 M49 L50 D51 M121 | K43-E47 WeakPolarHBondContact O-CB 3.33Å; K43-E47 PolarHBondContact O-N 3.03Å; E47-M49 VanDerWaalsContact C-N 3.35Å; E47-M49 PolarHBondContact O-N 3.5Å; E47-L50 PolarHBondContact O-N 3Å; E47-D51 PolarHBondContact O-N 3.19Å; E47-M121 VanDerWaalsContact OE1-SD 3.4Å |
| 48 | S | 62.2 | Low | 59.4 | Low | 42 Ų | 42 | 83.2 Ų | 83.2 | 29% | 0.294 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -64.2 | -34.8 | 174.2 | 179.9 | 0 | 0 | 0 | 0 | 113.3 | S44 D51 V52 | S44-S48 WeakPolarHBondContact O-CB 3.48Å; S44-S48 PolarHBondContact O-N 3.25Å; S48-D51 PolarHBondContact O-N 3.48Å; S48-V52 VanDerWaalsContact O-CG2 3.29Å; S48-V52 WeakPolarHBondContact O-CG2 3.2Å; S48-V52 PolarHBondContact O-N 3.35Å |
| 49 | M | 68.5 | Low | 59.8 | Low | 142 Ų | 142 | 79.2 Ų | 79.2 | 70% | 0.7 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -69.2 | -37.4 | 178.7 | -176.1 | 176.8 | -177.5 | 0 | 0 | 112.2 | A45 A46 E47 D51 V52 A53 | A45-M49 WeakPolarHBondContact O-CB 3.38Å; A45-M49 PolarHBondContact O-N 3.41Å; A46-M49 PolarHBondContact O-N 2.95Å; E47-M49 VanDerWaalsContact C-N 3.35Å; E47-M49 PolarHBondContact O-N 3.5Å; M49-D51 VanDerWaalsContact C-N 3.32Å; M49-V52 PolarHBondContact O-N 2.73Å; M49-A53 VanDerWaalsContact O-CB 3.25Å; M49-A53 WeakPolarHBondContact O-CB 3.15Å; M49-A53 PolarHBondContact O-N 3.32Å |
| 50 | L | 66.2 | Low | 60.4 | Low | 104 Ų | 104 | 73.2 Ų | 73.2 | 55% | 0.545 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.5 | -41.8 | 175.9 | -178.6 | 138.4 | 0 | 0 | 0 | 110.8 | A46 E47 A53 L54 | A46-L50 PolarHBondContact O-N 3.41Å; E47-L50 PolarHBondContact O-N 3Å; L50-A53 PolarHBondContact O-N 3.42Å; L50-L54 HydrophobicContact CD2-CD1 3.61Å; L50-L54 HydrophobicContact CG-CD1 4.26Å; L50-L54 WeakPolarHBondContact O-CB 3.34Å; L50-L54 WeakPolarHBondContact O-CG 3.3Å; L50-L54 PolarHBondContact O-N 2.86Å |
| 51 | D | 69.6 | Low | 60.7 | Low | 33 Ų | 33 | 75 Ų | 75 | 18% | 0.176 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -68.5 | -40.2 | 179.6 | -67.5 | -23.5 | 0 | 0 | 0 | 112.4 | E47 S48 M49 L54 L55 I124 | E47-D51 PolarHBondContact O-N 3.19Å; S48-D51 PolarHBondContact O-N 3.48Å; M49-D51 VanDerWaalsContact C-N 3.32Å; D51-L54 PolarHBondContact O-N 3.28Å; D51-L55 VanDerWaalsContact O-CB 3.22Å; D51-L55 WeakPolarHBondContact O-CB 3.38Å; D51-L55 PolarHBondContact O-N 2.94Å; D51-I124 HydrophobicContact CB-CD1 3.87Å; D51-I124 HydrophobicContact CB-CG2 4Å; D51-I124 VanDerWaalsContact OD2-CD1 3.24Å; D51-I124 WeakPolarHBondContact OD2-CD1 3.23Å |
| 52 | V | 65.9 | Low | 61.1 | Low | 68 Ų | 68 | 72.9 Ų | 72.9 | 41% | 0.412 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -68.2 | -38.8 | 175.3 | 173.7 | 0 | 0 | 0 | 0 | 111.4 | S48 M49 L55 M56 | S48-V52 VanDerWaalsContact O-CG2 3.29Å; S48-V52 WeakPolarHBondContact O-CG2 3.2Å; S48-V52 PolarHBondContact O-N 3.35Å; M49-V52 PolarHBondContact O-N 2.73Å; V52-L55 WeakPolarHBondContact O-CB 3.37Å; V52-L55 PolarHBondContact O-N 3.36Å; V52-M56 WeakPolarHBondContact O-CB 3.38Å; V52-M56 PolarHBondContact O-N 3.46Å |
| 53 | A | 70.3 | Confident | 61.6 | Low | 58 Ų | 58 | 72.7 Ų | 72.7 | 48% | 0.479 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -65.2 | -42.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | M49 L50 M56 A57 | M49-A53 VanDerWaalsContact O-CB 3.25Å; M49-A53 WeakPolarHBondContact O-CB 3.15Å; M49-A53 PolarHBondContact O-N 3.32Å; L50-A53 PolarHBondContact O-N 3.42Å; A53-M56 PolarHBondContact O-N 2.96Å; A53-A57 VanDerWaalsContact O-CB 3.31Å; A53-A57 WeakPolarHBondContact O-CB 3.18Å; A53-A57 PolarHBondContact O-N 2.95Å |
| 54 | L | 64.3 | Low | 62.2 | Low | 74 Ų | 74 | 67.8 Ų | 67.8 | 39% | 0.387 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -64.9 | -42 | 173.2 | -74.8 | 171.4 | 0 | 0 | 0 | 111.2 | L50 D51 M56 A57 N58 | L50-L54 HydrophobicContact CD2-CD1 3.61Å; L50-L54 HydrophobicContact CG-CD1 4.26Å; L50-L54 WeakPolarHBondContact O-CB 3.34Å; L50-L54 WeakPolarHBondContact O-CG 3.3Å; L50-L54 PolarHBondContact O-N 2.86Å; D51-L54 PolarHBondContact O-N 3.28Å; L54-M56 PolarHBondContact O-N 3.49Å; L54-A57 PolarHBondContact O-N 3.5Å; L54-N58 WeakPolarHBondContact O-CB 2.96Å; L54-N58 PolarHBondContact O-N 3.46Å; L54-N58 PolarHBondContact O-ND2 2.82Å |
| 55 | L | 63.6 | Low | 62.3 | Low | 52 Ų | 52 | 68.3 Ų | 68.3 | 27% | 0.272 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59 | -45.4 | 175.2 | -169.8 | 152.3 | 0 | 0 | 0 | 111.7 | D51 V52 N58 A59 Q89 | D51-L55 VanDerWaalsContact O-CB 3.22Å; D51-L55 WeakPolarHBondContact O-CB 3.38Å; D51-L55 PolarHBondContact O-N 2.94Å; V52-L55 WeakPolarHBondContact O-CB 3.37Å; V52-L55 PolarHBondContact O-N 3.36Å; L55-N58 PolarHBondContact O-N 3.37Å; L55-A59 WeakPolarHBondContact O-CB 3.46Å; L55-A59 PolarHBondContact O-N 3.45Å; L55-Q89 HydrophobicContact CD1-CB 3.98Å; L55-Q89 HydrophobicContact CD1-CG 3.59Å; L55-Q89 HydrophobicContact CD2-CB 4.38Å; L55-Q89 HydrophobicContact CD2-CG 4.22Å; L55-Q89 HydrophobicContact CG-CB 4.33Å; L55-Q89 HydrophobicContact CG-CG 3.72Å |
| 56 | M | 69.8 | Low | 62.2 | Low | 134 Ų | 134 | 70 Ų | 70 | 66% | 0.66 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -69.7 | -40.7 | 179.4 | -173.9 | 175.5 | -76.5 | 0 | 0 | 112.5 | V52 A53 L54 N58 A59 S60 | V52-M56 WeakPolarHBondContact O-CB 3.38Å; V52-M56 PolarHBondContact O-N 3.46Å; A53-M56 PolarHBondContact O-N 2.96Å; L54-M56 PolarHBondContact O-N 3.49Å; M56-N58 VanDerWaalsContact C-N 3.33Å; M56-A59 PolarHBondContact O-N 3.06Å; M56-S60 PolarHBondContact O-N 3.29Å |
| 57 | A | 65.2 | Low | 61.9 | Low | 46 Ų | 46 | 73.6 Ų | 73.6 | 38% | 0.38 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -63.2 | -41.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | A53 L54 S60 Q61 | A53-A57 VanDerWaalsContact O-CB 3.31Å; A53-A57 WeakPolarHBondContact O-CB 3.18Å; A53-A57 PolarHBondContact O-N 2.95Å; L54-A57 PolarHBondContact O-N 3.5Å; A57-S60 PolarHBondContact O-N 2.93Å; A57-Q61 WeakPolarHBondContact O-CG 3.43Å; A57-Q61 PolarHBondContact O-N 3.34Å; A57-Q61 VanDerWaalsContact O-N 3.09Å |
| 58 | N | 64.6 | Low | 61.6 | Low | 31 Ų | 31 | 77.3 Ų | 77.3 | 17% | 0.166 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -67.4 | -36.6 | 176.4 | -66.8 | -28.1 | 0 | 0 | 0 | 111.7 | L54 L55 M56 Q61 L62 N131 | L54-N58 WeakPolarHBondContact O-CB 2.96Å; L54-N58 PolarHBondContact O-N 3.46Å; L54-N58 PolarHBondContact O-ND2 2.82Å; L55-N58 PolarHBondContact O-N 3.37Å; M56-N58 VanDerWaalsContact C-N 3.33Å; N58-Q61 PolarHBondContact O-N 2.95Å; N58-L62 WeakPolarHBondContact O-CB 3.25Å; N58-L62 PolarHBondContact O-N 3.26Å; N58-N131 HydrophobicContact CB-CB 4.46Å; N58-N131 WeakPolarHBondContact CB-ND2 3.35Å; N58-N131 PolarHBondContact ND2-ND2 2.9Å; N58-N131 VanDerWaalsContact ND2-ND2 3.15Å |
| 59 | A | 59.1 | Low | 61.1 | Low | 31 Ų | 31 | 77.1 Ų | 77.1 | 26% | 0.256 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -67.5 | -37.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L55 M56 L62 K63 | L55-A59 WeakPolarHBondContact O-CB 3.46Å; L55-A59 PolarHBondContact O-N 3.45Å; M56-A59 PolarHBondContact O-N 3.06Å; A59-L62 WeakPolarHBondContact O-CB 3.03Å; A59-L62 PolarHBondContact O-N 2.92Å; A59-K63 PolarHBondContact O-N 3.15Å |
| 60 | S | 60.5 | Low | 60.3 | Low | 77 Ų | 77 | 76 Ų | 76 | 54% | 0.538 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -68.1 | -39.2 | 175.4 | -170.3 | 0 | 0 | 0 | 0 | 112.1 | M56 A57 L62 K63 A64 | M56-S60 PolarHBondContact O-N 3.29Å; A57-S60 PolarHBondContact O-N 2.93Å; S60-L62 VanDerWaalsContact C-N 3.33Å; S60-K63 PolarHBondContact O-N 3.3Å; S60-A64 PolarHBondContact O-N 3.06Å; S60-A64 VanDerWaalsContact O-N 3.08Å |
| 61 | Q | 56.3 | Low | 59.6 | Low | 91 Ų | 91 | 75.2 Ų | 75.2 | 43% | 0.425 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63 | -42.6 | 173.2 | -73.8 | 176.2 | 54.7 | 0 | 0 | 111.1 | A57 N58 K63 A64 V65 | A57-Q61 WeakPolarHBondContact O-CG 3.43Å; A57-Q61 PolarHBondContact O-N 3.34Å; A57-Q61 VanDerWaalsContact O-N 3.09Å; N58-Q61 PolarHBondContact O-N 2.95Å; Q61-K63 PolarHBondContact O-N 3.34Å; Q61-A64 PolarHBondContact O-N 3.47Å; Q61-V65 WeakPolarHBondContact O-CG2 3.27Å; Q61-V65 PolarHBondContact O-N 2.69Å; Q61-V65 VanDerWaalsContact O-N 3.08Å |
| 62 | L | 58.2 | Low | 58.6 | Low | 27 Ų | 27 | 80.7 Ų | 80.7 | 14% | 0.141 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -56.9 | -48.3 | 172.6 | 134.9 | 45.8 | 0 | 0 | 0 | 111.3 | N58 A59 S60 A64 V65 L66 L82 L86 | N58-L62 WeakPolarHBondContact O-CB 3.25Å; N58-L62 PolarHBondContact O-N 3.26Å; A59-L62 WeakPolarHBondContact O-CB 3.03Å; A59-L62 PolarHBondContact O-N 2.92Å; S60-L62 VanDerWaalsContact C-N 3.33Å; L62-A64 VanDerWaalsContact C-N 3.33Å; L62-A64 PolarHBondContact O-N 3.11Å; L62-V65 PolarHBondContact O-N 3.43Å; L62-L66 PolarHBondContact O-N 3.38Å; L62-L82 HydrophobicContact CB-CD1 4.38Å; L62-L82 HydrophobicContact CB-CG 4.1Å; L62-L82 HydrophobicContact CD1-CD1 3.8Å; L62-L82 HydrophobicContact CD1-CD2 3.02Å; L62-L82 HydrophobicContact CD1-CG 3.47Å; L62-L82 VanDerWaalsContact CD1-CG 3.47Å; L62-L82 HydrophobicContact CD2-CD2 3.55Å; L62-L82 HydrophobicContact CD2-CG 3.74Å; L62-L82 HydrophobicContact CG-CD1 4.5Å; L62-L82 HydrophobicContact CG-CD2 3.81Å; L62-L82 HydrophobicContact CG-CG 3.93Å; L62-L86 HydrophobicContact CD2-CD1 4.01Å |
| 63 | K | 57.7 | Low | 58.1 | Low | 129 Ų | 129 | 83.6 Ų | 83.6 | 56% | 0.561 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -59.1 | -44 | 179.5 | -171.9 | -170 | 175.7 | -141.1 | 0 | 111.7 | A59 S60 Q61 V65 L66 E67 | A59-K63 PolarHBondContact O-N 3.15Å; S60-K63 PolarHBondContact O-N 3.3Å; Q61-K63 PolarHBondContact O-N 3.34Å; K63-V65 VanDerWaalsContact C-N 3.33Å; K63-V65 PolarHBondContact O-N 2.97Å; K63-L66 PolarHBondContact O-N 3.16Å; K63-E67 PolarHBondContact O-N 3.32Å |
| 64 | A | 61 | Low | 57.4 | Low | 47 Ų | 47 | 87.7 Ų | 87.7 | 39% | 0.388 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.4 | -35 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | S60 Q61 L62 H68 | S60-A64 PolarHBondContact O-N 3.06Å; S60-A64 VanDerWaalsContact O-N 3.08Å; Q61-A64 PolarHBondContact O-N 3.47Å; L62-A64 VanDerWaalsContact C-N 3.33Å; L62-A64 PolarHBondContact O-N 3.11Å; A64-H68 PolarHBondContact O-ND1 3.44Å |
| 65 | V | 54.1 | Low | 57.1 | Low | 58 Ų | 58 | 86.9 Ų | 86.9 | 35% | 0.352 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -70.8 | -37.2 | 174.9 | 172.5 | 0 | 0 | 0 | 0 | 111.5 | Q61 L62 K63 H68 Y75 | Q61-V65 WeakPolarHBondContact O-CG2 3.27Å; Q61-V65 PolarHBondContact O-N 2.69Å; Q61-V65 VanDerWaalsContact O-N 3.08Å; L62-V65 PolarHBondContact O-N 3.43Å; K63-V65 VanDerWaalsContact C-N 3.33Å; K63-V65 PolarHBondContact O-N 2.97Å; V65-H68 PolarHBondContact O-N 2.88Å; V65-Y75 PolarHBondContact O-OH 2.86Å |
| 66 | L | 52.5 | Low | 56.8 | Low | 99 Ų | 99 | 89.5 Ų | 89.5 | 52% | 0.518 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.8 | -33.9 | 176.9 | -163.5 | 78.1 | 0 | 0 | 0 | 112.6 | L62 K63 H68 | L62-L66 PolarHBondContact O-N 3.38Å; K63-L66 PolarHBondContact O-N 3.16Å; L66-H68 PolarHBondContact O-N 2.98Å |
| 67 | E | 53.1 | Low | 56.3 | Low | 136 Ų | 136 | 86.2 Ų | 86.2 | 64% | 0.636 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.5 | -18 | 178.7 | -114.8 | 165.2 | 168.5 | 0 | 0 | 113.5 | K63 | K63-E67 PolarHBondContact O-N 3.32Š|
| 68 | H | 51.5 | Low | 56.2 | Low | 144 Ų | 144 | 85.1 Ų | 85.1 | 67% | 0.667 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.2 | 19.9 | -174.4 | -77.2 | 83.4 | 0 | 0 | 0 | 115 | A64 V65 L66 | A64-H68 PolarHBondContact O-ND1 3.44Å; V65-H68 PolarHBondContact O-N 2.88Å; L66-H68 PolarHBondContact O-N 2.98Å |
| 69 | G | 51.1 | Low | 56.3 | Low | 39 Ų | 39 | 87.1 Ų | 87.1 | 40% | 0.402 | 48% | 0.482 | S | S | . | . | trans | -69.2 | 150.3 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | Y75 | G69-Y75 VanDerWaalsContact CA-CZ 3.45Å; G69-Y75 WeakPolarHBondContact CA-OH 3.42Å; G69-Y75 PolarHBondContact N-OH 3.27Å | ||
| 70 | P | 52.8 | Low | 56.6 | Low | 117 Ų | 117 | 89.1 Ų | 89.1 | 76% | 0.76 | 49% | 0.492 | S | S | * | . | S | Bend | cis | -133.8 | 136.3 | -0.3 | 35.2 | -16.1 | 0 | 0 | 0 | 114.4 | ||
| 71 | S | 50 | Low | 57 | Low | 89 Ų | 89 | 88.3 Ų | 88.3 | 62% | 0.622 | 48% | 0.481 | S | S | * | . | S | Bend | trans | -165.4 | 15.2 | 160.7 | 49.1 | 0 | 0 | 0 | 0 | 118.3 | ||
| 72 | F | 49.7 | Very low | 57.7 | Low | 147 Ų | 147 | 84.7 Ų | 84.7 | 65% | 0.645 | 46% | 0.464 | S | S | * | . | trans | -148.2 | 147.4 | 176.1 | -77.5 | -76.3 | 0 | 0 | 0 | 116.7 | F74 Y75 | F72-F74 PolarHBondContact O-N 2.87Å; F72-Y75 WeakPolarHBondContact O-CB 3.29Å; F72-Y75 PolarHBondContact O-N 3.38Å; F72-Y75 VanDerWaalsContact O-N 3.13Å | ||
| 73 | T | 54.1 | Low | 58.4 | Low | 130 Ų | 130 | 86.1 Ų | 86.1 | 80% | 0.798 | 48% | 0.477 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.8 | -17.5 | -176.6 | -54.8 | 0 | 0 | 0 | 0 | 116.6 | Y75 | T73-Y75 VanDerWaalsContact C-N 3.35Š|
| 74 | F | 56.4 | Low | 59.1 | Low | 144 Ų | 144 | 83.8 Ų | 83.8 | 63% | 0.632 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.9 | 2.5 | 178.9 | -72.3 | -83.5 | 0 | 0 | 0 | 114.4 | F72 V76 P77 L78 | F72-F74 PolarHBondContact O-N 2.87Å; F74-V76 VanDerWaalsContact C-N 3.35Å; F74-V76 PolarHBondContact O-N 3.32Å; F74-P77 WeakPolarHBondContact O-CD 3.43Å; F74-L78 HydrophobicContact CB-CD1 4.34Å; F74-L78 WeakPolarHBondContact O-CB 2.88Å; F74-L78 WeakPolarHBondContact O-CD1 3.39Å; F74-L78 WeakPolarHBondContact O-CG 2.9Å; F74-L78 PolarHBondContact O-N 3.21Å |
| 75 | Y | 57.6 | Low | 59.6 | Low | 56 Ų | 56 | 81.7 Ų | 81.7 | 22% | 0.22 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -60.8 | -38.9 | 179.7 | -123.1 | -99 | 0 | 0 | 0 | 113.7 | V65 G69 F72 T73 I79 | V65-Y75 PolarHBondContact O-OH 2.86Å; G69-Y75 VanDerWaalsContact CA-CZ 3.45Å; G69-Y75 WeakPolarHBondContact CA-OH 3.42Å; G69-Y75 PolarHBondContact N-OH 3.27Å; F72-Y75 WeakPolarHBondContact O-CB 3.29Å; F72-Y75 PolarHBondContact O-N 3.38Å; F72-Y75 VanDerWaalsContact O-N 3.13Å; T73-Y75 VanDerWaalsContact C-N 3.35Å; Y75-I79 HydrophobicContact CD1-CD1 3.53Å; Y75-I79 HydrophobicContact CD1-CG1 4.22Å; Y75-I79 HydrophobicContact CE1-CD1 3.79Å; Y75-I79 HydrophobicContact CE1-CG1 4.47Å; Y75-I79 WeakPolarHBondContact O-CB 3.33Å; Y75-I79 WeakPolarHBondContact O-CG1 3.23Å; Y75-I79 PolarHBondContact O-N 2.87Å |
| 76 | V | 57.5 | Low | 60.5 | Low | 107 Ų | 107 | 83.1 Ų | 83.1 | 65% | 0.648 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -72.4 | -49.1 | -173.9 | 178.3 | 0 | 0 | 0 | 0 | 112.3 | F74 L78 T80 | F74-V76 VanDerWaalsContact C-N 3.35Å; F74-V76 PolarHBondContact O-N 3.32Å; V76-L78 VanDerWaalsContact C-N 3.35Å; V76-L78 PolarHBondContact O-N 2.89Å; V76-T80 WeakPolarHBondContact O-CB 3.35Å; V76-T80 PolarHBondContact O-N 3.37Å; V76-T80 PolarHBondContact O-OG1 2.76Å |
| 77 | P | 59 | Low | 61.7 | Low | 65 Ų | 65 | 83 Ų | 83 | 42% | 0.422 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.4 | -43.7 | 173.1 | -21.2 | 30.7 | 0 | 0 | 0 | 112 | F74 T80 L81 | F74-P77 WeakPolarHBondContact O-CD 3.43Å; P77-T80 PolarHBondContact O-N 3.23Å; P77-L81 HydrophobicContact CB-CD1 4.37Å; P77-L81 WeakPolarHBondContact O-CB 3.28Å; P77-L81 WeakPolarHBondContact O-CD1 3.47Å; P77-L81 WeakPolarHBondContact O-CG 3.33Å; P77-L81 PolarHBondContact O-N 3.03Å |
| 78 | L | 63.3 | Low | 62.5 | Low | 23 Ų | 23 | 78.6 Ų | 78.6 | 12% | 0.12 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -59.1 | -53.7 | 179.3 | -80.7 | 165.6 | 0 | 0 | 0 | 111.4 | F74 V76 T80 L81 L82 I134 | F74-L78 HydrophobicContact CB-CD1 4.34Å; F74-L78 WeakPolarHBondContact O-CB 2.88Å; F74-L78 WeakPolarHBondContact O-CD1 3.39Å; F74-L78 WeakPolarHBondContact O-CG 2.9Å; F74-L78 PolarHBondContact O-N 3.21Å; V76-L78 VanDerWaalsContact C-N 3.35Å; V76-L78 PolarHBondContact O-N 2.89Å; L78-T80 VanDerWaalsContact C-N 3.27Å; L78-T80 PolarHBondContact O-N 3.02Å; L78-L81 PolarHBondContact O-N 3.41Å; L78-L82 WeakPolarHBondContact O-CB 3.45Å; L78-L82 PolarHBondContact O-N 2.98Å; L78-I134 HydrophobicContact CD2-CG2 4.01Å |
| 79 | I | 67.3 | Low | 63.2 | Low | 74 Ų | 74 | 72.5 Ų | 72.5 | 38% | 0.379 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59.7 | -38.8 | 177.9 | -73.9 | 179.2 | 0 | 0 | 0 | 111.6 | Y75 L82 S83 | Y75-I79 HydrophobicContact CD1-CD1 3.53Å; Y75-I79 HydrophobicContact CD1-CG1 4.22Å; Y75-I79 HydrophobicContact CE1-CD1 3.79Å; Y75-I79 HydrophobicContact CE1-CG1 4.47Å; Y75-I79 WeakPolarHBondContact O-CB 3.33Å; Y75-I79 WeakPolarHBondContact O-CG1 3.23Å; Y75-I79 PolarHBondContact O-N 2.87Å; I79-L82 PolarHBondContact O-N 2.9Å; I79-S83 VanDerWaalsContact O-CB 3.29Å; I79-S83 WeakPolarHBondContact O-CB 3.34Å; I79-S83 PolarHBondContact O-N 3.28Å |
| 80 | T | 65.1 | Low | 64.4 | Low | 73 Ų | 73 | 75 Ų | 75 | 45% | 0.448 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -67.3 | -48.5 | -179.4 | -54.9 | 0 | 0 | 0 | 0 | 111.4 | V76 P77 L78 L82 S83 I84 | V76-T80 WeakPolarHBondContact O-CB 3.35Å; V76-T80 PolarHBondContact O-N 3.37Å; V76-T80 PolarHBondContact O-OG1 2.76Å; P77-T80 PolarHBondContact O-N 3.23Å; L78-T80 VanDerWaalsContact C-N 3.27Å; L78-T80 PolarHBondContact O-N 3.02Å; T80-L82 PolarHBondContact O-N 3.19Å; T80-S83 PolarHBondContact O-N 2.77Å; T80-I84 HydrophobicContact CG2-CD1 4.02Å; T80-I84 WeakPolarHBondContact O-CB 3.27Å; T80-I84 WeakPolarHBondContact O-CD1 3.34Å; T80-I84 WeakPolarHBondContact O-CG1 3.25Å; T80-I84 PolarHBondContact O-N 3.2Å |
| 81 | L | 69.4 | Low | 65.6 | Low | 59 Ų | 59 | 74.3 Ų | 74.3 | 31% | 0.309 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -59.9 | -34 | 177.7 | -71.7 | 156.9 | 0 | 0 | 0 | 112 | P77 L78 S85 I134 | P77-L81 HydrophobicContact CB-CD1 4.37Å; P77-L81 WeakPolarHBondContact O-CB 3.28Å; P77-L81 WeakPolarHBondContact O-CD1 3.47Å; P77-L81 WeakPolarHBondContact O-CG 3.33Å; P77-L81 PolarHBondContact O-N 3.03Å; L78-L81 PolarHBondContact O-N 3.41Å; L81-S85 WeakPolarHBondContact O-CB 3.32Å; L81-S85 PolarHBondContact O-N 3.48Å; L81-I134 HydrophobicContact CB-CD1 3.91Å; L81-I134 HydrophobicContact CB-CG1 3.75Å |
| 82 | L | 70.7 | Confident | 66.5 | Low | 16 Ų | 16 | 70.5 Ų | 70.5 | 8% | 0.084 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -85.5 | -34.8 | -173 | 179.7 | 170.6 | 0 | 0 | 0 | 111.2 | L62 L78 I79 T80 S85 L86 I134 | L62-L82 HydrophobicContact CB-CD1 4.38Å; L62-L82 HydrophobicContact CB-CG 4.1Å; L62-L82 HydrophobicContact CD1-CD1 3.8Å; L62-L82 HydrophobicContact CD1-CD2 3.02Å; L62-L82 HydrophobicContact CD1-CG 3.47Å; L62-L82 VanDerWaalsContact CD1-CG 3.47Å; L62-L82 HydrophobicContact CD2-CD2 3.55Å; L62-L82 HydrophobicContact CD2-CG 3.74Å; L62-L82 HydrophobicContact CG-CD1 4.5Å; L62-L82 HydrophobicContact CG-CD2 3.81Å; L62-L82 HydrophobicContact CG-CG 3.93Å; L78-L82 WeakPolarHBondContact O-CB 3.45Å; L78-L82 PolarHBondContact O-N 2.98Å; I79-L82 PolarHBondContact O-N 2.9Å; T80-L82 PolarHBondContact O-N 3.19Å; L82-S85 PolarHBondContact O-N 2.86Å; L82-L86 WeakPolarHBondContact O-CB 3.32Å; L82-L86 PolarHBondContact O-N 2.88Å; L82-I134 HydrophobicContact CB-CD1 4.19Å |
| 83 | S | 72.5 | Confident | 67.5 | Low | 57 Ų | 57 | 65 Ų | 65 | 40% | 0.399 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -64 | -43.6 | 165.3 | 178.3 | 0 | 0 | 0 | 0 | 111.6 | I79 T80 S85 L86 I87 | I79-S83 VanDerWaalsContact O-CB 3.29Å; I79-S83 WeakPolarHBondContact O-CB 3.34Å; I79-S83 PolarHBondContact O-N 3.28Å; T80-S83 PolarHBondContact O-N 2.77Å; S83-S85 PolarHBondContact O-N 3.39Å; S83-L86 PolarHBondContact O-N 2.95Å; S83-I87 VanDerWaalsContact O-CG1 3.27Å; S83-I87 WeakPolarHBondContact O-CG1 3.33Å; S83-I87 PolarHBondContact O-N 2.8Å |
| 84 | I | 72.3 | Confident | 68.6 | Low | 80 Ų | 80 | 62.5 Ų | 62.5 | 41% | 0.41 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -60.7 | -46.1 | 175.1 | -68.8 | 165.9 | 0 | 0 | 0 | 110 | T80 L86 I87 L88 | T80-I84 HydrophobicContact CG2-CD1 4.02Å; T80-I84 WeakPolarHBondContact O-CB 3.27Å; T80-I84 WeakPolarHBondContact O-CD1 3.34Å; T80-I84 WeakPolarHBondContact O-CG1 3.25Å; T80-I84 PolarHBondContact O-N 3.2Å; I84-L86 PolarHBondContact O-N 3.49Å; I84-I87 PolarHBondContact O-N 3.33Å; I84-L88 HydrophobicContact CG2-CD1 3.94Å; I84-L88 WeakPolarHBondContact O-CB 3.33Å; I84-L88 VanDerWaalsContact O-CD1 3.23Å; I84-L88 WeakPolarHBondContact O-CD1 3.47Å; I84-L88 PolarHBondContact O-N 3.28Å |
| 85 | S | 72 | Confident | 69.2 | Low | 3 Ų | 3 | 60.6 Ų | 60.6 | 2% | 0.021 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.8 | -43 | 176.5 | -168.4 | 0 | 0 | 0 | 0 | 112.2 | L81 L82 S83 I87 L88 Q89 N131 | L81-S85 WeakPolarHBondContact O-CB 3.32Å; L81-S85 PolarHBondContact O-N 3.48Å; L82-S85 PolarHBondContact O-N 2.86Å; S83-S85 PolarHBondContact O-N 3.39Å; S85-I87 PolarHBondContact O-N 3.34Å; S85-L88 PolarHBondContact O-N 3.08Å; S85-Q89 VanDerWaalsContact O-CB 3.3Å; S85-Q89 WeakPolarHBondContact O-CB 3.38Å; S85-Q89 WeakPolarHBondContact O-CG 3.39Å; S85-Q89 PolarHBondContact O-N 3.44Å; S85-N131 PolarHBondContact OG-OD1 3.34Å |
| 86 | L | 73.3 | Confident | 69.7 | Low | 88 Ų | 88 | 59.4 Ų | 59.4 | 46% | 0.461 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -64.3 | -42.1 | 178.5 | -159.5 | 93.3 | 0 | 0 | 0 | 112.4 | L62 L82 S83 I84 Q89 V90 | L62-L86 HydrophobicContact CD2-CD1 4.01Å; L82-L86 WeakPolarHBondContact O-CB 3.32Å; L82-L86 PolarHBondContact O-N 2.88Å; S83-L86 PolarHBondContact O-N 2.95Å; I84-L86 PolarHBondContact O-N 3.49Å; L86-Q89 PolarHBondContact O-N 3.26Å; L86-V90 WeakPolarHBondContact O-CG2 3.33Å; L86-V90 PolarHBondContact O-N 3.45Å |
| 87 | I | 77.9 | Confident | 70.4 | Confident | 96 Ų | 96 | 59.8 Ų | 59.8 | 49% | 0.492 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -65.8 | -44.4 | 177.3 | -67.3 | 168.5 | 0 | 0 | 0 | 110.3 | S83 I84 S85 Q89 V90 L91 | S83-I87 VanDerWaalsContact O-CG1 3.27Å; S83-I87 WeakPolarHBondContact O-CG1 3.33Å; S83-I87 PolarHBondContact O-N 2.8Å; I84-I87 PolarHBondContact O-N 3.33Å; S85-I87 PolarHBondContact O-N 3.34Å; I87-Q89 VanDerWaalsContact C-N 3.32Å; I87-Q89 PolarHBondContact O-N 2.8Å; I87-V90 PolarHBondContact O-N 3.04Å; I87-L91 HydrophobicContact CG2-CD1 4.14Å; I87-L91 PolarHBondContact O-N 3.44Å |
| 88 | L | 68.5 | Low | 70.8 | Confident | 44 Ų | 44 | 62 Ų | 62 | 23% | 0.23 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -62.9 | -38.8 | 175.2 | -93.5 | 67.7 | 0 | 0 | 0 | 111.3 | I84 S85 L91 V92 I127 | I84-L88 HydrophobicContact CG2-CD1 3.94Å; I84-L88 WeakPolarHBondContact O-CB 3.33Å; I84-L88 VanDerWaalsContact O-CD1 3.23Å; I84-L88 WeakPolarHBondContact O-CD1 3.47Å; I84-L88 PolarHBondContact O-N 3.28Å; S85-L88 PolarHBondContact O-N 3.08Å; L88-L91 PolarHBondContact O-N 3.48Å; L88-V92 WeakPolarHBondContact O-CB 3.37Å; L88-V92 VanDerWaalsContact O-CG2 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.43Å; L88-V92 PolarHBondContact O-N 3.24Å; L88-I127 HydrophobicContact CB-CD1 4.33Å; L88-I127 HydrophobicContact CB-CG1 4.13Å; L88-I127 HydrophobicContact CD2-CG1 4.47Å |
| 89 | Q | 67.4 | Low | 70.9 | Confident | 15 Ų | 15 | 62.5 Ų | 62.5 | 7% | 0.07 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -65.5 | -39.4 | 175.8 | -76.8 | 169.8 | -15.2 | 0 | 0 | 112.5 | L55 S85 L86 I87 G93 I127 | L55-Q89 HydrophobicContact CD1-CB 3.98Å; L55-Q89 HydrophobicContact CD1-CG 3.59Å; L55-Q89 HydrophobicContact CD2-CB 4.38Å; L55-Q89 HydrophobicContact CD2-CG 4.22Å; L55-Q89 HydrophobicContact CG-CB 4.33Å; L55-Q89 HydrophobicContact CG-CG 3.72Å; S85-Q89 VanDerWaalsContact O-CB 3.3Å; S85-Q89 WeakPolarHBondContact O-CB 3.38Å; S85-Q89 WeakPolarHBondContact O-CG 3.39Å; S85-Q89 PolarHBondContact O-N 3.44Å; L86-Q89 PolarHBondContact O-N 3.26Å; I87-Q89 VanDerWaalsContact C-N 3.32Å; I87-Q89 PolarHBondContact O-N 2.8Å; Q89-G93 PolarHBondContact O-N 2.86Å; Q89-I127 HydrophobicContact CG-CD1 4.27Å; Q89-I127 HydrophobicContact CG-CG2 3.96Å |
| 90 | V | 76.6 | Confident | 70.6 | Confident | 92 Ų | 92 | 63 Ų | 63 | 56% | 0.558 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -66.4 | -44.3 | 174.1 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | L86 I87 V92 G93 V94 | L86-V90 WeakPolarHBondContact O-CG2 3.33Å; L86-V90 PolarHBondContact O-N 3.45Å; I87-V90 PolarHBondContact O-N 3.04Å; V90-V92 PolarHBondContact O-N 2.94Å; V90-G93 PolarHBondContact O-N 2.94Å; V90-V94 WeakPolarHBondContact O-CG2 3.37Å; V90-V94 PolarHBondContact O-N 3.22Å |
| 91 | L | 76.6 | Confident | 70.4 | Confident | 102 Ų | 102 | 67.3 Ų | 67.3 | 53% | 0.534 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -60 | -44.8 | 175.3 | -88.5 | 159.3 | 0 | 0 | 0 | 112 | I87 L88 V94 M95 | I87-L91 HydrophobicContact CG2-CD1 4.14Å; I87-L91 PolarHBondContact O-N 3.44Å; L88-L91 PolarHBondContact O-N 3.48Å; L91-V94 PolarHBondContact O-N 3.35Å; L91-M95 WeakPolarHBondContact O-CB 3.32Å; L91-M95 WeakPolarHBondContact O-CG 3.3Å; L91-M95 PolarHBondContact O-N 2.85Å |
| 92 | V | 69.6 | Low | 69.7 | Low | 9 Ų | 9 | 72.2 Ų | 72.2 | 6% | 0.055 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 175.8 | 167.6 | 0 | 0 | 0 | 0 | 110.8 | L88 V90 V94 M95 L96 F123 I124 I127 | L88-V92 WeakPolarHBondContact O-CB 3.37Å; L88-V92 VanDerWaalsContact O-CG2 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.43Å; L88-V92 PolarHBondContact O-N 3.24Å; V90-V92 PolarHBondContact O-N 2.94Å; V92-V94 VanDerWaalsContact C-N 3.33Å; V92-V94 PolarHBondContact O-N 3.41Å; V92-M95 CarbonylContact O-C 3.56Å; V92-M95 PolarHBondContact O-N 3.45Å; V92-M95 VanDerWaalsContact O-N 3.16Å; V92-L96 HydrophobicContact CG1-CD1 3.4Å; V92-L96 WeakPolarHBondContact O-CD1 3.36Å; V92-L96 PolarHBondContact O-N 3.26Å; V92-F123 HydrophobicContact CG2-CB 3.78Å; V92-F123 HydrophobicContact CG2-CD1 4.34Å; V92-F123 HydrophobicContact CG2-CG 4.28Å; V92-I124 HydrophobicContact CG1-CG1 4.13Å; V92-I127 HydrophobicContact CB-CD1 4.1Å; V92-I127 HydrophobicContact CG1-CD1 4.39Å; V92-I127 HydrophobicContact CG2-CD1 3.65Å |
| 93 | G | 69.6 | Low | 69.1 | Low | 31 Ų | 31 | 73.2 Ų | 73.2 | 32% | 0.32 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.8 | -42.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q89 V90 L96 I97 | Q89-G93 PolarHBondContact O-N 2.86Å; V90-G93 PolarHBondContact O-N 2.94Å; G93-L96 PolarHBondContact O-N 2.99Å; G93-I97 VanDerWaalsContact O-CG1 3.26Å; G93-I97 WeakPolarHBondContact O-CG1 3.26Å; G93-I97 PolarHBondContact O-N 3.46Å |
| 94 | V | 77.2 | Confident | 67.9 | Low | 79 Ų | 79 | 77.5 Ų | 77.5 | 48% | 0.479 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -66.6 | -42.3 | 174.5 | 174.2 | 0 | 0 | 0 | 0 | 111.1 | V90 L91 V92 I97 F98 | V90-V94 WeakPolarHBondContact O-CG2 3.37Å; V90-V94 PolarHBondContact O-N 3.22Å; L91-V94 PolarHBondContact O-N 3.35Å; V92-V94 VanDerWaalsContact C-N 3.33Å; V92-V94 PolarHBondContact O-N 3.41Å; V94-I97 PolarHBondContact O-N 3.01Å; V94-F98 WeakPolarHBondContact O-CB 3.19Å; V94-F98 PolarHBondContact O-N 3.39Å |
| 95 | M | 69 | Low | 66.9 | Low | 103 Ų | 103 | 79.7 Ų | 79.7 | 51% | 0.507 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -61.5 | -43.7 | 175.1 | -79.3 | -74.2 | 145.4 | 0 | 0 | 112 | L91 V92 F98 I99 | L91-M95 WeakPolarHBondContact O-CB 3.32Å; L91-M95 WeakPolarHBondContact O-CG 3.3Å; L91-M95 PolarHBondContact O-N 2.85Å; V92-M95 CarbonylContact O-C 3.56Å; V92-M95 PolarHBondContact O-N 3.45Å; V92-M95 VanDerWaalsContact O-N 3.16Å; M95-F98 WeakPolarHBondContact O-CB 3.39Å; M95-F98 PolarHBondContact O-N 3.23Å; M95-I99 WeakPolarHBondContact O-CB 3.49Å; M95-I99 VanDerWaalsContact O-CD1 3.29Å; M95-I99 WeakPolarHBondContact O-CD1 3.46Å; M95-I99 WeakPolarHBondContact O-CG1 3.4Å; M95-I99 PolarHBondContact O-N 3.08Å |
| 96 | L | 68.1 | Low | 65.8 | Low | 31 Ų | 31 | 83.6 Ų | 83.6 | 16% | 0.162 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -63.1 | -42.4 | 175.4 | -93.4 | 81.5 | 0 | 0 | 0 | 111.8 | V92 G93 F98 I99 V100 V120 | V92-L96 HydrophobicContact CG1-CD1 3.4Å; V92-L96 WeakPolarHBondContact O-CD1 3.36Å; V92-L96 PolarHBondContact O-N 3.26Å; G93-L96 PolarHBondContact O-N 2.99Å; L96-F98 VanDerWaalsContact C-N 3.32Å; L96-F98 PolarHBondContact O-N 3.08Å; L96-I99 WeakPolarHBondContact O-CB 3.45Å; L96-I99 PolarHBondContact O-N 3.49Å; L96-V100 WeakPolarHBondContact O-CB 3.49Å; L96-V100 VanDerWaalsContact O-CG2 3.26Å; L96-V100 WeakPolarHBondContact O-CG2 3.15Å; L96-V100 PolarHBondContact O-N 2.89Å; L96-V120 HydrophobicContact CD1-CG1 3.67Å; L96-V120 HydrophobicContact CD1-CG2 4.05Å; L96-V120 HydrophobicContact CG-CG1 4.33Å |
| 97 | I | 73.2 | Confident | 64.7 | Low | 116 Ų | 116 | 84.6 Ų | 84.6 | 60% | 0.595 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -61.3 | -44.8 | 175.4 | -70 | 165.1 | 0 | 0 | 0 | 110 | G93 V94 I99 V100 K101 | G93-I97 VanDerWaalsContact O-CG1 3.26Å; G93-I97 WeakPolarHBondContact O-CG1 3.26Å; G93-I97 PolarHBondContact O-N 3.46Å; V94-I97 PolarHBondContact O-N 3.01Å; I97-I99 VanDerWaalsContact C-N 3.31Å; I97-I99 PolarHBondContact O-N 3.31Å; I97-V100 PolarHBondContact O-N 2.93Å; I97-K101 VanDerWaalsContact O-CB 3.23Å; I97-K101 WeakPolarHBondContact O-CB 3.49Å; I97-K101 PolarHBondContact O-N 2.95Å |
| 98 | F | 67.8 | Low | 63.3 | Low | 111 Ų | 111 | 90.4 Ų | 90.4 | 49% | 0.487 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -61.5 | -42 | 177.3 | -125.1 | -87 | 0 | 0 | 0 | 111.6 | V94 M95 L96 K101 W102 | V94-F98 WeakPolarHBondContact O-CB 3.19Å; V94-F98 PolarHBondContact O-N 3.39Å; M95-F98 WeakPolarHBondContact O-CB 3.39Å; M95-F98 PolarHBondContact O-N 3.23Å; L96-F98 VanDerWaalsContact C-N 3.32Å; L96-F98 PolarHBondContact O-N 3.08Å; F98-K101 PolarHBondContact O-N 3.4Å; F98-W102 HydrophobicContact CD1-CD2 4.33Å; F98-W102 AromaticContact CD1-CE3 3.51Å; F98-W102 HydrophobicContact CD1-CE3 3.51Å; F98-W102 HydrophobicContact CD1-CH2 4.36Å; F98-W102 AromaticContact CD1-CZ3 3.52Å; F98-W102 HydrophobicContact CD1-CZ3 3.52Å; F98-W102 AromaticContact CE1-CE3 3.93Å; F98-W102 HydrophobicContact CE1-CE3 3.93Å; F98-W102 AromaticContact CE1-CH2 4Å; F98-W102 HydrophobicContact CE1-CH2 4Å; F98-W102 AromaticContact CE1-CZ3 3.61Å; F98-W102 HydrophobicContact CE1-CZ3 3.61Å; F98-W102 WeakPolarHBondContact O-CB 3.21Å; F98-W102 PolarHBondContact O-N 3.33Å |
| 99 | I | 65.8 | Low | 62.4 | Low | 33 Ų | 33 | 93.6 Ų | 93.6 | 17% | 0.169 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -61.3 | -53.1 | 176.3 | -74.6 | 164.2 | 0 | 0 | 0 | 111.3 | M95 L96 I97 K101 W102 N103 L116 V120 | M95-I99 WeakPolarHBondContact O-CB 3.49Å; M95-I99 VanDerWaalsContact O-CD1 3.29Å; M95-I99 WeakPolarHBondContact O-CD1 3.46Å; M95-I99 WeakPolarHBondContact O-CG1 3.4Å; M95-I99 PolarHBondContact O-N 3.08Å; L96-I99 WeakPolarHBondContact O-CB 3.45Å; L96-I99 PolarHBondContact O-N 3.49Å; I97-I99 VanDerWaalsContact C-N 3.31Å; I97-I99 PolarHBondContact O-N 3.31Å; I99-K101 PolarHBondContact O-N 2.87Å; I99-W102 PolarHBondContact O-N 3.15Å; I99-N103 WeakPolarHBondContact O-CA 3.44Å; I99-N103 WeakPolarHBondContact O-CB 3.26Å; I99-N103 PolarHBondContact O-N 2.94Å; I99-L116 HydrophobicContact CB-CD2 4.33Å; I99-L116 HydrophobicContact CD1-CD1 3.96Å; I99-L116 HydrophobicContact CD1-CD2 4.08Å; I99-L116 HydrophobicContact CD1-CG 3.52Å; I99-L116 HydrophobicContact CG1-CD1 4.01Å; I99-L116 HydrophobicContact CG1-CD2 3.33Å; I99-L116 HydrophobicContact CG1-CG 3.38Å; I99-V120 HydrophobicContact CD1-CB 4.42Å; I99-V120 HydrophobicContact CD1-CG2 3.1Å |
| 100 | V | 59.7 | Low | 61.6 | Low | 85 Ų | 85 | 99.6 Ų | 99.6 | 52% | 0.515 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.5 | -38.5 | 179.1 | 171.3 | 0 | 0 | 0 | 0 | 110.4 | L96 I97 L104 | L96-V100 WeakPolarHBondContact O-CB 3.49Å; L96-V100 VanDerWaalsContact O-CG2 3.26Å; L96-V100 WeakPolarHBondContact O-CG2 3.15Å; L96-V100 PolarHBondContact O-N 2.89Å; I97-V100 PolarHBondContact O-N 2.93Å; V100-L104 WeakPolarHBondContact O-CD1 3.24Å; V100-L104 PolarHBondContact O-N 3.35Å |
| 101 | K | 61 | Low | 60.4 | Low | 164 Ų | 164 | 102.5 Ų | 102.5 | 71% | 0.713 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -72.5 | -35.8 | 179.5 | -149.4 | -172.4 | 175.5 | 86.3 | 0 | 112.7 | I97 F98 I99 | I97-K101 VanDerWaalsContact O-CB 3.23Å; I97-K101 WeakPolarHBondContact O-CB 3.49Å; I97-K101 PolarHBondContact O-N 2.95Å; F98-K101 PolarHBondContact O-N 3.4Å; I99-K101 PolarHBondContact O-N 2.87Å |
| 102 | W | 55.4 | Low | 59.3 | Low | 161 Ų | 161 | 104.6 Ų | 104.6 | 61% | 0.61 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -76.8 | -36.6 | 174.1 | -115.4 | -37.8 | 0 | 0 | 0 | 112.5 | F98 I99 L104 N105 D106 | F98-W102 HydrophobicContact CD1-CD2 4.33Å; F98-W102 AromaticContact CD1-CE3 3.51Å; F98-W102 HydrophobicContact CD1-CE3 3.51Å; F98-W102 HydrophobicContact CD1-CH2 4.36Å; F98-W102 AromaticContact CD1-CZ3 3.52Å; F98-W102 HydrophobicContact CD1-CZ3 3.52Å; F98-W102 AromaticContact CE1-CE3 3.93Å; F98-W102 HydrophobicContact CE1-CE3 3.93Å; F98-W102 AromaticContact CE1-CH2 4Å; F98-W102 HydrophobicContact CE1-CH2 4Å; F98-W102 AromaticContact CE1-CZ3 3.61Å; F98-W102 HydrophobicContact CE1-CZ3 3.61Å; F98-W102 WeakPolarHBondContact O-CB 3.21Å; F98-W102 PolarHBondContact O-N 3.33Å; I99-W102 PolarHBondContact O-N 3.15Å; W102-L104 VanDerWaalsContact C-N 3.25Å; W102-L104 PolarHBondContact O-N 3.46Å; W102-N105 PolarHBondContact O-N 2.87Å; W102-D106 PolarHBondContact O-N 3.28Å |
| 103 | N | 57.1 | Low | 58.7 | Low | 37 Ų | 37 | 107.1 Ų | 107.1 | 20% | 0.198 | 52% | 0.517 | C | S | . | . | H | α-helix | trans | -62.5 | -30.5 | 179 | -169.3 | 33.3 | 0 | 0 | 0 | 112 | I99 L113 | I99-N103 WeakPolarHBondContact O-CA 3.44Å; I99-N103 WeakPolarHBondContact O-CB 3.26Å; I99-N103 PolarHBondContact O-N 2.94Å; N103-L113 WeakPolarHBondContact OD1-CD2 3.43Å |
| 104 | L | 48.7 | Very low | 58.3 | Low | 148 Ų | 148 | 111 Ų | 111 | 78% | 0.775 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.3 | -22.6 | 172.9 | -103.3 | 77.5 | 0 | 0 | 0 | 114.2 | V100 W102 | V100-L104 WeakPolarHBondContact O-CD1 3.24Å; V100-L104 PolarHBondContact O-N 3.35Å; W102-L104 VanDerWaalsContact C-N 3.25Å; W102-L104 PolarHBondContact O-N 3.46Å |
| 105 | N | 50.7 | Low | 57.6 | Low | 126 Ų | 126 | 112.4 Ų | 112.4 | 67% | 0.674 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.9 | -19.2 | -167.6 | -169.4 | 80.7 | 0 | 0 | 0 | 113.5 | W102 | W102-N105 PolarHBondContact O-N 2.87Š|
| 106 | D | 49 | Very low | 57.3 | Low | 84 Ų | 84 | 110.1 Ų | 110.1 | 45% | 0.449 | 52% | 0.523 | S | S | . | . | trans | -154.1 | 83.6 | -177.2 | -142.8 | -16.2 | 0 | 0 | 0 | 113.3 | W102 R108 | W102-D106 PolarHBondContact O-N 3.28Å; D106-R108 PolarHBondContact O-N 2.84Å | ||
| 107 | E | 50.1 | Low | 57.5 | Low | 109 Ų | 109 | 112.3 Ų | 112.3 | 51% | 0.509 | 53% | 0.533 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | 14.2 | 176.2 | -156.9 | 173.3 | 150 | 0 | 0 | 113.2 | N37 | N37-E107 VanDerWaalsContact CG-CD 3.48Å; N37-E107 PolarHBondContact ND2-OE1 2.83Å; N37-E107 PolarHBondContact ND2-OE2 3.26Å; N37-E107 PolarHBondContact OD1-OE1 3.35Å |
| 108 | R | 48.1 | Very low | 57.5 | Low | 219 Ų | 219 | 110.3 Ų | 110.3 | 83% | 0.826 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.8 | -4.7 | -169.4 | -60.6 | -164.9 | -162.9 | -120.2 | 5.4 | 116 | D106 | D106-R108 PolarHBondContact O-N 2.84Š|
| 109 | M | 49.8 | Very low | 57.6 | Low | 111 Ų | 111 | 107.9 Ų | 107.9 | 55% | 0.547 | 53% | 0.526 | S | S | . | . | trans | -116.7 | 75.3 | 177.8 | -67.8 | -139.8 | 80.8 | 0 | 0 | 112.3 | H111 K112 | M109-H111 PolarHBondContact O-N 3.47Å; M109-K112 PolarHBondContact O-N 3Å; M109-K112 VanDerWaalsContact O-N 3.08Å | ||
| 110 | H | 49.9 | Very low | 57.9 | Low | 141 Ų | 141 | 107.4 Ų | 107.4 | 65% | 0.653 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -49 | -24.6 | -179.6 | -70.3 | -69 | 0 | 0 | 0 | 115.8 | ||
| 111 | H | 52.7 | Low | 58.6 | Low | 153 Ų | 153 | 107.1 Ų | 107.1 | 71% | 0.708 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -80 | -28.5 | 179.4 | -82.2 | 40.9 | 0 | 0 | 0 | 114.9 | M109 I115 | M109-H111 PolarHBondContact O-N 3.47Å; H111-I115 WeakPolarHBondContact O-CD1 3.44Å; H111-I115 WeakPolarHBondContact O-CG1 3.08Å |
| 112 | K | 52.5 | Low | 59.3 | Low | 146 Ų | 146 | 101.9 Ų | 101.9 | 64% | 0.635 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -82 | -28.4 | -176.7 | -76.4 | -178.4 | 171.6 | -74.8 | 0 | 112.1 | M109 L116 | M109-K112 PolarHBondContact O-N 3Å; M109-K112 VanDerWaalsContact O-N 3.08Å; K112-L116 WeakPolarHBondContact O-CB 3.49Å; K112-L116 PolarHBondContact O-N 3.48Å |
| 113 | L | 56.9 | Low | 60.1 | Low | 62 Ų | 62 | 99.7 Ų | 99.7 | 33% | 0.325 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.1 | -49.7 | 174.9 | -118.1 | 61.9 | 0 | 0 | 0 | 111.2 | N103 I115 L116 E117 | N103-L113 WeakPolarHBondContact OD1-CD2 3.43Å; L113-I115 PolarHBondContact O-N 3.16Å; L113-L116 PolarHBondContact O-N 2.95Å; L113-E117 WeakPolarHBondContact O-CB 3.49Å; L113-E117 PolarHBondContact O-N 2.97Å |
| 114 | D | 61.4 | Low | 60.9 | Low | 111 Ų | 111 | 98.9 Ų | 98.9 | 59% | 0.594 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.8 | -40 | -178 | -70.7 | -4.9 | 0 | 0 | 0 | 112.8 | L116 S118 | D114-L116 VanDerWaalsContact C-N 3.29Å; D114-L116 PolarHBondContact O-N 3.32Å; D114-S118 VanDerWaalsContact O-CB 3.25Å; D114-S118 WeakPolarHBondContact O-CB 3.08Å; D114-S118 PolarHBondContact O-N 2.76Å |
| 115 | I | 62.2 | Low | 62.2 | Low | 109 Ų | 109 | 98.5 Ų | 98.5 | 56% | 0.559 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -64 | -40 | 177.7 | -68.7 | 169.5 | 0 | 0 | 0 | 110.5 | H111 L113 S118 C119 | H111-I115 WeakPolarHBondContact O-CD1 3.44Å; H111-I115 WeakPolarHBondContact O-CG1 3.08Å; L113-I115 PolarHBondContact O-N 3.16Å; I115-S118 PolarHBondContact O-N 3.4Å; I115-C119 WeakPolarHBondContact O-CB 3.48Å; I115-C119 PolarHBondContact O-N 2.86Å; I115-C119 PolarHBondContact O-SG 3.29Å |
| 116 | L | 64.2 | Low | 63.3 | Low | 55 Ų | 55 | 95.8 Ų | 95.8 | 29% | 0.288 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -78.2 | -35.3 | -173.1 | -163.3 | 59.7 | 0 | 0 | 0 | 111.3 | I99 K112 L113 D114 V120 | I99-L116 HydrophobicContact CB-CD2 4.33Å; I99-L116 HydrophobicContact CD1-CD1 3.96Å; I99-L116 HydrophobicContact CD1-CD2 4.08Å; I99-L116 HydrophobicContact CD1-CG 3.52Å; I99-L116 HydrophobicContact CG1-CD1 4.01Å; I99-L116 HydrophobicContact CG1-CD2 3.33Å; I99-L116 HydrophobicContact CG1-CG 3.38Å; K112-L116 WeakPolarHBondContact O-CB 3.49Å; K112-L116 PolarHBondContact O-N 3.48Å; L113-L116 PolarHBondContact O-N 2.95Å; D114-L116 VanDerWaalsContact C-N 3.29Å; D114-L116 PolarHBondContact O-N 3.32Å; L116-V120 WeakPolarHBondContact O-CB 3.37Å; L116-V120 WeakPolarHBondContact O-CG2 3.29Å; L116-V120 PolarHBondContact O-N 2.88Å |
| 117 | E | 71.8 | Confident | 64.5 | Low | 77 Ų | 77 | 92.1 Ų | 92.1 | 36% | 0.36 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.2 | -46.6 | 168.4 | -169.5 | 178.5 | 146.7 | 0 | 0 | 111.4 | L113 C119 V120 M121 | L113-E117 WeakPolarHBondContact O-CB 3.49Å; L113-E117 PolarHBondContact O-N 2.97Å; E117-C119 VanDerWaalsContact C-N 3.35Å; E117-C119 PolarHBondContact O-N 3.42Å; E117-V120 PolarHBondContact O-N 3.44Å; E117-M121 HydrophobicContact CG-CE 4.08Å; E117-M121 WeakPolarHBondContact O-CB 3.26Å; E117-M121 PolarHBondContact O-N 3.46Å |
| 118 | S | 71.9 | Confident | 65.5 | Low | 75 Ų | 75 | 89.4 Ų | 89.4 | 52% | 0.524 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -63.9 | -38.8 | 177.1 | -164.7 | 0 | 0 | 0 | 0 | 112.3 | D114 I115 A122 | D114-S118 VanDerWaalsContact O-CB 3.25Å; D114-S118 WeakPolarHBondContact O-CB 3.08Å; D114-S118 PolarHBondContact O-N 2.76Å; I115-S118 PolarHBondContact O-N 3.4Å; S118-A122 VanDerWaalsContact O-CB 3.27Å; S118-A122 WeakPolarHBondContact O-CB 3.44Å; S118-A122 PolarHBondContact O-N 3.42Å |
| 119 | C | 71.4 | Confident | 66.8 | Low | 60 Ų | 60 | 81.5 Ų | 81.5 | 41% | 0.405 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63 | -46.9 | 172.3 | -78 | 0 | 0 | 0 | 0 | 111.7 | I115 E117 A122 F123 | I115-C119 WeakPolarHBondContact O-CB 3.48Å; I115-C119 PolarHBondContact O-N 2.86Å; I115-C119 PolarHBondContact O-SG 3.29Å; E117-C119 VanDerWaalsContact C-N 3.35Å; E117-C119 PolarHBondContact O-N 3.42Å; C119-A122 PolarHBondContact O-N 3.39Å; C119-F123 VanDerWaalsContact O-CD2 3.28Å; C119-F123 WeakPolarHBondContact O-CD2 3.31Å; C119-F123 PolarHBondContact O-N 2.87Å |
| 120 | V | 71.8 | Confident | 67.7 | Low | 22 Ų | 22 | 77.9 Ų | 77.9 | 13% | 0.133 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -61.7 | -48.7 | 178.4 | 164 | 0 | 0 | 0 | 0 | 111.6 | L96 I99 L116 E117 A122 F123 I124 | L96-V120 HydrophobicContact CD1-CG1 3.67Å; L96-V120 HydrophobicContact CD1-CG2 4.05Å; L96-V120 HydrophobicContact CG-CG1 4.33Å; I99-V120 HydrophobicContact CD1-CB 4.42Å; I99-V120 HydrophobicContact CD1-CG2 3.1Å; L116-V120 WeakPolarHBondContact O-CB 3.37Å; L116-V120 WeakPolarHBondContact O-CG2 3.29Å; L116-V120 PolarHBondContact O-N 2.88Å; E117-V120 PolarHBondContact O-N 3.44Å; V120-A122 VanDerWaalsContact C-N 3.28Å; V120-A122 PolarHBondContact O-N 3.34Å; V120-F123 PolarHBondContact O-N 3.48Å; V120-F123 VanDerWaalsContact O-N 3.15Å; V120-I124 HydrophobicContact CG1-CD1 3.42Å; V120-I124 VanDerWaalsContact CG1-CD1 3.42Å; V120-I124 HydrophobicContact CG1-CG1 4.2Å; V120-I124 WeakPolarHBondContact O-CB 3.22Å; V120-I124 VanDerWaalsContact O-CG1 3.26Å; V120-I124 WeakPolarHBondContact O-CG1 3.37Å; V120-I124 PolarHBondContact O-N 3.39Å |
| 121 | M | 74.3 | Confident | 68.7 | Low | 79 Ų | 79 | 71.7 Ų | 71.7 | 39% | 0.389 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58.3 | -41.5 | 176.5 | -78.8 | -157.4 | -88.7 | 0 | 0 | 111.8 | E47 E117 I124 F125 | E47-M121 VanDerWaalsContact OE1-SD 3.4Å; E117-M121 HydrophobicContact CG-CE 4.08Å; E117-M121 WeakPolarHBondContact O-CB 3.26Å; E117-M121 PolarHBondContact O-N 3.46Å; M121-I124 PolarHBondContact O-N 3.06Å; M121-F125 WeakPolarHBondContact O-CB 3.44Å; M121-F125 PolarHBondContact O-N 3.32Å |
| 122 | A | 74.6 | Confident | 69.6 | Low | 54 Ų | 54 | 68.7 Ų | 68.7 | 45% | 0.446 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -63.4 | -42.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S118 C119 V120 F125 V126 | S118-A122 VanDerWaalsContact O-CB 3.27Å; S118-A122 WeakPolarHBondContact O-CB 3.44Å; S118-A122 PolarHBondContact O-N 3.42Å; C119-A122 PolarHBondContact O-N 3.39Å; V120-A122 VanDerWaalsContact C-N 3.28Å; V120-A122 PolarHBondContact O-N 3.34Å; A122-F125 PolarHBondContact O-N 2.89Å; A122-V126 WeakPolarHBondContact O-CG2 3.45Å; A122-V126 PolarHBondContact O-N 3.09Å; A122-V126 VanDerWaalsContact O-N 3.16Å |
| 123 | F | 73.3 | Confident | 70.5 | Confident | 116 Ų | 116 | 67 Ų | 67 | 51% | 0.509 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -66.5 | -40.3 | 176.5 | -92.1 | -78.4 | 0 | 0 | 0 | 112.4 | V92 C119 V120 V126 I127 | V92-F123 HydrophobicContact CG2-CB 3.78Å; V92-F123 HydrophobicContact CG2-CD1 4.34Å; V92-F123 HydrophobicContact CG2-CG 4.28Å; C119-F123 VanDerWaalsContact O-CD2 3.28Å; C119-F123 WeakPolarHBondContact O-CD2 3.31Å; C119-F123 PolarHBondContact O-N 2.87Å; V120-F123 PolarHBondContact O-N 3.48Å; V120-F123 VanDerWaalsContact O-N 3.15Å; F123-V126 PolarHBondContact O-N 2.93Å; F123-I127 WeakPolarHBondContact O-CG1 3.36Å; F123-I127 PolarHBondContact O-N 3.48Å |
| 124 | I | 74.6 | Confident | 70.9 | Confident | 19 Ų | 19 | 65.1 Ų | 65.1 | 10% | 0.097 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.9 | -42.2 | 176.2 | -69.3 | 170.5 | 0 | 0 | 0 | 110.6 | D51 V92 V120 M121 V126 I127 V128 | D51-I124 HydrophobicContact CB-CD1 3.87Å; D51-I124 HydrophobicContact CB-CG2 4Å; D51-I124 VanDerWaalsContact OD2-CD1 3.24Å; D51-I124 WeakPolarHBondContact OD2-CD1 3.23Å; V92-I124 HydrophobicContact CG1-CG1 4.13Å; V120-I124 HydrophobicContact CG1-CD1 3.42Å; V120-I124 VanDerWaalsContact CG1-CD1 3.42Å; V120-I124 HydrophobicContact CG1-CG1 4.2Å; V120-I124 WeakPolarHBondContact O-CB 3.22Å; V120-I124 VanDerWaalsContact O-CG1 3.26Å; V120-I124 WeakPolarHBondContact O-CG1 3.37Å; V120-I124 PolarHBondContact O-N 3.39Å; M121-I124 PolarHBondContact O-N 3.06Å; I124-V126 VanDerWaalsContact C-N 3.31Å; I124-V126 PolarHBondContact O-N 3.01Å; I124-I127 WeakPolarHBondContact O-CB 3.04Å; I124-I127 PolarHBondContact O-N 3.35Å; I124-I127 VanDerWaalsContact O-N 3.11Å; I124-V128 HydrophobicContact CG2-CG2 4.36Å; I124-V128 WeakPolarHBondContact O-CG2 3.18Å; I124-V128 PolarHBondContact O-N 3.38Å |
| 125 | F | 75.6 | Confident | 71.1 | Confident | 140 Ų | 140 | 62.4 Ų | 62.4 | 61% | 0.614 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -57.2 | -44.4 | 175.2 | 178.8 | -101.9 | 0 | 0 | 0 | 111.9 | M121 A122 I127 V128 V129 | M121-F125 WeakPolarHBondContact O-CB 3.44Å; M121-F125 PolarHBondContact O-N 3.32Å; A122-F125 PolarHBondContact O-N 2.89Å; F125-I127 VanDerWaalsContact C-N 3.35Å; F125-I127 PolarHBondContact O-N 3.34Å; F125-V128 PolarHBondContact O-N 3.43Å; F125-V129 HydrophobicContact CD1-CG2 4.42Å; F125-V129 HydrophobicContact CE1-CG2 4.06Å; F125-V129 HydrophobicContact CE2-CG2 4.32Å; F125-V129 HydrophobicContact CZ-CG2 4Å; F125-V129 VanDerWaalsContact O-CG2 3.32Å; F125-V129 WeakPolarHBondContact O-CG2 3.49Å; F125-V129 PolarHBondContact O-N 2.89Å |
| 126 | V | 72.3 | Confident | 71.3 | Confident | 70 Ų | 70 | 60 Ų | 60 | 42% | 0.424 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -62.3 | -42.2 | 175.7 | 174.6 | 0 | 0 | 0 | 0 | 111.3 | A122 F123 I124 V129 V130 | A122-V126 WeakPolarHBondContact O-CG2 3.45Å; A122-V126 PolarHBondContact O-N 3.09Å; A122-V126 VanDerWaalsContact O-N 3.16Å; F123-V126 PolarHBondContact O-N 2.93Å; I124-V126 VanDerWaalsContact C-N 3.31Å; I124-V126 PolarHBondContact O-N 3.01Å; V126-V129 PolarHBondContact O-N 3.28Å; V126-V130 HydrophobicContact CG1-CG2 4.47Å; V126-V130 VanDerWaalsContact O-CG2 3.3Å; V126-V130 WeakPolarHBondContact O-CG2 3.42Å; V126-V130 PolarHBondContact O-N 2.84Å |
| 127 | I | 74.3 | Confident | 71.2 | Confident | 7 Ų | 7 | 63.4 Ų | 63.4 | 4% | 0.036 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -62.3 | -44.1 | 176.8 | -68.2 | 163.9 | 0 | 0 | 0 | 111.1 | L88 Q89 V92 F123 I124 F125 V130 N131 | L88-I127 HydrophobicContact CB-CD1 4.33Å; L88-I127 HydrophobicContact CB-CG1 4.13Å; L88-I127 HydrophobicContact CD2-CG1 4.47Å; Q89-I127 HydrophobicContact CG-CD1 4.27Å; Q89-I127 HydrophobicContact CG-CG2 3.96Å; V92-I127 HydrophobicContact CB-CD1 4.1Å; V92-I127 HydrophobicContact CG1-CD1 4.39Å; V92-I127 HydrophobicContact CG2-CD1 3.65Å; F123-I127 WeakPolarHBondContact O-CG1 3.36Å; F123-I127 PolarHBondContact O-N 3.48Å; I124-I127 WeakPolarHBondContact O-CB 3.04Å; I124-I127 PolarHBondContact O-N 3.35Å; I124-I127 VanDerWaalsContact O-N 3.11Å; F125-I127 VanDerWaalsContact C-N 3.35Å; F125-I127 PolarHBondContact O-N 3.34Å; I127-V130 PolarHBondContact O-N 2.86Å; I127-N131 WeakPolarHBondContact O-CB 3.46Å; I127-N131 PolarHBondContact O-N 3.29Å; I127-N131 PolarHBondContact O-ND2 3.02Å |
| 128 | V | 72.9 | Confident | 70.5 | Confident | 51 Ų | 51 | 61 Ų | 61 | 31% | 0.309 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 178 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | I124 F125 N131 V132 | I124-V128 HydrophobicContact CG2-CG2 4.36Å; I124-V128 WeakPolarHBondContact O-CG2 3.18Å; I124-V128 PolarHBondContact O-N 3.38Å; F125-V128 PolarHBondContact O-N 3.43Å; V128-N131 PolarHBondContact O-N 2.74Å; V128-V132 HydrophobicContact CG1-CG2 4.4Å; V128-V132 WeakPolarHBondContact O-CG2 3.26Å; V128-V132 PolarHBondContact O-N 3.2Å |
| 129 | V | 73.9 | Confident | 69.7 | Low | 54 Ų | 54 | 62.8 Ų | 62.8 | 33% | 0.327 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -61.4 | -47.5 | 178 | 170.5 | 0 | 0 | 0 | 0 | 111.1 | F125 V126 N131 V132 F133 | F125-V129 HydrophobicContact CD1-CG2 4.42Å; F125-V129 HydrophobicContact CE1-CG2 4.06Å; F125-V129 HydrophobicContact CE2-CG2 4.32Å; F125-V129 HydrophobicContact CZ-CG2 4Å; F125-V129 VanDerWaalsContact O-CG2 3.32Å; F125-V129 WeakPolarHBondContact O-CG2 3.49Å; F125-V129 PolarHBondContact O-N 2.89Å; V126-V129 PolarHBondContact O-N 3.28Å; V129-N131 VanDerWaalsContact C-N 3.31Å; V129-N131 PolarHBondContact O-N 2.95Å; V129-V132 PolarHBondContact O-N 3.44Å; V129-F133 HydrophobicContact CG1-CD2 3.83Å; V129-F133 HydrophobicContact CG1-CE2 3.61Å; V129-F133 WeakPolarHBondContact O-CD2 3.14Å; V129-F133 PolarHBondContact O-N 3.01Å |
| 130 | V | 69.3 | Low | 68.5 | Low | 34 Ų | 34 | 67.2 Ų | 67.2 | 21% | 0.206 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.7 | -41.6 | 176.8 | 172.4 | 0 | 0 | 0 | 0 | 111 | V126 I127 F133 I134 | V126-V130 HydrophobicContact CG1-CG2 4.47Å; V126-V130 VanDerWaalsContact O-CG2 3.3Å; V126-V130 WeakPolarHBondContact O-CG2 3.42Å; V126-V130 PolarHBondContact O-N 2.84Å; I127-V130 PolarHBondContact O-N 2.86Å; V130-F133 PolarHBondContact O-N 3.37Å; V130-I134 HydrophobicContact CG1-CD1 4.1Å; V130-I134 VanDerWaalsContact O-CG1 3.32Å; V130-I134 WeakPolarHBondContact O-CG1 3.25Å; V130-I134 PolarHBondContact O-N 3.38Å |
| 131 | N | 70.4 | Confident | 67.4 | Low | 12 Ų | 12 | 72.3 Ų | 72.3 | 6% | 0.064 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -65.7 | -39.2 | 176.9 | -71.1 | -16 | 0 | 0 | 0 | 112.6 | N58 S85 I127 V128 V129 F133 I134 T135 | N58-N131 HydrophobicContact CB-CB 4.46Å; N58-N131 WeakPolarHBondContact CB-ND2 3.35Å; N58-N131 PolarHBondContact ND2-ND2 2.9Å; N58-N131 VanDerWaalsContact ND2-ND2 3.15Å; S85-N131 PolarHBondContact OG-OD1 3.34Å; I127-N131 WeakPolarHBondContact O-CB 3.46Å; I127-N131 PolarHBondContact O-N 3.29Å; I127-N131 PolarHBondContact O-ND2 3.02Å; V128-N131 PolarHBondContact O-N 2.74Å; V129-N131 VanDerWaalsContact C-N 3.31Å; V129-N131 PolarHBondContact O-N 2.95Å; N131-F133 VanDerWaalsContact C-N 3.34Å; N131-F133 PolarHBondContact O-N 3.36Å; N131-I134 WeakPolarHBondContact O-CB 3.29Å; N131-I134 PolarHBondContact O-N 3.3Å; N131-T135 PolarHBondContact O-N 2.92Å; N131-T135 PolarHBondContact O-OG1 3.05Å |
| 132 | V | 73.1 | Confident | 66.1 | Low | 90 Ų | 90 | 73.3 Ų | 73.3 | 55% | 0.545 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.5 | -40.7 | 175 | 167.8 | 0 | 0 | 0 | 0 | 111.1 | V128 V129 T135 A136 | V128-V132 HydrophobicContact CG1-CG2 4.4Å; V128-V132 WeakPolarHBondContact O-CG2 3.26Å; V128-V132 PolarHBondContact O-N 3.2Å; V129-V132 PolarHBondContact O-N 3.44Å; V132-T135 PolarHBondContact O-N 3.3Å; V132-A136 VanDerWaalsContact O-CB 3.25Å; V132-A136 WeakPolarHBondContact O-CB 3.41Å; V132-A136 PolarHBondContact O-N 2.91Å |
| 133 | F | 70 | Confident | 64.7 | Low | 110 Ų | 110 | 78.8 Ų | 78.8 | 48% | 0.482 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61.5 | -44.1 | 172.5 | -81.2 | -69.3 | 0 | 0 | 0 | 111.3 | V129 V130 N131 T135 A136 F137 | V129-F133 HydrophobicContact CG1-CD2 3.83Å; V129-F133 HydrophobicContact CG1-CE2 3.61Å; V129-F133 WeakPolarHBondContact O-CD2 3.14Å; V129-F133 PolarHBondContact O-N 3.01Å; V130-F133 PolarHBondContact O-N 3.37Å; N131-F133 VanDerWaalsContact C-N 3.34Å; N131-F133 PolarHBondContact O-N 3.36Å; F133-T135 PolarHBondContact O-N 3.41Å; F133-A136 PolarHBondContact O-N 2.93Å; F133-F137 HydrophobicContact CB-CD2 4.28Å; F133-F137 HydrophobicContact CB-CE2 4.22Å; F133-F137 HydrophobicContact CD1-CD2 4.43Å; F133-F137 AromaticContact CD1-CE2 3.63Å; F133-F137 HydrophobicContact CD1-CE2 3.63Å; F133-F137 HydrophobicContact CD1-CZ 4.32Å; F133-F137 HydrophobicContact CE1-CE2 4.5Å; F133-F137 HydrophobicContact CG-CE2 4.38Å; F133-F137 WeakPolarHBondContact O-CB 3.14Å; F133-F137 WeakPolarHBondContact O-CD2 3.38Å; F133-F137 WeakPolarHBondContact O-CG 3.1Å; F133-F137 PolarHBondContact O-N 3.49Å |
| 134 | I | 66.6 | Low | 63.6 | Low | 22 Ų | 22 | 77.7 Ų | 77.7 | 11% | 0.113 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -59.2 | -47 | 175.3 | -65.8 | 164.5 | 0 | 0 | 0 | 111.2 | L78 L81 L82 V130 N131 F137 G138 | L78-I134 HydrophobicContact CD2-CG2 4.01Å; L81-I134 HydrophobicContact CB-CD1 3.91Å; L81-I134 HydrophobicContact CB-CG1 3.75Å; L82-I134 HydrophobicContact CB-CD1 4.19Å; V130-I134 HydrophobicContact CG1-CD1 4.1Å; V130-I134 VanDerWaalsContact O-CG1 3.32Å; V130-I134 WeakPolarHBondContact O-CG1 3.25Å; V130-I134 PolarHBondContact O-N 3.38Å; N131-I134 WeakPolarHBondContact O-CB 3.29Å; N131-I134 PolarHBondContact O-N 3.3Å; I134-F137 PolarHBondContact O-N 2.93Å; I134-G138 WeakPolarHBondContact O-CA 3.2Å; I134-G138 PolarHBondContact O-N 3.1Å |
| 135 | T | 64.1 | Low | 62.3 | Low | 55 Ų | 55 | 84.4 Ų | 84.4 | 34% | 0.337 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.8 | -43.6 | 178.2 | -60.4 | 0 | 0 | 0 | 0 | 111.7 | N131 V132 F133 F137 G138 V139 | N131-T135 PolarHBondContact O-N 2.92Å; N131-T135 PolarHBondContact O-OG1 3.05Å; V132-T135 PolarHBondContact O-N 3.3Å; F133-T135 PolarHBondContact O-N 3.41Å; T135-F137 VanDerWaalsContact C-N 3.31Å; T135-F137 PolarHBondContact O-N 3.03Å; T135-G138 PolarHBondContact O-N 2.7Å; T135-V139 HydrophobicContact CG2-CG2 4.46Å; T135-V139 WeakPolarHBondContact O-CB 3.49Å; T135-V139 PolarHBondContact O-N 2.93Å |
| 136 | A | 66.2 | Low | 60.9 | Low | 57 Ų | 57 | 84.9 Ų | 84.9 | 47% | 0.471 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.1 | -37.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | V132 F133 | V132-A136 VanDerWaalsContact O-CB 3.25Å; V132-A136 WeakPolarHBondContact O-CB 3.41Å; V132-A136 PolarHBondContact O-N 2.91Å; F133-A136 PolarHBondContact O-N 2.93Å |
| 137 | F | 62.8 | Low | 60.2 | Low | 128 Ų | 128 | 86.7 Ų | 86.7 | 56% | 0.561 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -86.1 | -22.3 | 177.1 | -66.3 | -57.9 | 0 | 0 | 0 | 113.5 | F133 I134 T135 | F133-F137 HydrophobicContact CB-CD2 4.28Å; F133-F137 HydrophobicContact CB-CE2 4.22Å; F133-F137 HydrophobicContact CD1-CD2 4.43Å; F133-F137 AromaticContact CD1-CE2 3.63Å; F133-F137 HydrophobicContact CD1-CE2 3.63Å; F133-F137 HydrophobicContact CD1-CZ 4.32Å; F133-F137 HydrophobicContact CE1-CE2 4.5Å; F133-F137 HydrophobicContact CG-CE2 4.38Å; F133-F137 WeakPolarHBondContact O-CB 3.14Å; F133-F137 WeakPolarHBondContact O-CD2 3.38Å; F133-F137 WeakPolarHBondContact O-CG 3.1Å; F133-F137 PolarHBondContact O-N 3.49Å; I134-F137 PolarHBondContact O-N 2.93Å; T135-F137 VanDerWaalsContact C-N 3.31Å; T135-F137 PolarHBondContact O-N 3.03Å |
| 138 | G | 57.4 | Low | 59.8 | Low | 27 Ų | 27 | 92 Ų | 92 | 28% | 0.278 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -83.9 | -22.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | I134 T135 Q140 | I134-G138 WeakPolarHBondContact O-CA 3.2Å; I134-G138 PolarHBondContact O-N 3.1Å; T135-G138 PolarHBondContact O-N 2.7Å; G138-Q140 PolarHBondContact O-N 3.33Å |
| 139 | V | 54.2 | Low | 59 | Low | 112 Ų | 112 | 95.6 Ų | 95.6 | 68% | 0.679 | 54% | 0.541 | S | S | * | . | S | Bend | trans | -73.6 | -0.2 | 178.4 | 145.5 | 0 | 0 | 0 | 0 | 114.2 | T135 Q141 | T135-V139 HydrophobicContact CG2-CG2 4.46Å; T135-V139 WeakPolarHBondContact O-CB 3.49Å; T135-V139 PolarHBondContact O-N 2.93Å; V139-Q141 VanDerWaalsContact C-N 3.31Å; V139-Q141 PolarHBondContact O-N 2.97Å |
| 140 | Q | 47.2 | Very low | 58.3 | Low | 153 Ų | 153 | 102.4 Ų | 102.4 | 72% | 0.715 | 59% | 0.591 | S | S | * | * | trans | -88.1 | 26.1 | -178.4 | -68.3 | -77.1 | -34.6 | 0 | 0 | 114.7 | G138 P142 | G138-Q140 PolarHBondContact O-N 3.33Å; Q140-P142 VanDerWaalsContact C-CD 3.44Å; Q140-P142 WeakPolarHBondContact O-CD 3.25Å | ||
| 141 | Q | 49.6 | Very low | 57.7 | Low | 128 Ų | 128 | 105.8 Ų | 105.8 | 60% | 0.598 | 61% | 0.61 | S | S | * | * | trans | -100.3 | 90.2 | 164.2 | -75.7 | -166.8 | 62 | 0 | 0 | 110.2 | V139 H143 | V139-Q141 VanDerWaalsContact C-N 3.31Å; V139-Q141 PolarHBondContact O-N 2.97Å; Q141-H143 PolarHBondContact O-N 2.82Å | ||
| 142 | P | 44.9 | Very low | 57.1 | Low | 101 Ų | 101 | 110.7 Ų | 110.7 | 66% | 0.656 | 64% | 0.639 | S | S | * | * | trans | -61.8 | 120.9 | 158.1 | 27.3 | -28.8 | 0 | 0 | 0 | 106.3 | Q140 S144 | Q140-P142 VanDerWaalsContact C-CD 3.44Å; Q140-P142 WeakPolarHBondContact O-CD 3.25Å; P142-S144 PolarHBondContact O-N 3.11Å | ||
| 143 | H | 45.6 | Very low | 56.2 | Low | 168 Ų | 168 | 111.9 Ų | 111.9 | 78% | 0.778 | 64% | 0.644 | S | S | * | * | trans | -59.5 | 94 | 162.6 | -142.1 | -25.9 | 0 | 0 | 0 | 105.5 | Q141 Q145 | Q141-H143 PolarHBondContact O-N 2.82Å; H143-Q145 PolarHBondContact O-N 3.3Å | ||
| 144 | S | 50.8 | Low | 55.4 | Low | 94 Ų | 94 | 112 Ų | 112 | 66% | 0.657 | 65% | 0.654 | S | S | * | * | trans | -67.4 | 73.3 | 162.1 | -63.9 | 0 | 0 | 0 | 0 | 106.5 | P142 N146 | P142-S144 PolarHBondContact O-N 3.11Å; S144-N146 PolarHBondContact O-N 3.08Å | ||
| 145 | Q | 47.7 | Very low | 54.7 | Low | 159 Ų | 159 | 117.6 Ų | 117.6 | 74% | 0.743 | 69% | 0.687 | S | S | * | * | trans | -70.1 | 94.3 | 154.6 | -97.6 | -163.5 | 37.8 | 0 | 0 | 105.9 | H143 S147 | H143-Q145 PolarHBondContact O-N 3.3Å; Q145-S147 PolarHBondContact O-N 3.24Å | ||
| 146 | N | 46.2 | Very low | 54 | Low | 151 Ų | 151 | 121.8 Ų | 121.8 | 81% | 0.807 | 71% | 0.711 | S | S | * | * | trans | -41.7 | 117.9 | 159.7 | -63.4 | -22 | 0 | 0 | 0 | 109.2 | S144 | S144-N146 PolarHBondContact O-N 3.08Š| ||
| 147 | S | 57.8 | Low | 53.2 | Low | 108 Ų | 108 | 126.4 Ų | 126.4 | 76% | 0.755 | 73% | 0.728 | S | S | * | * | trans | -95.2 | 167.9 | 156 | 29.9 | 0 | 0 | 0 | 0 | 108.3 | Q145 | Q145-S147 PolarHBondContact O-N 3.24Š| ||
| 148 | P | 64.9 | Low | 52.4 | Low | 117 Ų | 117 | 126.3 Ų | 126.3 | 76% | 0.76 | 74% | 0.741 | S | S | * | * | -105.3 | -173.6 | -73.7 | 36.2 | -21.4 | 0 | 0 | 0 | 111 | |||||
| 149 | P | 55.9 | Low | 52 | Low | 127 Ų | 127 | 134.6 Ų | 134.6 | 83% | 0.825 | 78% | 0.779 | S | S | * | * | trans | -119.9 | 153.7 | 137.4 | 34.6 | -29 | 0 | 0 | 0 | 112.7 | ||||
| 150 | S | 59.3 | Low | 51.8 | Low | 197 Ų | 197 | 136.6 Ų | 136.6 | 100% | 1.378 | 79% | 0.788 | S | S | * | * | trans | -56.6 | 0 | -163.1 | -44.7 | 0 | 0 | 0 | 0 | 117.5 |
Retrieved 150 of 150 residues in 98.9 ms
(Link to these results)