| 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 | 50.7 | Low | 57.3 | Low | 242 Ų | 242 | 144.7 Ų | 144.7 | 100% | 1.192 | 82% | 0.818 | S | S | * | * | 0 | 128.1 | 0 | -61.3 | -172.3 | 93.4 | 0 | 0 | 107.7 | |||||
| 2 | S | 50.8 | Low | 57.5 | Low | 120 Ų | 120 | 146.1 Ų | 146.1 | 84% | 0.839 | 82% | 0.818 | S | S | * | * | trans | 46.8 | 143.9 | 164.6 | -71.3 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 3 | S | 48.2 | Very low | 57.2 | Low | 90 Ų | 90 | 143.5 Ų | 143.5 | 63% | 0.629 | 82% | 0.816 | S | S | * | * | cis | 169 | 119.2 | -17.3 | 48.4 | 0 | 0 | 0 | 0 | 104.8 | ||||
| 4 | T | 63 | Low | 57.1 | Low | 135 Ų | 135 | 149.2 Ų | 149.2 | 83% | 0.828 | 82% | 0.818 | S | S | * | * | trans | -156.9 | 93.7 | 159.7 | 45.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 5 | H | 57.8 | Low | 57 | Low | 173 Ų | 173 | 147.9 Ų | 147.9 | 80% | 0.801 | 82% | 0.816 | S | S | * | * | 96.4 | 93.7 | 102.2 | -83.4 | 44.6 | 0 | 0 | 0 | 112.8 | |||||
| 6 | S | 60.7 | Low | 56.7 | Low | 115 Ų | 115 | 145.9 Ų | 145.9 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | trans | -78.5 | 121.9 | 170.3 | 175.4 | 0 | 0 | 0 | 0 | 109.9 | R8 | S6-R8 PolarHBondContact O-N 3.18Š| ||
| 7 | N | 61.8 | Low | 56.5 | Low | 160 Ų | 160 | 143.9 Ų | 143.9 | 86% | 0.856 | 81% | 0.808 | S | S | * | * | trans | -78.8 | 94.2 | 170.5 | -77.2 | -41.6 | 0 | 0 | 0 | 109.4 | S9 | N7-S9 PolarHBondContact O-N 3.27Š| ||
| 8 | R | 52.6 | Low | 56 | Low | 218 Ų | 218 | 142.8 Ų | 142.8 | 82% | 0.823 | 81% | 0.805 | S | S | * | * | trans | -82.4 | 100 | 168.3 | -175.5 | 176.6 | -177.1 | -154.6 | 1.1 | 108.8 | S6 T10 | S6-R8 PolarHBondContact O-N 3.18Å; R8-T10 PolarHBondContact O-N 3.42Å | ||
| 9 | S | 59.2 | Low | 56 | Low | 114 Ų | 114 | 141.5 Ų | 141.5 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | trans | -73.8 | 107.3 | 165.1 | -65.9 | 0 | 0 | 0 | 0 | 109.3 | N7 | N7-S9 PolarHBondContact O-N 3.27Š| ||
| 10 | T | 62 | Low | 55.8 | Low | 102 Ų | 102 | 140.6 Ų | 140.6 | 63% | 0.626 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 130 | 166.1 | 47.6 | 0 | 0 | 0 | 0 | 109.6 | R8 I12 | R8-T10 PolarHBondContact O-N 3.42Å; T10-I12 PolarHBondContact O-N 2.92Å |
| 11 | P | 63.9 | Low | 55.8 | Low | 123 Ų | 123 | 139.4 Ų | 139.4 | 80% | 0.799 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 123.2 | 166.3 | 28.7 | -28.6 | 0 | 0 | 0 | 108.7 | S13 | P11-S13 PolarHBondContact O-N 3.23Š|
| 12 | I | 59.2 | Low | 56.1 | Low | 161 Ų | 161 | 133.8 Ų | 133.8 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 117.6 | 170.3 | -77.1 | 168.2 | 0 | 0 | 0 | 108.2 | T10 R14 | T10-I12 PolarHBondContact O-N 2.92Å; I12-R14 PolarHBondContact O-N 2.95Å |
| 13 | S | 53.4 | Low | 56.1 | Low | 112 Ų | 112 | 134 Ų | 134 | 78% | 0.783 | 77% | 0.77 | S | S | * | * | trans | -58.4 | 104.4 | 167.5 | -66.6 | 0 | 0 | 0 | 0 | 109.4 | P11 T15 | P11-S13 PolarHBondContact O-N 3.23Å; S13-T15 PolarHBondContact O-N 3.39Å | ||
| 14 | R | 55.4 | Low | 56.5 | Low | 224 Ų | 224 | 138.9 Ų | 138.9 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | trans | -76.7 | 103.1 | 168.9 | -174.9 | 175.9 | -70.9 | -126.5 | -1 | 107.5 | I12 T16 | I12-R14 PolarHBondContact O-N 2.95Å; R14-T16 PolarHBondContact O-N 3.03Å; R14-T16 VanDerWaalsContact O-N 3.09Å | ||
| 15 | T | 56.9 | Low | 55.8 | Low | 129 Ų | 129 | 138.9 Ų | 138.9 | 79% | 0.791 | 78% | 0.78 | S | S | * | * | trans | -60.1 | 108.8 | 165.5 | 49.3 | 0 | 0 | 0 | 0 | 108.4 | S13 S17 | S13-T15 PolarHBondContact O-N 3.39Å; T15-S17 PolarHBondContact O-N 3.25Å | ||
| 16 | T | 52.3 | Low | 55.6 | Low | 117 Ų | 117 | 136.5 Ų | 136.5 | 72% | 0.718 | 78% | 0.778 | S | S | * | * | trans | -74.5 | 103.8 | 167.9 | 47.1 | 0 | 0 | 0 | 0 | 108 | R14 T18 | R14-T16 PolarHBondContact O-N 3.03Å; R14-T16 VanDerWaalsContact O-N 3.09Å; T16-T18 PolarHBondContact O-N 3.24Å; T16-T18 VanDerWaalsContact O-N 3.14Å | ||
| 17 | S | 52 | Low | 55 | Low | 111 Ų | 111 | 136.5 Ų | 136.5 | 78% | 0.776 | 77% | 0.773 | S | S | * | * | trans | -69 | 102.3 | 159.9 | 48.4 | 0 | 0 | 0 | 0 | 107.6 | T15 T19 | T15-S17 PolarHBondContact O-N 3.25Å; S17-T19 PolarHBondContact O-N 2.87Å | ||
| 18 | T | 48.7 | Very low | 54.2 | Low | 124 Ų | 124 | 135.3 Ų | 135.3 | 76% | 0.761 | 77% | 0.772 | S | S | * | * | trans | -63.4 | 99.5 | 174.4 | -49.1 | 0 | 0 | 0 | 0 | 109.1 | T16 | T16-T18 PolarHBondContact O-N 3.24Å; T16-T18 VanDerWaalsContact O-N 3.14Å | ||
| 19 | T | 56.1 | Low | 53.9 | Low | 118 Ų | 118 | 131.3 Ų | 131.3 | 72% | 0.724 | 77% | 0.772 | S | S | * | * | trans | -87.2 | 115.6 | 159.6 | -47.5 | 0 | 0 | 0 | 0 | 106.9 | S17 T21 | S17-T19 PolarHBondContact O-N 2.87Å; T19-T21 PolarHBondContact O-N 2.92Å | ||
| 20 | T | 50.3 | Low | 53.1 | Low | 123 Ų | 123 | 130.2 Ų | 130.2 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | trans | -60.3 | 97.9 | 175.6 | -44.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 21 | T | 57.4 | Low | 52.4 | Low | 116 Ų | 116 | 137.2 Ų | 137.2 | 71% | 0.712 | 79% | 0.786 | S | S | * | * | trans | -99.3 | 110.6 | 165.8 | -49 | 0 | 0 | 0 | 0 | 107.8 | T19 T23 | T19-T21 PolarHBondContact O-N 2.92Å; T21-T23 PolarHBondContact O-N 3.34Å | ||
| 22 | T | 56.3 | Low | 51.5 | Low | 124 Ų | 124 | 135.4 Ų | 135.4 | 76% | 0.761 | 78% | 0.777 | S | S | * | * | trans | -59 | 102.8 | 176.5 | -39.9 | 0 | 0 | 0 | 0 | 109.7 | K24 | T22-K24 PolarHBondContact O-N 3.24Š| ||
| 23 | T | 50.9 | Low | 51.5 | Low | 124 Ų | 124 | 137.9 Ų | 137.9 | 76% | 0.761 | 78% | 0.777 | S | S | * | * | trans | -75.6 | 105 | 171.5 | 50.2 | 0 | 0 | 0 | 0 | 109.2 | T21 T25 | T21-T23 PolarHBondContact O-N 3.34Å; T23-T25 PolarHBondContact O-N 3.46Å | ||
| 24 | K | 56.3 | Low | 52 | Low | 194 Ų | 194 | 139.9 Ų | 139.9 | 84% | 0.843 | 77% | 0.774 | S | S | * | * | trans | -81.2 | 106.3 | 156.5 | -86.9 | -176.1 | 175 | -178.2 | 0 | 107.8 | T22 T26 | T22-K24 PolarHBondContact O-N 3.24Å; K24-T26 PolarHBondContact O-N 2.91Å | ||
| 25 | T | 48.4 | Very low | 52.5 | Low | 135 Ų | 135 | 137.4 Ų | 137.4 | 83% | 0.828 | 77% | 0.772 | S | S | * | * | trans | -68.1 | 112.9 | 164.6 | 38.6 | 0 | 0 | 0 | 0 | 109.4 | T23 | T23-T25 PolarHBondContact O-N 3.46Š| ||
| 26 | T | 54.3 | Low | 53.1 | Low | 122 Ų | 122 | 134.4 Ų | 134.4 | 75% | 0.748 | 76% | 0.755 | S | S | * | * | trans | -128.5 | 101.2 | 163.2 | 14.6 | 0 | 0 | 0 | 0 | 108.2 | K24 | K24-T26 PolarHBondContact O-N 2.91Š| ||
| 27 | T | 47.9 | Very low | 54.6 | Low | 115 Ų | 115 | 133.3 Ų | 133.3 | 71% | 0.706 | 75% | 0.745 | S | S | * | * | trans | 21.6 | 105.4 | 136.3 | 14.6 | 0 | 0 | 0 | 0 | 117.6 | T29 | T27-T29 PolarHBondContact O-N 3.42Š| ||
| 28 | T | 45.3 | Very low | 56.2 | Low | 136 Ų | 136 | 136.6 Ų | 136.6 | 83% | 0.834 | 75% | 0.745 | S | S | * | * | trans | 4.7 | 97 | 141.1 | 38.7 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 29 | T | 45.3 | Very low | 57.9 | Low | 134 Ų | 134 | 137 Ų | 137 | 82% | 0.822 | 74% | 0.738 | S | S | * | * | trans | -149.6 | 130.9 | 156.2 | 41.3 | 0 | 0 | 0 | 0 | 110.2 | T27 | T27-T29 PolarHBondContact O-N 3.42Š| ||
| 30 | A | 43.2 | Very low | 59.5 | Low | 90 Ų | 90 | 133.8 Ų | 133.8 | 74% | 0.744 | 72% | 0.721 | S | S | * | * | S | Bend | trans | 21.9 | 120.7 | 162.5 | 0 | 0 | 0 | 0 | 0 | 120.2 | S32 | A30-S32 PolarHBondContact O-N 3.49Š|
| 31 | Y | 47.6 | Very low | 61.3 | Low | 249 Ų | 249 | 131.9 Ų | 131.9 | 98% | 0.976 | 71% | 0.705 | S | S | * | * | trans | -11.4 | 85 | 161.9 | -68 | -86.6 | 0 | 0 | 0 | 116 | ||||
| 32 | S | 44.3 | Very low | 62.9 | Low | 86 Ų | 86 | 128.6 Ų | 128.6 | 60% | 0.601 | 69% | 0.69 | S | S | * | * | trans | -86 | 113.6 | 168.7 | -179.8 | 0 | 0 | 0 | 0 | 108.7 | A30 E34 | A30-S32 PolarHBondContact O-N 3.49Å; S32-E34 PolarHBondContact O-N 2.97Å; S32-E34 PolarHBondContact OG-OE1 3.49Å; S32-E34 VanDerWaalsContact OG-OE1 3.04Å | ||
| 33 | Y | 58.7 | Low | 64.7 | Low | 213 Ų | 213 | 124.8 Ų | 124.8 | 84% | 0.835 | 67% | 0.671 | S | S | * | * | trans | -73.5 | 82.8 | 170.8 | -146.9 | -90.7 | 0 | 0 | 0 | 107.2 | H35 | Y33-H35 PolarHBondContact O-N 2.93Š| ||
| 34 | E | 63.2 | Low | 66.7 | Low | 154 Ų | 154 | 122.5 Ų | 122.5 | 72% | 0.72 | 66% | 0.657 | S | S | * | * | trans | -56.9 | 109.4 | 174 | -67.3 | -69 | 128.5 | 0 | 0 | 108.1 | S32 P36 | S32-E34 PolarHBondContact O-N 2.97Å; S32-E34 PolarHBondContact OG-OE1 3.49Å; S32-E34 VanDerWaalsContact OG-OE1 3.04Å; E34-P36 WeakPolarHBondContact O-CD 3.26Å | ||
| 35 | H | 65.8 | Low | 68.6 | Low | 171 Ų | 171 | 119.9 Ų | 119.9 | 79% | 0.792 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 121.6 | 174.9 | -97.3 | -76.3 | 0 | 0 | 0 | 107.9 | Y33 D37 | Y33-H35 PolarHBondContact O-N 2.93Å; H35-D37 PolarHBondContact O-N 3.42Å |
| 36 | P | 70.6 | Confident | 70.8 | Confident | 67 Ų | 67 | 119.5 Ų | 119.5 | 44% | 0.435 | 64% | 0.637 | S | S | . | * | P | Polyproline II helix | trans | -57 | 133.5 | 176.2 | 22.4 | -30.9 | 0 | 0 | 0 | 108.2 | E34 | E34-P36 WeakPolarHBondContact O-CD 3.26Š|
| 37 | D | 83 | Confident | 72.8 | Confident | 94 Ų | 94 | 118.8 Ų | 118.8 | 50% | 0.503 | 63% | 0.626 | S | S | . | * | P | Polyproline II helix | trans | -53.3 | 159.8 | 170.9 | 60.1 | 12.1 | 0 | 0 | 0 | 110.3 | H35 E39 S40 L41 | H35-D37 PolarHBondContact O-N 3.42Å; D37-E39 PolarHBondContact O-N 3.4Å; D37-E39 VanDerWaalsContact O-N 3.11Å; D37-S40 PolarHBondContact O-N 2.85Å; D37-S40 VanDerWaalsContact O-N 3.09Å; D37-S40 WeakPolarHBondContact OD1-CA 3.31Å; D37-S40 WeakPolarHBondContact OD1-CB 3.39Å; D37-S40 PolarHBondContact OD1-N 2.91Å; D37-L41 PolarHBondContact O-N 3.21Å |
| 38 | K | 86.3 | Confident | 75 | Confident | 179 Ų | 179 | 116.1 Ų | 116.1 | 78% | 0.778 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -58.4 | -31.9 | -174 | -69.5 | 177.7 | -179.2 | 174 | 0 | 110.6 | A42 | K38-A42 WeakPolarHBondContact O-CB 3.15Å; K38-A42 PolarHBondContact O-N 2.99Å |
| 39 | E | 84.9 | Confident | 77.5 | Confident | 132 Ų | 132 | 111.6 Ų | 111.6 | 62% | 0.617 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -64.4 | -48.7 | 176.5 | -65.3 | 74 | -165.5 | 0 | 0 | 111.8 | D37 A42 A43 | D37-E39 PolarHBondContact O-N 3.4Å; D37-E39 VanDerWaalsContact O-N 3.11Å; E39-A42 PolarHBondContact O-N 3.43Å; E39-A43 WeakPolarHBondContact O-CB 3.46Å; E39-A43 PolarHBondContact O-N 2.91Å |
| 40 | S | 88.7 | Confident | 79.9 | Confident | 52 Ų | 52 | 112.6 Ų | 112.6 | 36% | 0.364 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.7 | -40 | 176.7 | 176.8 | 0 | 0 | 0 | 0 | 112 | D37 A42 A43 T44 | D37-S40 PolarHBondContact O-N 2.85Å; D37-S40 VanDerWaalsContact O-N 3.09Å; D37-S40 WeakPolarHBondContact OD1-CA 3.31Å; D37-S40 WeakPolarHBondContact OD1-CB 3.39Å; D37-S40 PolarHBondContact OD1-N 2.91Å; S40-A42 PolarHBondContact O-N 2.83Å; S40-A43 PolarHBondContact O-N 3.41Å; S40-T44 WeakPolarHBondContact O-CB 3.38Å; S40-T44 PolarHBondContact O-N 3.27Å; S40-T44 PolarHBondContact O-OG1 3.34Å |
| 41 | L | 88 | Confident | 82.4 | Confident | 83 Ų | 83 | 116.8 Ų | 116.8 | 44% | 0.435 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -63.2 | -42.2 | 173.6 | -176 | 66.7 | 0 | 0 | 0 | 111.3 | D37 T44 K45 | D37-L41 PolarHBondContact O-N 3.21Å; L41-T44 PolarHBondContact O-N 2.97Å; L41-K45 WeakPolarHBondContact O-CG 3.46Å; L41-K45 PolarHBondContact O-N 3.07Å |
| 42 | A | 91.7 | Very high | 84.6 | Confident | 47 Ų | 47 | 105.8 Ų | 105.8 | 39% | 0.388 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -63.8 | -45.1 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | K38 E39 S40 T44 K45 I46 | K38-A42 WeakPolarHBondContact O-CB 3.15Å; K38-A42 PolarHBondContact O-N 2.99Å; E39-A42 PolarHBondContact O-N 3.43Å; S40-A42 PolarHBondContact O-N 2.83Å; A42-T44 PolarHBondContact O-N 3.45Å; A42-K45 WeakPolarHBondContact O-CB 3.36Å; A42-K45 PolarHBondContact O-N 3.3Å; A42-I46 WeakPolarHBondContact O-CG1 3.34Å; A42-I46 PolarHBondContact O-N 2.91Å |
| 43 | A | 93.3 | Very high | 87.1 | Confident | 44 Ų | 44 | 107.3 Ų | 107.3 | 36% | 0.364 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -59.8 | -44.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | E39 S40 K45 I46 Q47 | E39-A43 WeakPolarHBondContact O-CB 3.46Å; E39-A43 PolarHBondContact O-N 2.91Å; S40-A43 PolarHBondContact O-N 3.41Å; A43-K45 VanDerWaalsContact C-N 3.32Å; A43-K45 PolarHBondContact O-N 3.21Å; A43-I46 PolarHBondContact O-N 3.29Å; A43-Q47 WeakPolarHBondContact O-CB 3.34Å; A43-Q47 VanDerWaalsContact O-CG 3.27Å; A43-Q47 WeakPolarHBondContact O-CG 3.44Å; A43-Q47 PolarHBondContact O-N 3.09Å |
| 44 | T | 93.1 | Very high | 88.7 | Confident | 76 Ų | 76 | 99.5 Ų | 99.5 | 47% | 0.466 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.5 | -42.1 | 176.6 | -59.4 | 0 | 0 | 0 | 0 | 111.5 | S40 L41 A42 Q47 A48 | S40-T44 WeakPolarHBondContact O-CB 3.38Å; S40-T44 PolarHBondContact O-N 3.27Å; S40-T44 PolarHBondContact O-OG1 3.34Å; L41-T44 PolarHBondContact O-N 2.97Å; A42-T44 PolarHBondContact O-N 3.45Å; T44-Q47 PolarHBondContact O-N 3.14Å; T44-A48 WeakPolarHBondContact O-CB 3.41Å; T44-A48 PolarHBondContact O-N 3.33Å |
| 45 | K | 95.9 | Very high | 90 | Very high | 138 Ų | 138 | 96 Ų | 96 | 60% | 0.6 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.5 | -44.6 | 176.3 | -74 | 173.7 | -179.3 | 177.7 | 0 | 112.4 | L41 A42 A43 A48 G49 | L41-K45 WeakPolarHBondContact O-CG 3.46Å; L41-K45 PolarHBondContact O-N 3.07Å; A42-K45 WeakPolarHBondContact O-CB 3.36Å; A42-K45 PolarHBondContact O-N 3.3Å; A43-K45 VanDerWaalsContact C-N 3.32Å; A43-K45 PolarHBondContact O-N 3.21Å; K45-A48 PolarHBondContact O-N 3.33Å; K45-G49 PolarHBondContact O-N 3.36Å |
| 46 | I | 95.7 | Very high | 91.1 | Very high | 127 Ų | 127 | 95.5 Ų | 95.5 | 65% | 0.651 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62 | -46.8 | 177.5 | -68.4 | 169.9 | 0 | 0 | 0 | 110.3 | A42 A43 A48 G49 Y50 | A42-I46 WeakPolarHBondContact O-CG1 3.34Å; A42-I46 PolarHBondContact O-N 2.91Å; A43-I46 PolarHBondContact O-N 3.29Å; I46-A48 PolarHBondContact O-N 3.4Å; I46-G49 PolarHBondContact O-N 2.98Å; I46-Y50 WeakPolarHBondContact O-CB 3.48Å; I46-Y50 PolarHBondContact O-N 2.96Å |
| 47 | Q | 95.4 | Very high | 91.9 | Very high | 108 Ų | 108 | 99.4 Ų | 99.4 | 51% | 0.505 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.1 | -44.3 | 178.6 | -71 | 173.8 | -9.2 | 0 | 0 | 112 | A43 T44 Y50 R51 | A43-Q47 WeakPolarHBondContact O-CB 3.34Å; A43-Q47 VanDerWaalsContact O-CG 3.27Å; A43-Q47 WeakPolarHBondContact O-CG 3.44Å; A43-Q47 PolarHBondContact O-N 3.09Å; T44-Q47 PolarHBondContact O-N 3.14Å; Q47-Y50 PolarHBondContact O-N 3.11Å; Q47-R51 WeakPolarHBondContact O-CB 3.47Å; Q47-R51 VanDerWaalsContact O-CG 3.25Å; Q47-R51 WeakPolarHBondContact O-CG 3.32Å; Q47-R51 PolarHBondContact O-N 3.07Å |
| 48 | A | 96 | Very high | 92.1 | Very high | 59 Ų | 59 | 102.2 Ų | 102.2 | 49% | 0.488 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.7 | -43.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | T44 K45 I46 R51 G52 | T44-A48 WeakPolarHBondContact O-CB 3.41Å; T44-A48 PolarHBondContact O-N 3.33Å; K45-A48 PolarHBondContact O-N 3.33Å; I46-A48 PolarHBondContact O-N 3.4Å; A48-R51 PolarHBondContact O-N 3.48Å; A48-G52 PolarHBondContact O-N 2.87Å |
| 49 | G | 96.4 | Very high | 92 | Very high | 40 Ų | 40 | 99.3 Ų | 99.3 | 41% | 0.412 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.1 | -46 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | K45 I46 G52 Y53 | K45-G49 PolarHBondContact O-N 3.36Å; I46-G49 PolarHBondContact O-N 2.98Å; G49-G52 PolarHBondContact O-N 3.24Å; G49-Y53 WeakPolarHBondContact O-CB 3.25Å; G49-Y53 PolarHBondContact O-N 3.34Å |
| 50 | Y | 97 | Very high | 91.3 | Very high | 156 Ų | 156 | 94.8 Ų | 94.8 | 61% | 0.612 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.9 | -45.2 | 178.6 | -176 | -104.2 | 0 | 0 | 0 | 112.5 | I46 Q47 G52 Y53 C54 | I46-Y50 WeakPolarHBondContact O-CB 3.48Å; I46-Y50 PolarHBondContact O-N 2.96Å; Q47-Y50 PolarHBondContact O-N 3.11Å; Y50-G52 VanDerWaalsContact C-N 3.29Å; Y50-G52 PolarHBondContact O-N 3.42Å; Y50-Y53 WeakPolarHBondContact O-CB 3.39Å; Y50-Y53 PolarHBondContact O-N 3.38Å; Y50-Y53 VanDerWaalsContact O-N 3.15Å; Y50-C54 VanDerWaalsContact CE1-SG 3.55Å; Y50-C54 VanDerWaalsContact CZ-SG 3.54Å; Y50-C54 PolarHBondContact O-N 3.45Å; Y50-C54 PolarHBondContact O-SG 3.34Å; Y50-C54 VanDerWaalsContact O-SG 3.36Å |
| 51 | R | 95.1 | Very high | 90 | Very high | 178 Ų | 178 | 98.7 Ų | 98.7 | 67% | 0.672 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -56.2 | -45.5 | 173.7 | -71.8 | 173.3 | -172.3 | -135.3 | 5.4 | 110.8 | Q47 A48 C54 T55 | Q47-R51 WeakPolarHBondContact O-CB 3.47Å; Q47-R51 VanDerWaalsContact O-CG 3.25Å; Q47-R51 WeakPolarHBondContact O-CG 3.32Å; Q47-R51 PolarHBondContact O-N 3.07Å; A48-R51 PolarHBondContact O-N 3.48Å; R51-C54 PolarHBondContact O-N 3.18Å; R51-T55 PolarHBondContact O-N 2.9Å; R51-T55 PolarHBondContact O-OG1 3.06Å; R51-T55 VanDerWaalsContact O-OG1 3.13Å |
| 52 | G | 94.6 | Very high | 88.6 | Confident | 18 Ų | 18 | 99.8 Ų | 99.8 | 19% | 0.186 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -63.3 | -41.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | A48 G49 Y50 T55 R56 | A48-G52 PolarHBondContact O-N 2.87Å; G49-G52 PolarHBondContact O-N 3.24Å; Y50-G52 VanDerWaalsContact C-N 3.29Å; Y50-G52 PolarHBondContact O-N 3.42Å; G52-T55 PolarHBondContact O-N 2.92Å; G52-R56 VanDerWaalsContact C-CZ 3.45Å; G52-R56 WeakPolarHBondContact O-CB 3.47Å; G52-R56 WeakPolarHBondContact O-CG 3.31Å; G52-R56 PolarHBondContact O-N 3.37Å; G52-R56 PolarHBondContact O-NH1 3.5Å |
| 53 | Y | 94.8 | Very high | 86.9 | Confident | 117 Ų | 117 | 102.3 Ų | 102.3 | 46% | 0.459 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61 | -46.3 | 175.1 | 169.6 | -96.5 | 0 | 0 | 0 | 111.5 | G49 Y50 T55 R56 K57 | G49-Y53 WeakPolarHBondContact O-CB 3.25Å; G49-Y53 PolarHBondContact O-N 3.34Å; Y50-Y53 WeakPolarHBondContact O-CB 3.39Å; Y50-Y53 PolarHBondContact O-N 3.38Å; Y50-Y53 VanDerWaalsContact O-N 3.15Å; Y53-T55 PolarHBondContact O-N 2.99Å; Y53-R56 PolarHBondContact O-N 2.99Å; Y53-K57 HydrophobicContact CE1-CD 3.94Å; Y53-K57 VanDerWaalsContact O-CB 3.26Å; Y53-K57 WeakPolarHBondContact O-CB 3.24Å; Y53-K57 PolarHBondContact O-N 3.45Å; Y53-K57 PolarHBondContact OH-NZ 3.09Å |
| 54 | C | 92.3 | Very high | 85.1 | Confident | 49 Ų | 49 | 106.9 Ų | 106.9 | 33% | 0.331 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -60.1 | -45.3 | 177.1 | -70.9 | 0 | 0 | 0 | 0 | 111.9 | Y50 R51 K57 K58 | Y50-C54 VanDerWaalsContact CE1-SG 3.55Å; Y50-C54 VanDerWaalsContact CZ-SG 3.54Å; Y50-C54 PolarHBondContact O-N 3.45Å; Y50-C54 PolarHBondContact O-SG 3.34Å; Y50-C54 VanDerWaalsContact O-SG 3.36Å; R51-C54 PolarHBondContact O-N 3.18Å; C54-K57 PolarHBondContact O-N 2.95Å; C54-K58 WeakPolarHBondContact O-CB 3.2Å; C54-K58 PolarHBondContact O-N 3.32Å |
| 55 | T | 90.8 | Very high | 83.1 | Confident | 81 Ų | 81 | 109.6 Ų | 109.6 | 50% | 0.497 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -60.6 | -50.3 | 175.2 | -61.8 | 0 | 0 | 0 | 0 | 111.3 | R51 G52 Y53 K57 K58 Y59 | R51-T55 PolarHBondContact O-N 2.9Å; R51-T55 PolarHBondContact O-OG1 3.06Å; R51-T55 VanDerWaalsContact O-OG1 3.13Å; G52-T55 PolarHBondContact O-N 2.92Å; Y53-T55 PolarHBondContact O-N 2.99Å; T55-K57 VanDerWaalsContact C-N 3.3Å; T55-K57 PolarHBondContact O-N 3.01Å; T55-K58 PolarHBondContact O-N 2.62Å; T55-Y59 HydrophobicContact CG2-CD2 3.7Å; T55-Y59 HydrophobicContact CG2-CE2 3.97Å; T55-Y59 WeakPolarHBondContact O-CD2 3.23Å; T55-Y59 PolarHBondContact O-N 2.99Å |
| 56 | R | 89.3 | Confident | 81.1 | Confident | 161 Ų | 161 | 107.9 Ų | 107.9 | 61% | 0.608 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65.1 | -31.8 | 178.5 | -72.1 | -174.6 | -62.3 | -86.6 | 0.5 | 112.7 | G52 Y53 G60 | G52-R56 VanDerWaalsContact C-CZ 3.45Å; G52-R56 WeakPolarHBondContact O-CB 3.47Å; G52-R56 WeakPolarHBondContact O-CG 3.31Å; G52-R56 PolarHBondContact O-N 3.37Å; G52-R56 PolarHBondContact O-NH1 3.5Å; Y53-R56 PolarHBondContact O-N 2.99Å; R56-G60 WeakPolarHBondContact O-CA 3.28Å; R56-G60 PolarHBondContact O-N 3.02Å |
| 57 | K | 88.6 | Confident | 78.9 | Confident | 148 Ų | 148 | 106.6 Ų | 106.6 | 64% | 0.643 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -71.8 | -39.9 | 175 | -172.5 | 174.4 | -173 | 171.7 | 0 | 111.5 | Y53 C54 T55 | Y53-K57 HydrophobicContact CE1-CD 3.94Å; Y53-K57 VanDerWaalsContact O-CB 3.26Å; Y53-K57 WeakPolarHBondContact O-CB 3.24Å; Y53-K57 PolarHBondContact O-N 3.45Å; Y53-K57 PolarHBondContact OH-NZ 3.09Å; C54-K57 PolarHBondContact O-N 2.95Å; T55-K57 VanDerWaalsContact C-N 3.3Å; T55-K57 PolarHBondContact O-N 3.01Å |
| 58 | K | 86.6 | Confident | 76.6 | Confident | 154 Ų | 154 | 108.9 Ų | 108.9 | 67% | 0.67 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -68.1 | -40.1 | 177 | -171.7 | -179.6 | 179.7 | -169 | 0 | 112.1 | C54 T55 | C54-K58 WeakPolarHBondContact O-CB 3.2Å; C54-K58 PolarHBondContact O-N 3.32Å; T55-K58 PolarHBondContact O-N 2.62Å |
| 59 | Y | 84.3 | Confident | 74.3 | Confident | 117 Ų | 117 | 111.8 Ų | 111.8 | 46% | 0.459 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -108.7 | 3.6 | -175.4 | -54 | -69.6 | 0 | 0 | 0 | 115.1 | T55 N61 L62 | T55-Y59 HydrophobicContact CG2-CD2 3.7Å; T55-Y59 HydrophobicContact CG2-CE2 3.97Å; T55-Y59 WeakPolarHBondContact O-CD2 3.23Å; T55-Y59 PolarHBondContact O-N 2.99Å; Y59-N61 PolarHBondContact O-N 2.98Å; Y59-N61 VanDerWaalsContact O-N 3.15Å; Y59-L62 HydrophobicContact CD1-CD1 3.85Å; Y59-L62 HydrophobicContact CG-CD1 4.38Å; Y59-L62 WeakPolarHBondContact O-CB 3.28Å; Y59-L62 PolarHBondContact O-N 3.27Å |
| 60 | G | 69.3 | Low | 71.8 | Confident | 37 Ų | 37 | 115.5 Ų | 115.5 | 38% | 0.381 | 61% | 0.608 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -61.6 | -28.1 | -171.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | R56 | R56-G60 WeakPolarHBondContact O-CA 3.28Å; R56-G60 PolarHBondContact O-N 3.02Å |
| 61 | N | 61.8 | Low | 69.2 | Low | 134 Ų | 134 | 112 Ų | 112 | 72% | 0.717 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -11.9 | 174.7 | -68.2 | -28.5 | 0 | 0 | 0 | 113.7 | Y59 | Y59-N61 PolarHBondContact O-N 2.98Å; Y59-N61 VanDerWaalsContact O-N 3.15Å |
| 62 | L | 59.3 | Low | 66.6 | Low | 107 Ų | 107 | 110 Ų | 110 | 56% | 0.56 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | -24.2 | 177.1 | -73.1 | 95.2 | 0 | 0 | 0 | 112.3 | Y59 L64 S66 | Y59-L62 HydrophobicContact CD1-CD1 3.85Å; Y59-L62 HydrophobicContact CG-CD1 4.38Å; Y59-L62 WeakPolarHBondContact O-CB 3.28Å; Y59-L62 PolarHBondContact O-N 3.27Å; L62-L64 VanDerWaalsContact C-N 3.33Å; L62-L64 PolarHBondContact O-N 2.89Å; L62-S66 WeakPolarHBondContact O-CB 3.47Å; L62-S66 PolarHBondContact O-N 3.26Å |
| 63 | S | 55.4 | Low | 64.4 | Low | 100 Ų | 100 | 118.9 Ų | 118.9 | 70% | 0.699 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -19.2 | -179.4 | -176.6 | 0 | 0 | 0 | 0 | 114 | ||
| 64 | L | 56.1 | Low | 61.7 | Low | 140 Ų | 140 | 119.4 Ų | 119.4 | 73% | 0.733 | 66% | 0.656 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -17.5 | -179.6 | -72.8 | 165.3 | 0 | 0 | 0 | 112.6 | L62 | L62-L64 VanDerWaalsContact C-N 3.33Å; L62-L64 PolarHBondContact O-N 2.89Å |
| 65 | N | 50.9 | Low | 59.4 | Low | 132 Ų | 132 | 122.8 Ų | 122.8 | 71% | 0.706 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -125.8 | 7.9 | -172.5 | -68 | -27.4 | 0 | 0 | 0 | 114.5 | S67 | N65-S67 PolarHBondContact O-N 3.47Å; N65-S67 VanDerWaalsContact O-N 3.13Å |
| 66 | S | 53 | Low | 57.2 | Low | 103 Ų | 103 | 126.1 Ų | 126.1 | 72% | 0.72 | 69% | 0.694 | S | S | * | * | trans | -78.2 | 9.4 | -173.8 | 73.6 | 0 | 0 | 0 | 0 | 115.6 | L62 | L62-S66 WeakPolarHBondContact O-CB 3.47Å; L62-S66 PolarHBondContact O-N 3.26Å | ||
| 67 | S | 50.9 | Low | 55 | Low | 100 Ų | 100 | 123.3 Ų | 123.3 | 70% | 0.699 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -102.7 | 61.1 | 169.1 | 57.3 | 0 | 0 | 0 | 0 | 110.8 | N65 | N65-S67 PolarHBondContact O-N 3.47Å; N65-S67 VanDerWaalsContact O-N 3.13Å |
| 68 | L | 47.2 | Very low | 52.8 | Low | 155 Ų | 155 | 123 Ų | 123 | 81% | 0.812 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -168.8 | 142.5 | 153.3 | -93 | 136.6 | 0 | 0 | 0 | 110.4 | S70 | L68-S70 PolarHBondContact O-N 3.24Š|
| 69 | P | 45.8 | Very low | 50.7 | Low | 121 Ų | 121 | 127 Ų | 127 | 79% | 0.786 | 72% | 0.72 | S | S | * | * | trans | -72.8 | 127.5 | -179.2 | -4.7 | 22.1 | 0 | 0 | 0 | 110.4 | S71 | P69-S71 PolarHBondContact O-N 3.17Š| ||
| 70 | S | 43.7 | Very low | 48.6 | Very low | 117 Ų | 117 | 130.5 Ų | 130.5 | 82% | 0.818 | 74% | 0.741 | S | S | * | * | trans | -56.2 | 111.9 | 173.7 | 176.7 | 0 | 0 | 0 | 0 | 111.7 | L68 | L68-S70 PolarHBondContact O-N 3.24Š| ||
| 71 | S | 44.4 | Very low | 47 | Very low | 83 Ų | 83 | 133 Ų | 133 | 58% | 0.58 | 75% | 0.752 | S | S | * | * | trans | -95.8 | 106.2 | 156.7 | -175.3 | 0 | 0 | 0 | 0 | 108.9 | P69 Y73 | P69-S71 PolarHBondContact O-N 3.17Å; S71-Y73 VanDerWaalsContact O-CE2 3.28Å; S71-Y73 WeakPolarHBondContact O-CE2 3.49Å | ||
| 72 | N | 40 | Very low | 46 | Very low | 136 Ų | 136 | 138 Ų | 138 | 73% | 0.727 | 76% | 0.763 | S | S | * | * | trans | 9.3 | 98.5 | 152.7 | -65.7 | -25.6 | 0 | 0 | 0 | 120 | ||||
| 73 | Y | 47.8 | Very low | 45.4 | Very low | 204 Ų | 204 | 138.7 Ų | 138.7 | 80% | 0.8 | 77% | 0.772 | S | S | * | * | trans | -152.2 | 123.6 | 140.6 | -28.2 | -89.5 | 0 | 0 | 0 | 109.8 | S71 | S71-Y73 VanDerWaalsContact O-CE2 3.28Å; S71-Y73 WeakPolarHBondContact O-CE2 3.49Å | ||
| 74 | P | 38.9 | Very low | 44.8 | Very low | 129 Ų | 129 | 140.9 Ų | 140.9 | 84% | 0.838 | 77% | 0.774 | S | S | * | * | trans | -96.4 | 106.9 | 169.7 | 32.1 | -22.6 | 0 | 0 | 0 | 109.7 | ||||
| 75 | S | 44.1 | Very low | 44.4 | Very low | 120 Ų | 120 | 142 Ų | 142 | 84% | 0.839 | 78% | 0.775 | S | S | * | * | trans | -106.8 | 99.4 | 166.5 | 82.2 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 76 | I | 44.8 | Very low | 44 | Very low | 151 Ų | 151 | 144.6 Ų | 144.6 | 77% | 0.774 | 78% | 0.783 | S | S | * | * | trans | -20 | 130.3 | 153.7 | -73.4 | 157 | 0 | 0 | 0 | 116.1 | ||||
| 77 | S | 41.6 | Very low | 43.4 | Very low | 102 Ų | 102 | 144.2 Ų | 144.2 | 71% | 0.713 | 78% | 0.781 | S | S | * | * | trans | 43 | 119.8 | 138.7 | -53.8 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 78 | T | 43.5 | Very low | 43.1 | Very low | 142 Ų | 142 | 145.8 Ų | 145.8 | 87% | 0.871 | 79% | 0.788 | S | S | * | * | -157.9 | 118.7 | 121.7 | 34.6 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 79 | R | 41.6 | Very low | 43 | Very low | 236 Ų | 236 | 146.4 Ų | 146.4 | 89% | 0.891 | 79% | 0.791 | S | S | * | * | trans | -59.1 | 167.7 | 155.8 | -104.6 | 179.6 | 166.9 | -138.6 | 0.6 | 110.1 | ||||
| 80 | Q | 41.3 | Very low | 43.2 | Very low | 191 Ų | 191 | 151.5 Ų | 151.5 | 89% | 0.893 | 80% | 0.795 | S | S | * | * | trans | 94.2 | 129.5 | 178.6 | -52.4 | 176.7 | 53.5 | 0 | 0 | 110.1 | ||||
| 81 | S | 36 | Very low | 43.6 | Very low | 89 Ų | 89 | 151.1 Ų | 151.1 | 62% | 0.622 | 78% | 0.784 | S | S | * | * | cis | -165.9 | 145.9 | 29.8 | 40 | 0 | 0 | 0 | 0 | 109.5 | T83 | S81-T83 PolarHBondContact O-N 3.34Š| ||
| 82 | Y | 40.1 | Very low | 44 | Very low | 240 Ų | 240 | 152.9 Ų | 152.9 | 94% | 0.941 | 79% | 0.787 | S | S | * | * | trans | -69.4 | 113 | 159 | -51.5 | -94.6 | 0 | 0 | 0 | 107.4 | ||||
| 83 | T | 46.1 | Very low | 44.7 | Very low | 121 Ų | 121 | 152.1 Ų | 152.1 | 74% | 0.742 | 78% | 0.783 | S | S | * | * | trans | -133.6 | 106.8 | 166.1 | 53.2 | 0 | 0 | 0 | 0 | 110 | S81 | S81-T83 PolarHBondContact O-N 3.34Š| ||
| 84 | I | 43.7 | Very low | 45.2 | Very low | 147 Ų | 147 | 146.7 Ų | 146.7 | 75% | 0.754 | 77% | 0.768 | S | S | * | * | trans | -51 | 132.7 | 162.1 | -81.2 | 173.1 | 0 | 0 | 0 | 110.3 | ||||
| 85 | H | 48 | Very low | 46.3 | Very low | 162 Ų | 162 | 144.4 Ų | 144.4 | 75% | 0.75 | 75% | 0.748 | S | S | * | * | trans | 57.7 | 108.2 | 152.1 | -60 | -131.9 | 0 | 0 | 0 | 117.6 | ||||
| 86 | Q | 42.1 | Very low | 47.3 | Very low | 188 Ų | 188 | 142.8 Ų | 142.8 | 88% | 0.879 | 73% | 0.73 | S | S | * | * | trans | -165.4 | 125.9 | 139.6 | -107.1 | 156.3 | 95.7 | 0 | 0 | 112.1 | ||||
| 87 | S | 39.8 | Very low | 48.7 | Very low | 95 Ų | 95 | 140 Ų | 140 | 66% | 0.664 | 72% | 0.717 | S | S | * | * | trans | 63.4 | 109.9 | 153.7 | 56.2 | 0 | 0 | 0 | 0 | 120.3 | L89 | S87-L89 PolarHBondContact O-N 2.82Š| ||
| 88 | P | 44.5 | Very low | 50.4 | Low | 133 Ų | 133 | 139.2 Ų | 139.2 | 86% | 0.864 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -83.5 | 82.8 | 163.4 | 32.2 | -29.5 | 0 | 0 | 0 | 110.9 | ||
| 89 | L | 45.5 | Very low | 52.4 | Low | 167 Ų | 167 | 137.3 Ų | 137.3 | 87% | 0.874 | 69% | 0.689 | S | S | * | * | trans | -140.7 | 20.1 | 175.1 | -79.2 | 174.4 | 0 | 0 | 0 | 115.3 | S87 | S87-L89 PolarHBondContact O-N 2.82Š| ||
| 90 | R | 49.5 | Very low | 54.6 | Low | 229 Ų | 229 | 131.7 Ų | 131.7 | 86% | 0.864 | 68% | 0.676 | S | S | * | * | trans | -129.5 | 15.3 | -176.4 | -160.3 | 162.9 | 150.1 | -112.1 | -5.1 | 116.5 | ||||
| 91 | N | 52.8 | Low | 56.9 | Low | 108 Ų | 108 | 128.7 Ų | 128.7 | 58% | 0.578 | 66% | 0.662 | S | S | * | * | trans | -103.2 | 11.4 | -169.7 | -146.1 | 16.4 | 0 | 0 | 0 | 116.8 | N95 | N91-N95 PolarHBondContact O-ND2 3.25Š| ||
| 92 | N | 53 | Low | 59.5 | Low | 120 Ų | 120 | 129 Ų | 129 | 64% | 0.642 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -88.8 | -34.1 | 178.9 | -128.1 | -4 | 0 | 0 | 0 | 113.3 | N96 | N92-N96 PolarHBondContact O-N 3.47Å |
| 93 | N | 54.9 | Low | 62 | Low | 121 Ų | 121 | 119.8 Ų | 119.8 | 65% | 0.647 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -73.8 | -29 | -179.8 | -72.1 | -6.8 | 0 | 0 | 0 | 113.1 | N97 | N93-N97 WeakPolarHBondContact O-CB 3.4Å; N93-N97 VanDerWaalsContact O-CG 3.26Å; N93-N97 PolarHBondContact O-N 3.13Å; N93-N97 PolarHBondContact O-ND2 3.36Å |
| 94 | N | 57.6 | Low | 64.4 | Low | 90 Ų | 90 | 116 Ų | 116 | 48% | 0.481 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -71.4 | -34.3 | 178.4 | -77.8 | -3.4 | 0 | 0 | 0 | 112.5 | N98 | N94-N98 WeakPolarHBondContact O-CB 3.4Å; N94-N98 PolarHBondContact O-N 3.14Å; N94-N98 PolarHBondContact O-ND2 3.44Å |
| 95 | N | 61.2 | Low | 66.8 | Low | 80 Ų | 80 | 112.4 Ų | 112.4 | 43% | 0.428 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -67.5 | -45.1 | 175.9 | -70.7 | -15.2 | 0 | 0 | 0 | 110.9 | N91 N97 N98 D99 | N91-N95 PolarHBondContact O-ND2 3.25Å; N95-N97 VanDerWaalsContact C-N 3.34Å; N95-N97 PolarHBondContact O-N 3.18Å; N95-N98 PolarHBondContact O-N 2.87Å; N95-D99 WeakPolarHBondContact O-CB 3.36Å; N95-D99 PolarHBondContact O-N 3.37Å |
| 96 | N | 65.8 | Low | 69.1 | Low | 86 Ų | 86 | 113.8 Ų | 113.8 | 46% | 0.46 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -62.4 | -39.7 | 176.6 | -68.6 | -15.2 | 0 | 0 | 0 | 112.3 | N92 D99 L100 | N92-N96 PolarHBondContact O-N 3.47Å; N96-D99 PolarHBondContact O-N 2.9Å; N96-L100 WeakPolarHBondContact O-CB 3.25Å; N96-L100 WeakPolarHBondContact O-CG 3.26Å; N96-L100 PolarHBondContact O-N 2.83Å |
| 97 | N | 73.9 | Confident | 71.7 | Confident | 94 Ų | 94 | 110.5 Ų | 110.5 | 50% | 0.503 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -65.5 | -43.8 | 177 | -74.5 | -23.9 | 0 | 0 | 0 | 112 | N93 N95 D99 L100 E101 | N93-N97 WeakPolarHBondContact O-CB 3.4Å; N93-N97 VanDerWaalsContact O-CG 3.26Å; N93-N97 PolarHBondContact O-N 3.13Å; N93-N97 PolarHBondContact O-ND2 3.36Å; N95-N97 VanDerWaalsContact C-N 3.34Å; N95-N97 PolarHBondContact O-N 3.18Å; N97-D99 VanDerWaalsContact C-N 3.33Å; N97-D99 PolarHBondContact O-N 2.89Å; N97-L100 PolarHBondContact O-N 3.43Å; N97-E101 WeakPolarHBondContact O-CB 3.48Å; N97-E101 PolarHBondContact O-N 3.05Å |
| 98 | N | 77.9 | Confident | 74.4 | Confident | 84 Ų | 84 | 111.7 Ų | 111.7 | 45% | 0.449 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -62.5 | -40.8 | 175.6 | -70.2 | -26.6 | 0 | 0 | 0 | 111.3 | N94 N95 E101 N102 | N94-N98 WeakPolarHBondContact O-CB 3.4Å; N94-N98 PolarHBondContact O-N 3.14Å; N94-N98 PolarHBondContact O-ND2 3.44Å; N95-N98 PolarHBondContact O-N 2.87Å; N98-E101 PolarHBondContact O-N 2.88Å; N98-N102 VanDerWaalsContact O-CB 3.22Å; N98-N102 WeakPolarHBondContact O-CB 3.5Å; N98-N102 PolarHBondContact O-N 3.4Å; N98-N102 PolarHBondContact O-ND2 3.15Å |
| 99 | D | 86.1 | Confident | 76.9 | Confident | 102 Ų | 102 | 108.1 Ų | 108.1 | 55% | 0.545 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -68.5 | -40.1 | 178.9 | -73.3 | -18.6 | 0 | 0 | 0 | 112.1 | N95 N96 N97 A103 | N95-D99 WeakPolarHBondContact O-CB 3.36Å; N95-D99 PolarHBondContact O-N 3.37Å; N96-D99 PolarHBondContact O-N 2.9Å; N97-D99 VanDerWaalsContact C-N 3.33Å; N97-D99 PolarHBondContact O-N 2.89Å; D99-A103 VanDerWaalsContact O-CB 3.25Å; D99-A103 WeakPolarHBondContact O-CB 3.15Å; D99-A103 PolarHBondContact O-N 3.39Å |
| 100 | L | 87.3 | Confident | 79.4 | Confident | 119 Ų | 119 | 103.9 Ų | 103.9 | 62% | 0.623 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.1 | -43 | 174.1 | -73.1 | 170 | 0 | 0 | 0 | 111.8 | N96 N97 A103 A104 | N96-L100 WeakPolarHBondContact O-CB 3.25Å; N96-L100 WeakPolarHBondContact O-CG 3.26Å; N96-L100 PolarHBondContact O-N 2.83Å; N97-L100 PolarHBondContact O-N 3.43Å; L100-A103 PolarHBondContact O-N 3.19Å; L100-A104 WeakPolarHBondContact O-CB 3.27Å; L100-A104 PolarHBondContact O-N 3.46Å |
| 101 | E | 89.4 | Confident | 81.7 | Confident | 127 Ų | 127 | 99.7 Ų | 99.7 | 59% | 0.593 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -65.7 | -42.6 | 176.5 | -175.3 | 175.5 | -172.5 | 0 | 0 | 111.7 | N97 N98 A104 T105 | N97-E101 WeakPolarHBondContact O-CB 3.48Å; N97-E101 PolarHBondContact O-N 3.05Å; N98-E101 PolarHBondContact O-N 2.88Å; E101-A104 PolarHBondContact O-N 3.33Å; E101-T105 WeakPolarHBondContact O-CB 3.47Å; E101-T105 PolarHBondContact O-N 2.9Å; E101-T105 PolarHBondContact O-OG1 3.15Å |
| 102 | N | 90.5 | Very high | 83.8 | Confident | 95 Ų | 95 | 103.4 Ų | 103.4 | 51% | 0.508 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.2 | -43.6 | 173.9 | -75.6 | -32 | 0 | 0 | 0 | 111.4 | N98 T105 R106 | N98-N102 VanDerWaalsContact O-CB 3.22Å; N98-N102 WeakPolarHBondContact O-CB 3.5Å; N98-N102 PolarHBondContact O-N 3.4Å; N98-N102 PolarHBondContact O-ND2 3.15Å; N102-T105 PolarHBondContact O-N 3.38Å; N102-R106 VanDerWaalsContact O-CG 3.3Å; N102-R106 WeakPolarHBondContact O-CG 3.39Å; N102-R106 PolarHBondContact O-N 2.9Å |
| 103 | A | 93.5 | Very high | 85.9 | Confident | 47 Ų | 47 | 98.6 Ų | 98.6 | 39% | 0.388 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.5 | -46.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | D99 L100 T105 R106 I107 | D99-A103 VanDerWaalsContact O-CB 3.25Å; D99-A103 WeakPolarHBondContact O-CB 3.15Å; D99-A103 PolarHBondContact O-N 3.39Å; L100-A103 PolarHBondContact O-N 3.19Å; A103-T105 PolarHBondContact O-N 3.36Å; A103-R106 PolarHBondContact O-N 2.78Å; A103-I107 WeakPolarHBondContact O-CG1 3.45Å; A103-I107 PolarHBondContact O-N 2.93Å |
| 104 | A | 94.6 | Very high | 87.9 | Confident | 41 Ų | 41 | 98.7 Ų | 98.7 | 34% | 0.339 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.2 | -45.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | L100 E101 R106 I107 Q108 | L100-A104 WeakPolarHBondContact O-CB 3.27Å; L100-A104 PolarHBondContact O-N 3.46Å; E101-A104 PolarHBondContact O-N 3.33Å; A104-R106 VanDerWaalsContact C-N 3.34Å; A104-R106 PolarHBondContact O-N 3.28Å; A104-I107 PolarHBondContact O-N 3.4Å; A104-Q108 WeakPolarHBondContact O-CB 3.46Å; A104-Q108 VanDerWaalsContact O-CG 3.25Å; A104-Q108 WeakPolarHBondContact O-CG 2.95Å; A104-Q108 PolarHBondContact O-N 2.73Å |
| 105 | T | 95.1 | Very high | 89.7 | Confident | 73 Ų | 73 | 98 Ų | 98 | 45% | 0.448 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59.7 | -43.1 | 177 | -60.6 | 0 | 0 | 0 | 0 | 111.6 | E101 N102 A103 Q108 A109 | E101-T105 WeakPolarHBondContact O-CB 3.47Å; E101-T105 PolarHBondContact O-N 2.9Å; E101-T105 PolarHBondContact O-OG1 3.15Å; N102-T105 PolarHBondContact O-N 3.38Å; A103-T105 PolarHBondContact O-N 3.36Å; T105-Q108 PolarHBondContact O-N 3.32Å; T105-A109 VanDerWaalsContact O-CB 3.26Å; T105-A109 WeakPolarHBondContact O-CB 3.44Å; T105-A109 PolarHBondContact O-N 3.13Å |
| 106 | R | 96.7 | Very high | 91.3 | Very high | 190 Ų | 190 | 98.3 Ų | 98.3 | 72% | 0.717 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.1 | -41.5 | 176.8 | -72.7 | 176.1 | 68.8 | 173.9 | 1.8 | 112.3 | N102 A103 A104 S110 | N102-R106 VanDerWaalsContact O-CG 3.3Å; N102-R106 WeakPolarHBondContact O-CG 3.39Å; N102-R106 PolarHBondContact O-N 2.9Å; A103-R106 PolarHBondContact O-N 2.78Å; A104-R106 VanDerWaalsContact C-N 3.34Å; A104-R106 PolarHBondContact O-N 3.28Å; R106-S110 VanDerWaalsContact O-CB 3.32Å; R106-S110 WeakPolarHBondContact O-CB 3.12Å; R106-S110 PolarHBondContact O-N 3.32Å; R106-S110 PolarHBondContact O-OG 3.47Å |
| 107 | I | 96.5 | Very high | 92.6 | Very high | 120 Ų | 120 | 101.7 Ų | 101.7 | 62% | 0.615 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.5 | -48.9 | 176.9 | -68.4 | 167.6 | 0 | 0 | 0 | 110 | A103 A104 A109 S110 Y111 | A103-I107 WeakPolarHBondContact O-CG1 3.45Å; A103-I107 PolarHBondContact O-N 2.93Å; A104-I107 PolarHBondContact O-N 3.4Å; I107-A109 PolarHBondContact O-N 3.01Å; I107-S110 PolarHBondContact O-N 3.37Å; I107-Y111 WeakPolarHBondContact O-CB 3.45Å; I107-Y111 PolarHBondContact O-N 2.88Å |
| 108 | Q | 96.9 | Very high | 93.5 | Very high | 119 Ų | 119 | 101.4 Ų | 101.4 | 56% | 0.556 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60 | -45.9 | 178.3 | -71.4 | 170 | -15.8 | 0 | 0 | 111.9 | A104 T105 S110 Y111 R112 | A104-Q108 WeakPolarHBondContact O-CB 3.46Å; A104-Q108 VanDerWaalsContact O-CG 3.25Å; A104-Q108 WeakPolarHBondContact O-CG 2.95Å; A104-Q108 PolarHBondContact O-N 2.73Å; T105-Q108 PolarHBondContact O-N 3.32Å; Q108-S110 VanDerWaalsContact C-N 3.34Å; Q108-S110 PolarHBondContact O-N 3.27Å; Q108-Y111 PolarHBondContact O-N 3.14Å; Q108-R112 WeakPolarHBondContact O-CB 3.38Å; Q108-R112 VanDerWaalsContact O-CG 3.26Å; Q108-R112 WeakPolarHBondContact O-CG 3.19Å; Q108-R112 PolarHBondContact O-N 2.91Å |
| 109 | A | 97 | Very high | 94.1 | Very high | 59 Ų | 59 | 99.6 Ų | 99.6 | 49% | 0.488 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | T105 I107 G113 | T105-A109 VanDerWaalsContact O-CB 3.26Å; T105-A109 WeakPolarHBondContact O-CB 3.44Å; T105-A109 PolarHBondContact O-N 3.13Å; I107-A109 PolarHBondContact O-N 3.01Å; A109-G113 PolarHBondContact O-N 2.86Å |
| 110 | S | 96.8 | Very high | 94.3 | Very high | 78 Ų | 78 | 99.4 Ų | 99.4 | 55% | 0.545 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.7 | -42.5 | 177.4 | -59.4 | 0 | 0 | 0 | 0 | 112 | R106 I107 Q108 G113 Y114 | R106-S110 VanDerWaalsContact O-CB 3.32Å; R106-S110 WeakPolarHBondContact O-CB 3.12Å; R106-S110 PolarHBondContact O-N 3.32Å; R106-S110 PolarHBondContact O-OG 3.47Å; I107-S110 PolarHBondContact O-N 3.37Å; Q108-S110 VanDerWaalsContact C-N 3.34Å; Q108-S110 PolarHBondContact O-N 3.27Å; S110-G113 PolarHBondContact O-N 3.41Å; S110-Y114 WeakPolarHBondContact O-CB 3.33Å; S110-Y114 PolarHBondContact O-N 3.39Å |
| 111 | Y | 97.9 | Very high | 94.3 | Very high | 141 Ų | 141 | 100.9 Ų | 100.9 | 55% | 0.553 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -67.3 | -45.1 | 178.1 | -176.4 | -109.8 | 0 | 0 | 0 | 112.2 | I107 Q108 G113 Y114 L115 | I107-Y111 WeakPolarHBondContact O-CB 3.45Å; I107-Y111 PolarHBondContact O-N 2.88Å; Q108-Y111 PolarHBondContact O-N 3.14Å; Y111-G113 VanDerWaalsContact C-N 3.31Å; Y111-G113 PolarHBondContact O-N 3.37Å; Y111-Y114 HydrophobicContact CD2-CD1 4.35Å; Y111-Y114 HydrophobicContact CE2-CD1 4.36Å; Y111-Y114 WeakPolarHBondContact O-CB 3.47Å; Y111-Y114 PolarHBondContact O-N 2.97Å; Y111-Y114 VanDerWaalsContact O-N 3.1Å; Y111-L115 HydrophobicContact CD1-CD1 4.02Å; Y111-L115 HydrophobicContact CD1-CG 4.37Å; Y111-L115 HydrophobicContact CE1-CD1 3.54Å; Y111-L115 HydrophobicContact CE1-CD2 4.4Å; Y111-L115 HydrophobicContact CE1-CG 4.01Å; Y111-L115 HydrophobicContact CE2-CD2 4.37Å; Y111-L115 HydrophobicContact CE2-CG 4.45Å; Y111-L115 WeakPolarHBondContact O-CG 3.38Å; Y111-L115 PolarHBondContact O-N 3.49Å |
| 112 | R | 96.8 | Very high | 94 | Very high | 185 Ų | 185 | 97.5 Ų | 97.5 | 70% | 0.698 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -56.1 | -46.5 | 172.9 | -71.5 | 169.8 | 69.3 | 174.1 | 3 | 111.1 | Q108 Y114 L115 T116 | Q108-R112 WeakPolarHBondContact O-CB 3.38Å; Q108-R112 VanDerWaalsContact O-CG 3.26Å; Q108-R112 WeakPolarHBondContact O-CG 3.19Å; Q108-R112 PolarHBondContact O-N 2.91Å; R112-Y114 PolarHBondContact O-N 3.48Å; R112-L115 PolarHBondContact O-N 3.43Å; R112-T116 PolarHBondContact O-N 3.45Å; R112-T116 PolarHBondContact O-OG1 3.25Å |
| 113 | G | 97 | Very high | 93.4 | Very high | 19 Ų | 19 | 97.7 Ų | 97.7 | 20% | 0.196 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -64.1 | -37 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | A109 S110 Y111 T116 R117 | A109-G113 PolarHBondContact O-N 2.86Å; S110-G113 PolarHBondContact O-N 3.41Å; Y111-G113 VanDerWaalsContact C-N 3.31Å; Y111-G113 PolarHBondContact O-N 3.37Å; G113-T116 PolarHBondContact O-N 2.93Å; G113-R117 WeakPolarHBondContact O-CG 3.44Å; G113-R117 VanDerWaalsContact O-CZ 3.31Å; G113-R117 PolarHBondContact O-N 3.01Å; G113-R117 PolarHBondContact O-NH1 2.9Å |
| 114 | Y | 97.4 | Very high | 91.9 | Very high | 124 Ų | 124 | 99.7 Ų | 99.7 | 49% | 0.486 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.5 | -46.5 | 173.5 | 166.1 | -97.2 | 0 | 0 | 0 | 111.6 | S110 Y111 R112 T116 R117 K118 | S110-Y114 WeakPolarHBondContact O-CB 3.33Å; S110-Y114 PolarHBondContact O-N 3.39Å; Y111-Y114 HydrophobicContact CD2-CD1 4.35Å; Y111-Y114 HydrophobicContact CE2-CD1 4.36Å; Y111-Y114 WeakPolarHBondContact O-CB 3.47Å; Y111-Y114 PolarHBondContact O-N 2.97Å; Y111-Y114 VanDerWaalsContact O-N 3.1Å; R112-Y114 PolarHBondContact O-N 3.48Å; Y114-T116 PolarHBondContact O-N 2.9Å; Y114-R117 PolarHBondContact O-N 3.27Å; Y114-K118 HydrophobicContact CE1-CD 4.31Å; Y114-K118 WeakPolarHBondContact O-CB 3.33Å; Y114-K118 PolarHBondContact O-N 2.93Å |
| 115 | L | 95.3 | Very high | 90.3 | Very high | 76 Ų | 76 | 101.3 Ų | 101.3 | 40% | 0.398 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.1 | -45.6 | 176.4 | -69.5 | 179.9 | 0 | 0 | 0 | 111.6 | Y111 R112 R117 K118 A119 | Y111-L115 HydrophobicContact CD1-CD1 4.02Å; Y111-L115 HydrophobicContact CD1-CG 4.37Å; Y111-L115 HydrophobicContact CE1-CD1 3.54Å; Y111-L115 HydrophobicContact CE1-CD2 4.4Å; Y111-L115 HydrophobicContact CE1-CG 4.01Å; Y111-L115 HydrophobicContact CE2-CD2 4.37Å; Y111-L115 HydrophobicContact CE2-CG 4.45Å; Y111-L115 WeakPolarHBondContact O-CG 3.38Å; Y111-L115 PolarHBondContact O-N 3.49Å; R112-L115 PolarHBondContact O-N 3.43Å; L115-R117 PolarHBondContact O-N 2.91Å; L115-K118 PolarHBondContact O-N 3.4Å; L115-A119 WeakPolarHBondContact O-CB 3.44Å; L115-A119 PolarHBondContact O-N 3.07Å |
| 116 | T | 94.5 | Very high | 88.4 | Confident | 85 Ų | 85 | 104.4 Ų | 104.4 | 52% | 0.521 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.1 | -46.4 | 175.7 | -55.8 | 0 | 0 | 0 | 0 | 111.8 | R112 G113 Y114 K118 A119 L120 | R112-T116 PolarHBondContact O-N 3.45Å; R112-T116 PolarHBondContact O-OG1 3.25Å; G113-T116 PolarHBondContact O-N 2.93Å; Y114-T116 PolarHBondContact O-N 2.9Å; T116-K118 VanDerWaalsContact C-N 3.31Å; T116-K118 PolarHBondContact O-N 3.22Å; T116-A119 PolarHBondContact O-N 3.46Å; T116-L120 HydrophobicContact CG2-CD1 4.26Å; T116-L120 WeakPolarHBondContact O-CG 3.45Å; T116-L120 PolarHBondContact O-N 2.86Å |
| 117 | R | 93.2 | Very high | 86.4 | Confident | 158 Ų | 158 | 101.8 Ų | 101.8 | 60% | 0.596 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.5 | -34.8 | 178.1 | -72.2 | -174.5 | -61 | -86.6 | 1.5 | 112.5 | G113 Y114 L115 R121 | G113-R117 WeakPolarHBondContact O-CG 3.44Å; G113-R117 VanDerWaalsContact O-CZ 3.31Å; G113-R117 PolarHBondContact O-N 3.01Å; G113-R117 PolarHBondContact O-NH1 2.9Å; Y114-R117 PolarHBondContact O-N 3.27Å; L115-R117 PolarHBondContact O-N 2.91Å; R117-R121 PolarHBondContact O-N 2.96Å; R117-R121 VanDerWaalsContact O-N 3.07Å |
| 118 | K | 93.2 | Very high | 84.1 | Confident | 87 Ų | 87 | 97.3 Ų | 97.3 | 38% | 0.378 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.5 | -48.9 | 175.4 | -174.7 | -177.7 | 175.6 | -173.4 | 0 | 111 | Y114 L115 T116 L120 R121 D122 | Y114-K118 HydrophobicContact CE1-CD 4.31Å; Y114-K118 WeakPolarHBondContact O-CB 3.33Å; Y114-K118 PolarHBondContact O-N 2.93Å; L115-K118 PolarHBondContact O-N 3.4Å; T116-K118 VanDerWaalsContact C-N 3.31Å; T116-K118 PolarHBondContact O-N 3.22Å; K118-L120 VanDerWaalsContact C-N 3.34Å; K118-L120 PolarHBondContact O-N 3.27Å; K118-R121 WeakPolarHBondContact O-CA 3.33Å; K118-R121 WeakPolarHBondContact O-CB 2.87Å; K118-R121 PolarHBondContact O-N 3.5Å; K118-D122 VanDerWaalsContact O-CG 3.28Å; K118-D122 PolarHBondContact O-N 2.74Å |
| 119 | A | 90.7 | Very high | 82 | Confident | 47 Ų | 47 | 100.5 Ų | 100.5 | 39% | 0.388 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -57.3 | -46.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | L115 T116 R121 D122 D123 | L115-A119 WeakPolarHBondContact O-CB 3.44Å; L115-A119 PolarHBondContact O-N 3.07Å; T116-A119 PolarHBondContact O-N 3.46Å; A119-R121 VanDerWaalsContact C-N 3.28Å; A119-R121 PolarHBondContact O-N 3.47Å; A119-D122 PolarHBondContact O-N 2.91Å; A119-D123 WeakPolarHBondContact O-CB 3.41Å; A119-D123 PolarHBondContact O-N 3.39Å |
| 120 | L | 90 | Very high | 79.7 | Confident | 97 Ų | 97 | 106.3 Ų | 106.3 | 51% | 0.508 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.3 | -37.2 | 174.8 | -70.1 | 173.4 | 0 | 0 | 0 | 112.2 | T116 K118 N124 | T116-L120 HydrophobicContact CG2-CD1 4.26Å; T116-L120 WeakPolarHBondContact O-CG 3.45Å; T116-L120 PolarHBondContact O-N 2.86Å; K118-L120 VanDerWaalsContact C-N 3.34Å; K118-L120 PolarHBondContact O-N 3.27Å; L120-N124 WeakPolarHBondContact O-CB 3.44Å; L120-N124 PolarHBondContact O-N 3.3Å; L120-N124 PolarHBondContact O-ND2 3.25Å |
| 121 | R | 87.7 | Confident | 77.1 | Confident | 151 Ų | 151 | 111.1 Ų | 111.1 | 57% | 0.57 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -68.1 | -44.6 | 175.9 | -166.3 | -173.7 | 73.6 | -161.6 | 2.5 | 111.5 | R117 K118 A119 N124 D125 | R117-R121 PolarHBondContact O-N 2.96Å; R117-R121 VanDerWaalsContact O-N 3.07Å; K118-R121 WeakPolarHBondContact O-CA 3.33Å; K118-R121 WeakPolarHBondContact O-CB 2.87Å; K118-R121 PolarHBondContact O-N 3.5Å; A119-R121 VanDerWaalsContact C-N 3.28Å; A119-R121 PolarHBondContact O-N 3.47Å; R121-N124 CarbonylContact O-C 3.57Å; R121-N124 WeakPolarHBondContact O-CB 3.39Å; R121-N124 PolarHBondContact O-N 2.86Å; R121-D125 VanDerWaalsContact O-CG 3.25Å; R121-D125 PolarHBondContact O-N 3.03Å |
| 122 | D | 82.3 | Confident | 74.5 | Confident | 56 Ų | 56 | 113.3 Ų | 113.3 | 30% | 0.299 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -70.1 | -34.5 | -178.2 | -61.2 | -14.6 | 0 | 0 | 0 | 111.6 | K118 A119 D125 N126 | K118-D122 VanDerWaalsContact O-CG 3.28Å; K118-D122 PolarHBondContact O-N 2.74Å; A119-D122 PolarHBondContact O-N 2.91Å; D122-D125 PolarHBondContact O-N 3.09Å; D122-N126 PolarHBondContact O-N 3.11Å; D122-N126 VanDerWaalsContact O-N 3.08Å; D122-N126 PolarHBondContact O-ND2 3.05Å |
| 123 | D | 77.9 | Confident | 72.3 | Confident | 98 Ų | 98 | 113.1 Ų | 113.1 | 52% | 0.524 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.4 | -41.2 | 170.9 | -71.7 | -21.8 | 0 | 0 | 0 | 110.9 | A119 N126 I127 | A119-D123 WeakPolarHBondContact O-CB 3.41Å; A119-D123 PolarHBondContact O-N 3.39Å; D123-N126 PolarHBondContact O-N 3.25Å; D123-I127 PolarHBondContact O-N 3.04Å; D123-I127 VanDerWaalsContact O-N 3.15Å |
| 124 | N | 62.9 | Low | 70.1 | Confident | 89 Ų | 89 | 116.7 Ų | 116.7 | 48% | 0.476 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -60.8 | -49.4 | 170.8 | -81.7 | -65.4 | 0 | 0 | 0 | 109.3 | L120 R121 N126 I127 T128 | L120-N124 WeakPolarHBondContact O-CB 3.44Å; L120-N124 PolarHBondContact O-N 3.3Å; L120-N124 PolarHBondContact O-ND2 3.25Å; R121-N124 CarbonylContact O-C 3.57Å; R121-N124 WeakPolarHBondContact O-CB 3.39Å; R121-N124 PolarHBondContact O-N 2.86Å; N124-N126 VanDerWaalsContact C-N 3.26Å; N124-N126 PolarHBondContact O-N 3.04Å; N124-I127 CarbonylContact O-C 3.21Å; N124-I127 PolarHBondContact O-N 3.48Å; N124-T128 WeakPolarHBondContact O-CA 3.47Å; N124-T128 WeakPolarHBondContact O-CB 3.49Å; N124-T128 PolarHBondContact O-N 3.13Å; N124-T128 PolarHBondContact O-OG1 3.45Å |
| 125 | D | 60.1 | Low | 67.9 | Low | 76 Ų | 76 | 116.6 Ų | 116.6 | 41% | 0.406 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -59.3 | -31 | -178.1 | -69.2 | -27 | 0 | 0 | 0 | 113.3 | R121 D122 Q129 | R121-D125 VanDerWaalsContact O-CG 3.25Å; R121-D125 PolarHBondContact O-N 3.03Å; D122-D125 PolarHBondContact O-N 3.09Å; D125-Q129 WeakPolarHBondContact O-CG 3.42Å; D125-Q129 PolarHBondContact O-N 3.17Å |
| 126 | N | 55.3 | Low | 65.9 | Low | 137 Ų | 137 | 121.1 Ų | 121.1 | 73% | 0.733 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -78.7 | -28.4 | 173.3 | -77.8 | -80.3 | 0 | 0 | 0 | 114.1 | D122 D123 N124 | D122-N126 PolarHBondContact O-N 3.11Å; D122-N126 VanDerWaalsContact O-N 3.08Å; D122-N126 PolarHBondContact O-ND2 3.05Å; D123-N126 PolarHBondContact O-N 3.25Å; N124-N126 VanDerWaalsContact C-N 3.26Å; N124-N126 PolarHBondContact O-N 3.04Å |
| 127 | I | 54.5 | Low | 63.8 | Low | 135 Ų | 135 | 124.3 Ų | 124.3 | 69% | 0.692 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -82.4 | -22 | 171.4 | -68.3 | 167.7 | 0 | 0 | 0 | 111.3 | D123 N124 | D123-I127 PolarHBondContact O-N 3.04Å; D123-I127 VanDerWaalsContact O-N 3.15Å; N124-I127 CarbonylContact O-C 3.21Å; N124-I127 PolarHBondContact O-N 3.48Å |
| 128 | T | 49.5 | Very low | 61.7 | Low | 27 Ų | 27 | 121.5 Ų | 121.5 | 17% | 0.166 | 60% | 0.598 | C | S | . | * | H | α-helix | trans | -101.7 | -8.8 | -165.3 | -71.5 | 0 | 0 | 0 | 0 | 114.7 | N124 K130 Q131 Y132 | N124-T128 WeakPolarHBondContact O-CA 3.47Å; N124-T128 WeakPolarHBondContact O-CB 3.49Å; N124-T128 PolarHBondContact O-N 3.13Å; N124-T128 PolarHBondContact O-OG1 3.45Å; T128-K130 CarbonylContact O-C 3.55Å; T128-K130 PolarHBondContact O-N 3Å; T128-K130 VanDerWaalsContact O-N 3.09Å; T128-Q131 PolarHBondContact O-N 3.35Å; T128-Y132 HydrophobicContact CG2-CG 4.35Å; T128-Y132 PolarHBondContact O-N 3.47Å |
| 129 | Q | 51.5 | Low | 59.4 | Low | 186 Ų | 186 | 122.3 Ų | 122.3 | 87% | 0.869 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -11.7 | 165.7 | -65.5 | -117 | 55.7 | 0 | 0 | 112 | D125 | D125-Q129 WeakPolarHBondContact O-CG 3.42Å; D125-Q129 PolarHBondContact O-N 3.17Å |
| 130 | K | 49.7 | Very low | 57.4 | Low | 181 Ų | 181 | 129.8 Ų | 129.8 | 79% | 0.787 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | 102.4 | 148.9 | -77.4 | 177.6 | 177.4 | 177.4 | 0 | 108.9 | T128 | T128-K130 CarbonylContact O-C 3.55Å; T128-K130 PolarHBondContact O-N 3Å; T128-K130 VanDerWaalsContact O-N 3.09Å |
| 131 | Q | 41.2 | Very low | 55.4 | Low | 178 Ų | 178 | 134.9 Ų | 134.9 | 83% | 0.832 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 76.5 | 58.2 | 159.6 | -46.6 | -70.9 | -34.5 | 0 | 0 | 118.3 | T128 | T128-Q131 PolarHBondContact O-N 3.35Š|
| 132 | Y | 43 | Very low | 53.3 | Low | 187 Ų | 187 | 131 Ų | 131 | 73% | 0.733 | 64% | 0.641 | S | S | * | * | trans | -145.1 | 85.9 | 147.6 | -140.2 | -98.7 | 0 | 0 | 0 | 109.9 | T128 | T128-Y132 HydrophobicContact CG2-CG 4.35Å; T128-Y132 PolarHBondContact O-N 3.47Å | ||
| 133 | K | 51.9 | Low | 51.4 | Low | 181 Ų | 181 | 136 Ų | 136 | 79% | 0.787 | 67% | 0.667 | S | S | * | * | trans | -79.1 | 130.9 | 156.9 | -64.1 | -173.4 | 179.4 | -171 | 0 | 105.9 | I135 | K133-I135 PolarHBondContact O-N 2.94Š| ||
| 134 | P | 49.3 | Very low | 49.8 | Very low | 95 Ų | 95 | 137.1 Ų | 137.1 | 62% | 0.617 | 67% | 0.674 | S | S | * | * | trans | -55.3 | 118.4 | 167.9 | 24.1 | -30.5 | 0 | 0 | 0 | 105.9 | K136 | P134-K136 PolarHBondContact O-N 3.33Š| ||
| 135 | I | 51.9 | Low | 48.9 | Very low | 121 Ų | 121 | 142.2 Ų | 142.2 | 62% | 0.621 | 69% | 0.692 | S | S | * | * | trans | -70.2 | 81.1 | -176.1 | -54.4 | 175.1 | 0 | 0 | 0 | 107.8 | K133 V138 | K133-I135 PolarHBondContact O-N 2.94Å; I135-V138 HydrophobicContact CB-CG2 4.46Å; I135-V138 HydrophobicContact CD1-CG1 4.19Å; I135-V138 HydrophobicContact CG2-CB 3.51Å; I135-V138 HydrophobicContact CG2-CG1 3.35Å; I135-V138 HydrophobicContact CG2-CG2 3.28Å; I135-V138 VanDerWaalsContact CG2-N 3.34Å | ||
| 136 | K | 54 | Low | 48.3 | Very low | 171 Ų | 171 | 145.5 Ų | 145.5 | 74% | 0.743 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -85.9 | 103.8 | 157.9 | -61.9 | -178.8 | -178.9 | -178.6 | 0 | 103.3 | P134 | P134-K136 PolarHBondContact O-N 3.33Š|
| 137 | N | 49.6 | Very low | 47.9 | Very low | 153 Ų | 153 | 146 Ų | 146 | 82% | 0.818 | 71% | 0.711 | S | S | * | * | trans | 82.4 | 77.2 | -177.8 | -40.1 | -23 | 0 | 0 | 0 | 114.3 | ||||
| 138 | V | 49.6 | Very low | 47.2 | Very low | 99 Ų | 99 | 149 Ų | 149 | 60% | 0.6 | 72% | 0.718 | S | S | * | * | trans | -87.3 | 120.1 | 152.3 | -108.2 | 0 | 0 | 0 | 0 | 107.3 | I135 Y140 | I135-V138 HydrophobicContact CB-CG2 4.46Å; I135-V138 HydrophobicContact CD1-CG1 4.19Å; I135-V138 HydrophobicContact CG2-CB 3.51Å; I135-V138 HydrophobicContact CG2-CG1 3.35Å; I135-V138 HydrophobicContact CG2-CG2 3.28Å; I135-V138 VanDerWaalsContact CG2-N 3.34Å; V138-Y140 PolarHBondContact O-N 2.88Å; V138-Y140 VanDerWaalsContact O-N 3.16Å | ||
| 139 | P | 45.1 | Very low | 46.7 | Very low | 103 Ų | 103 | 153.1 Ų | 153.1 | 67% | 0.669 | 74% | 0.744 | S | S | * | * | trans | -61.4 | 115.3 | 156.3 | -9.9 | 25.7 | 0 | 0 | 0 | 106.4 | Y141 | P139-Y141 PolarHBondContact O-N 3.37Å; P139-Y141 VanDerWaalsContact O-N 3.08Å | ||
| 140 | Y | 47.5 | Very low | 46.1 | Very low | 204 Ų | 204 | 150.6 Ų | 150.6 | 80% | 0.8 | 74% | 0.736 | S | S | * | * | trans | -67.1 | 106.3 | 176.7 | -168.5 | -92.6 | 0 | 0 | 0 | 108.2 | V138 S142 | V138-Y140 PolarHBondContact O-N 2.88Å; V138-Y140 VanDerWaalsContact O-N 3.16Å; Y140-S142 PolarHBondContact O-N 3.28Å; Y140-S142 VanDerWaalsContact O-N 3.14Å | ||
| 141 | Y | 48.9 | Very low | 45.9 | Very low | 205 Ų | 205 | 149.5 Ų | 149.5 | 80% | 0.804 | 74% | 0.739 | S | S | * | * | trans | -72.9 | 102.7 | 166.8 | -82.2 | -82.7 | 0 | 0 | 0 | 108.3 | P139 N143 | P139-Y141 PolarHBondContact O-N 3.37Å; P139-Y141 VanDerWaalsContact O-N 3.08Å; Y141-N143 PolarHBondContact O-N 2.91Å; Y141-N143 VanDerWaalsContact O-N 3.11Å | ||
| 142 | S | 44.1 | Very low | 45.9 | Very low | 70 Ų | 70 | 147.1 Ų | 147.1 | 49% | 0.49 | 73% | 0.732 | S | S | . | * | trans | -66.2 | 102.5 | 170.7 | -138.4 | 0 | 0 | 0 | 0 | 108.7 | Y140 D144 | Y140-S142 PolarHBondContact O-N 3.28Å; Y140-S142 VanDerWaalsContact O-N 3.14Å; S142-D144 WeakPolarHBondContact CB-OD2 3Å; S142-D144 PolarHBondContact O-N 3.41Å; S142-D144 VanDerWaalsContact O-N 3.1Å; S142-D144 PolarHBondContact OG-OD2 3.24Å | ||
| 143 | N | 41.8 | Very low | 46.3 | Very low | 159 Ų | 159 | 146.1 Ų | 146.1 | 85% | 0.85 | 73% | 0.734 | S | S | * | * | trans | -82 | 71 | 164.1 | -74.5 | -41.2 | 0 | 0 | 0 | 108.3 | Y141 K145 | Y141-N143 PolarHBondContact O-N 2.91Å; Y141-N143 VanDerWaalsContact O-N 3.11Å; N143-K145 PolarHBondContact O-N 2.81Å; N143-K145 VanDerWaalsContact O-N 3.12Å | ||
| 144 | D | 44.6 | Very low | 46 | Very low | 123 Ų | 123 | 145 Ų | 145 | 66% | 0.658 | 74% | 0.736 | S | S | * | * | trans | -78.9 | 88.3 | 171.2 | -77.4 | -47.8 | 0 | 0 | 0 | 109.7 | S142 | S142-D144 WeakPolarHBondContact CB-OD2 3Å; S142-D144 PolarHBondContact O-N 3.41Å; S142-D144 VanDerWaalsContact O-N 3.1Å; S142-D144 PolarHBondContact OG-OD2 3.24Å | ||
| 145 | K | 44.4 | Very low | 46.3 | Very low | 196 Ų | 196 | 147.5 Ų | 147.5 | 85% | 0.852 | 74% | 0.743 | S | S | * | * | trans | -113.5 | 70.6 | 151.6 | -79.4 | -174.5 | -178.8 | 178.2 | 0 | 108.2 | N143 | N143-K145 PolarHBondContact O-N 2.81Å; N143-K145 VanDerWaalsContact O-N 3.12Å | ||
| 146 | I | 46.8 | Very low | 46.4 | Very low | 145 Ų | 145 | 147.9 Ų | 147.9 | 74% | 0.744 | 75% | 0.746 | S | S | * | * | trans | -126.1 | 89.4 | 165.5 | -52.4 | 178.6 | 0 | 0 | 0 | 107.5 | K148 | I146-K148 PolarHBondContact O-N 3.17Š| ||
| 147 | N | 46.4 | Very low | 46.3 | Very low | 148 Ų | 148 | 146.9 Ų | 146.9 | 79% | 0.791 | 75% | 0.749 | S | S | * | * | trans | 11.7 | 92 | 146.3 | -56.8 | -32.6 | 0 | 0 | 0 | 116 | T149 | N147-T149 PolarHBondContact O-N 2.98Š| ||
| 148 | K | 40.6 | Very low | 46.3 | Very low | 197 Ų | 197 | 145.3 Ų | 145.3 | 86% | 0.857 | 74% | 0.74 | S | S | * | * | 10 | 106.2 | 130 | -164.9 | 173.9 | -168.8 | 172 | 0 | 115.2 | I146 | I146-K148 PolarHBondContact O-N 3.17Š| |||
| 149 | T | 38 | Very low | 46.5 | Very low | 114 Ų | 114 | 146.6 Ų | 146.6 | 70% | 0.699 | 74% | 0.744 | S | S | * | * | trans | -171.4 | 119.1 | 130.8 | 37.1 | 0 | 0 | 0 | 0 | 112 | N147 | N147-T149 PolarHBondContact O-N 2.98Š| ||
| 150 | N | 39 | Very low | 47.1 | Very low | 133 Ų | 133 | 148.4 Ų | 148.4 | 71% | 0.711 | 75% | 0.748 | S | S | * | * | trans | 61.9 | 96.8 | 139.8 | -45.3 | -21.7 | 0 | 0 | 0 | 118.8 | ||||
| 151 | N | 46.8 | Very low | 47.8 | Very low | 157 Ų | 157 | 146 Ų | 146 | 84% | 0.84 | 75% | 0.749 | S | S | * | * | 164.3 | 107.2 | 113.3 | -87.1 | -43.4 | 0 | 0 | 0 | 110.3 | |||||
| 152 | D | 40.9 | Very low | 48.9 | Very low | 129 Ų | 129 | 140.4 Ų | 140.4 | 69% | 0.69 | 73% | 0.733 | S | S | * | * | trans | 24.4 | 103.4 | 130.7 | -158.4 | -10.5 | 0 | 0 | 0 | 117.5 | ||||
| 153 | H | 51.2 | Low | 50.4 | Low | 165 Ų | 165 | 142.1 Ų | 142.1 | 76% | 0.764 | 74% | 0.736 | S | S | * | * | -168.2 | 129.8 | 122.2 | -103 | -0.2 | 0 | 0 | 0 | 112 | I155 | H153-I155 PolarHBondContact O-N 2.95Š| |||
| 154 | N | 45.2 | Very low | 52.3 | Low | 157 Ų | 157 | 139.2 Ų | 139.2 | 84% | 0.84 | 72% | 0.72 | S | S | * | * | trans | -38.4 | 117.5 | 175.7 | -71.8 | -65.9 | 0 | 0 | 0 | 113.6 | ||||
| 155 | I | 56.6 | Low | 54.3 | Low | 148 Ų | 148 | 134.4 Ų | 134.4 | 76% | 0.759 | 70% | 0.7 | S | S | * | * | trans | -119.4 | 105 | 161.5 | -63 | 177.2 | 0 | 0 | 0 | 106.8 | H153 N157 | H153-I155 PolarHBondContact O-N 2.95Å; I155-N157 PolarHBondContact O-N 2.88Å | ||
| 156 | D | 53.7 | Low | 56.2 | Low | 129 Ų | 129 | 131.2 Ų | 131.2 | 69% | 0.69 | 69% | 0.686 | S | S | * | * | trans | -52.1 | 120 | 170.6 | -174.5 | -1 | 0 | 0 | 0 | 110 | N158 | D156-N158 VanDerWaalsContact C-N 3.34Å; D156-N158 PolarHBondContact O-N 3.3Å; D156-N158 VanDerWaalsContact O-N 3.14Å; D156-N158 PolarHBondContact OD1-ND2 3.4Å | ||
| 157 | N | 51.1 | Low | 58.2 | Low | 150 Ų | 150 | 128.1 Ų | 128.1 | 80% | 0.802 | 67% | 0.674 | S | S | * | * | trans | -83.5 | 71.8 | -178.4 | -77.2 | -60.6 | 0 | 0 | 0 | 110 | I155 | I155-N157 PolarHBondContact O-N 2.88Š| ||
| 158 | N | 49.9 | Very low | 60.1 | Low | 120 Ų | 120 | 126.3 Ų | 126.3 | 64% | 0.642 | 66% | 0.659 | S | S | * | * | trans | -141.8 | 129.4 | 171.7 | -74.1 | -62.4 | 0 | 0 | 0 | 111 | D156 | D156-N158 VanDerWaalsContact C-N 3.34Å; D156-N158 PolarHBondContact O-N 3.3Å; D156-N158 VanDerWaalsContact O-N 3.14Å; D156-N158 PolarHBondContact OD1-ND2 3.4Å | ||
| 159 | N | 53.8 | Low | 62.5 | Low | 127 Ų | 127 | 119.2 Ų | 119.2 | 68% | 0.679 | 64% | 0.637 | S | S | * | * | trans | 102.6 | 91.2 | 170.8 | -51.5 | -44.1 | 0 | 0 | 0 | 116.9 | D161 | N159-D161 PolarHBondContact O-N 2.89Š| ||
| 160 | D | 58.6 | Low | 65.1 | Low | 141 Ų | 141 | 117.2 Ų | 117.2 | 75% | 0.754 | 62% | 0.624 | S | S | * | * | G | 310 helix | trans | -70.5 | -0.9 | 166.5 | -104.8 | -32.5 | 0 | 0 | 0 | 113.9 | ||
| 161 | D | 62 | Low | 67.7 | Low | 154 Ų | 154 | 114.5 Ų | 114.5 | 82% | 0.824 | 61% | 0.613 | S | S | * | * | G | 310 helix | trans | -90.4 | -7.3 | -170.4 | -70.2 | -33.2 | 0 | 0 | 0 | 115.8 | N159 | N159-D161 PolarHBondContact O-N 2.89Š|
| 162 | D | 70.6 | Confident | 70.1 | Confident | 87 Ų | 87 | 114.6 Ų | 114.6 | 47% | 0.465 | 61% | 0.606 | S | S | . | * | G | 310 helix | trans | -115.9 | 35 | -177.1 | -167.4 | 45.5 | 0 | 0 | 0 | 114.1 | D164 G165 K166 | D162-D164 VanDerWaalsContact C-N 3.3Å; D162-D164 PolarHBondContact O-N 3.47Å; D162-G165 PolarHBondContact O-N 3.41Å; D162-G165 VanDerWaalsContact OD1-CA 3.24Å; D162-G165 WeakPolarHBondContact OD1-CA 2.68Å; D162-G165 PolarHBondContact OD1-N 2.9Å; D162-K166 WeakPolarHBondContact O-CG 3.39Å; D162-K166 PolarHBondContact O-N 3.4Å; D162-K166 VanDerWaalsContact O-N 3.1Å |
| 163 | I | 76.8 | Confident | 72.6 | Confident | 106 Ų | 106 | 114.3 Ų | 114.3 | 54% | 0.544 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -62.3 | -41.3 | 174.7 | -66.6 | 172.9 | 0 | 0 | 0 | 110.5 | K166 V167 | I163-K166 PolarHBondContact O-N 2.93Å; I163-V167 HydrophobicContact CG2-CG2 4.33Å; I163-V167 WeakPolarHBondContact O-CB 3.35Å; I163-V167 VanDerWaalsContact O-CG2 3.28Å; I163-V167 WeakPolarHBondContact O-CG2 3.36Å; I163-V167 PolarHBondContact O-N 2.87Å |
| 164 | D | 81.8 | Confident | 74.7 | Confident | 97 Ų | 97 | 111.7 Ų | 111.7 | 52% | 0.519 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -65.8 | -40 | 179.4 | -179.4 | 57.6 | 0 | 0 | 0 | 112.1 | D162 V167 K168 | D162-D164 VanDerWaalsContact C-N 3.3Å; D162-D164 PolarHBondContact O-N 3.47Å; D164-V167 PolarHBondContact O-N 3.04Å; D164-K168 WeakPolarHBondContact O-CB 3.18Å; D164-K168 WeakPolarHBondContact O-CD 3.49Å; D164-K168 WeakPolarHBondContact O-CG 3.37Å; D164-K168 PolarHBondContact O-N 3.49Å; D164-K168 WeakPolarHBondContact OD1-CE 3.02Å; D164-K168 IonicContact OD1-NZ 2.6Å; D164-K168 WeakPolarHBondContact OD2-CE 3.35Å; D164-K168 IonicContact OD2-NZ 3.71Å; D164-K168 PolarHBondContact OD2-NZ 3.05Å |
| 165 | G | 85.9 | Confident | 77.1 | Confident | 23 Ų | 23 | 107.1 Ų | 107.1 | 24% | 0.237 | 58% | 0.575 | C | S | . | * | H | α-helix | trans | -63.4 | -45.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | D162 K168 A169 | D162-G165 PolarHBondContact O-N 3.41Å; D162-G165 VanDerWaalsContact OD1-CA 3.24Å; D162-G165 WeakPolarHBondContact OD1-CA 2.68Å; D162-G165 PolarHBondContact OD1-N 2.9Å; G165-K168 PolarHBondContact O-N 2.89Å; G165-A169 WeakPolarHBondContact O-CB 3.13Å; G165-A169 PolarHBondContact O-N 3.46Å |
| 166 | K | 85.4 | Confident | 79 | Confident | 128 Ų | 128 | 101.8 Ų | 101.8 | 56% | 0.557 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -61.8 | -45.9 | 175.5 | -70.7 | 173.2 | -175.8 | 171.9 | 0 | 112.1 | D162 I163 K168 A169 V170 | D162-K166 WeakPolarHBondContact O-CG 3.39Å; D162-K166 PolarHBondContact O-N 3.4Å; D162-K166 VanDerWaalsContact O-N 3.1Å; I163-K166 PolarHBondContact O-N 2.93Å; K166-K168 PolarHBondContact O-N 2.88Å; K166-A169 PolarHBondContact O-N 2.93Å; K166-V170 WeakPolarHBondContact O-CG2 3.34Å; K166-V170 PolarHBondContact O-N 3.48Å |
| 167 | V | 87 | Confident | 81.1 | Confident | 80 Ų | 80 | 102.7 Ų | 102.7 | 49% | 0.485 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.9 | -42.2 | 177.6 | 170.9 | 0 | 0 | 0 | 0 | 111.3 | I163 D164 V170 T171 | I163-V167 HydrophobicContact CG2-CG2 4.33Å; I163-V167 WeakPolarHBondContact O-CB 3.35Å; I163-V167 VanDerWaalsContact O-CG2 3.28Å; I163-V167 WeakPolarHBondContact O-CG2 3.36Å; I163-V167 PolarHBondContact O-N 2.87Å; D164-V167 PolarHBondContact O-N 3.04Å; V167-V170 PolarHBondContact O-N 3.47Å; V167-T171 WeakPolarHBondContact O-CB 3.33Å; V167-T171 PolarHBondContact O-N 2.88Å; V167-T171 PolarHBondContact O-OG1 3.01Å |
| 168 | K | 87.5 | Confident | 83.2 | Confident | 110 Ų | 110 | 104.6 Ų | 104.6 | 48% | 0.478 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.7 | -43 | 174 | -76.1 | 169.4 | 176.6 | 170.1 | 0 | 111.6 | D164 G165 K166 T171 K172 | D164-K168 WeakPolarHBondContact O-CB 3.18Å; D164-K168 WeakPolarHBondContact O-CD 3.49Å; D164-K168 WeakPolarHBondContact O-CG 3.37Å; D164-K168 PolarHBondContact O-N 3.49Å; D164-K168 WeakPolarHBondContact OD1-CE 3.02Å; D164-K168 IonicContact OD1-NZ 2.6Å; D164-K168 WeakPolarHBondContact OD2-CE 3.35Å; D164-K168 IonicContact OD2-NZ 3.71Å; D164-K168 PolarHBondContact OD2-NZ 3.05Å; G165-K168 PolarHBondContact O-N 2.89Å; K166-K168 PolarHBondContact O-N 2.88Å; K168-T171 PolarHBondContact O-N 3.44Å; K168-K172 VanDerWaalsContact O-CG 3.3Å; K168-K172 WeakPolarHBondContact O-CG 3.48Å; K168-K172 PolarHBondContact O-N 3.43Å |
| 169 | A | 91.4 | Very high | 85.4 | Confident | 48 Ų | 48 | 99.7 Ų | 99.7 | 40% | 0.397 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.9 | -47.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | G165 K166 T171 K172 I173 | G165-A169 WeakPolarHBondContact O-CB 3.13Å; G165-A169 PolarHBondContact O-N 3.46Å; K166-A169 PolarHBondContact O-N 2.93Å; A169-T171 PolarHBondContact O-N 3.18Å; A169-K172 WeakPolarHBondContact O-CB 3.19Å; A169-K172 PolarHBondContact O-N 3.24Å; A169-I173 WeakPolarHBondContact O-CG1 3.39Å; A169-I173 PolarHBondContact O-N 3.22Å |
| 170 | V | 92.1 | Very high | 87.5 | Confident | 72 Ų | 72 | 99.5 Ų | 99.5 | 44% | 0.436 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.7 | -45.7 | 176.4 | 171.7 | 0 | 0 | 0 | 0 | 111 | K166 V167 K172 I173 Q174 | K166-V170 WeakPolarHBondContact O-CG2 3.34Å; K166-V170 PolarHBondContact O-N 3.48Å; V167-V170 PolarHBondContact O-N 3.47Å; V170-K172 VanDerWaalsContact C-N 3.31Å; V170-K172 PolarHBondContact O-N 3.18Å; V170-I173 PolarHBondContact O-N 3.38Å; V170-Q174 HydrophobicContact CG1-CG 4.26Å; V170-Q174 WeakPolarHBondContact O-CB 3.32Å; V170-Q174 VanDerWaalsContact O-CG 3.3Å; V170-Q174 WeakPolarHBondContact O-CG 3.46Å; V170-Q174 PolarHBondContact O-N 2.86Å |
| 171 | T | 94.1 | Very high | 89.2 | Confident | 76 Ų | 76 | 99.1 Ų | 99.1 | 47% | 0.466 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.9 | -42 | 177.9 | -58.5 | 0 | 0 | 0 | 0 | 111.4 | V167 K168 A169 Q174 A175 | V167-T171 WeakPolarHBondContact O-CB 3.33Å; V167-T171 PolarHBondContact O-N 2.88Å; V167-T171 PolarHBondContact O-OG1 3.01Å; K168-T171 PolarHBondContact O-N 3.44Å; A169-T171 PolarHBondContact O-N 3.18Å; T171-Q174 PolarHBondContact O-N 3.36Å; T171-A175 VanDerWaalsContact O-CB 3.28Å; T171-A175 WeakPolarHBondContact O-CB 3.45Å; T171-A175 PolarHBondContact O-N 2.85Å |
| 172 | K | 95.5 | Very high | 90.7 | Very high | 159 Ų | 159 | 95.5 Ų | 95.5 | 69% | 0.691 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.3 | -43.8 | 175.5 | -74.9 | 175.7 | -179.9 | -178.2 | 0 | 112 | K168 A169 V170 A175 G176 | K168-K172 VanDerWaalsContact O-CG 3.3Å; K168-K172 WeakPolarHBondContact O-CG 3.48Å; K168-K172 PolarHBondContact O-N 3.43Å; A169-K172 WeakPolarHBondContact O-CB 3.19Å; A169-K172 PolarHBondContact O-N 3.24Å; V170-K172 VanDerWaalsContact C-N 3.31Å; V170-K172 PolarHBondContact O-N 3.18Å; K172-A175 PolarHBondContact O-N 2.87Å; K172-G176 PolarHBondContact O-N 3.41Å |
| 173 | I | 94.6 | Very high | 91.8 | Very high | 123 Ų | 123 | 98.9 Ų | 98.9 | 63% | 0.631 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.4 | -47.5 | 177.3 | -68.5 | 167.6 | 0 | 0 | 0 | 110.4 | A169 V170 A175 G176 Y177 | A169-I173 WeakPolarHBondContact O-CG1 3.39Å; A169-I173 PolarHBondContact O-N 3.22Å; V170-I173 PolarHBondContact O-N 3.38Å; I173-A175 PolarHBondContact O-N 3.22Å; I173-G176 PolarHBondContact O-N 3.36Å; I173-Y177 WeakPolarHBondContact O-CB 3.22Å; I173-Y177 PolarHBondContact O-N 2.85Å |
| 174 | Q | 95.4 | Very high | 92.5 | Very high | 111 Ų | 111 | 100.2 Ų | 100.2 | 52% | 0.519 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.4 | -43.9 | 178.7 | -71.3 | 174.6 | -16.7 | 0 | 0 | 112 | V170 T171 Y177 R178 | V170-Q174 HydrophobicContact CG1-CG 4.26Å; V170-Q174 WeakPolarHBondContact O-CB 3.32Å; V170-Q174 VanDerWaalsContact O-CG 3.3Å; V170-Q174 WeakPolarHBondContact O-CG 3.46Å; V170-Q174 PolarHBondContact O-N 2.86Å; T171-Q174 PolarHBondContact O-N 3.36Å; Q174-Y177 PolarHBondContact O-N 3.46Å; Q174-R178 WeakPolarHBondContact O-CB 3.32Å; Q174-R178 VanDerWaalsContact O-CG 3.27Å; Q174-R178 WeakPolarHBondContact O-CG 3.43Å; Q174-R178 PolarHBondContact O-N 3.41Å |
| 175 | A | 95.3 | Very high | 93 | Very high | 60 Ų | 60 | 99.4 Ų | 99.4 | 50% | 0.496 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.7 | -43.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | T171 K172 I173 G179 | T171-A175 VanDerWaalsContact O-CB 3.28Å; T171-A175 WeakPolarHBondContact O-CB 3.45Å; T171-A175 PolarHBondContact O-N 2.85Å; K172-A175 PolarHBondContact O-N 2.87Å; I173-A175 PolarHBondContact O-N 3.22Å; A175-G179 PolarHBondContact O-N 2.83Å |
| 176 | G | 96.9 | Very high | 93.1 | Very high | 36 Ų | 36 | 102.5 Ų | 102.5 | 37% | 0.371 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -59.1 | -48.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | K172 I173 G179 Y180 | K172-G176 PolarHBondContact O-N 3.41Å; I173-G176 PolarHBondContact O-N 3.36Å; G176-G179 PolarHBondContact O-N 2.89Å; G176-Y180 WeakPolarHBondContact O-CB 3.23Å; G176-Y180 PolarHBondContact O-N 3.23Å |
| 177 | Y | 97.7 | Very high | 93 | Very high | 148 Ų | 148 | 98.3 Ų | 98.3 | 58% | 0.58 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64.6 | -47 | 178.5 | 178.7 | -102 | 0 | 0 | 0 | 112.4 | I173 Q174 G179 Y180 K181 | I173-Y177 WeakPolarHBondContact O-CB 3.22Å; I173-Y177 PolarHBondContact O-N 2.85Å; Q174-Y177 PolarHBondContact O-N 3.46Å; Y177-G179 VanDerWaalsContact C-N 3.31Å; Y177-G179 PolarHBondContact O-N 3.46Å; Y177-Y180 PolarHBondContact O-N 2.77Å; Y177-K181 WeakPolarHBondContact O-CB 3.25Å; Y177-K181 PolarHBondContact O-N 2.86Å |
| 178 | R | 95.3 | Very high | 92.8 | Very high | 190 Ų | 190 | 98 Ų | 98 | 72% | 0.717 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -55.2 | -48.3 | 174.2 | -77.7 | 171 | 143.5 | -159.4 | -5.5 | 110.9 | Q174 K181 T182 | Q174-R178 WeakPolarHBondContact O-CB 3.32Å; Q174-R178 VanDerWaalsContact O-CG 3.27Å; Q174-R178 WeakPolarHBondContact O-CG 3.43Å; Q174-R178 PolarHBondContact O-N 3.41Å; R178-K181 PolarHBondContact O-N 2.99Å; R178-T182 PolarHBondContact O-N 3.45Å; R178-T182 VanDerWaalsContact O-N 3.11Å; R178-T182 PolarHBondContact O-OG1 2.88Å |
| 179 | G | 96 | Very high | 92.4 | Very high | 17 Ų | 17 | 98.5 Ų | 98.5 | 18% | 0.175 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -63.9 | -42.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | A175 G176 Y177 T182 R183 | A175-G179 PolarHBondContact O-N 2.83Å; G176-G179 PolarHBondContact O-N 2.89Å; Y177-G179 VanDerWaalsContact C-N 3.31Å; Y177-G179 PolarHBondContact O-N 3.46Å; G179-T182 PolarHBondContact O-N 3.37Å; G179-R183 WeakPolarHBondContact O-CB 3.33Å; G179-R183 WeakPolarHBondContact O-CG 3.25Å; G179-R183 PolarHBondContact O-N 3.48Å; G179-R183 PolarHBondContact O-NH1 3.25Å |
| 180 | Y | 97.4 | Very high | 91.3 | Very high | 123 Ų | 123 | 100.9 Ų | 100.9 | 48% | 0.482 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.3 | -46.8 | 175.6 | 167.4 | -97.9 | 0 | 0 | 0 | 111.2 | G176 Y177 T182 R183 K184 | G176-Y180 WeakPolarHBondContact O-CB 3.23Å; G176-Y180 PolarHBondContact O-N 3.23Å; Y177-Y180 PolarHBondContact O-N 2.77Å; Y180-T182 VanDerWaalsContact C-N 3.35Å; Y180-T182 PolarHBondContact O-N 3.23Å; Y180-R183 PolarHBondContact O-N 3.01Å; Y180-K184 HydrophobicContact CE1-CD 4.02Å; Y180-K184 VanDerWaalsContact O-CB 3.3Å; Y180-K184 WeakPolarHBondContact O-CB 3.44Å; Y180-K184 PolarHBondContact O-N 2.9Å; Y180-K184 PolarHBondContact OH-NZ 3.34Å |
| 181 | K | 95.4 | Very high | 90.1 | Very high | 134 Ų | 134 | 102.4 Ų | 102.4 | 58% | 0.583 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -57.2 | -47.8 | 177.6 | -172.1 | -176.4 | 179.9 | -172.3 | 0 | 111.1 | Y177 R178 K184 S185 | Y177-K181 WeakPolarHBondContact O-CB 3.25Å; Y177-K181 PolarHBondContact O-N 2.86Å; R178-K181 PolarHBondContact O-N 2.99Å; K181-K184 PolarHBondContact O-N 2.92Å; K181-S185 PolarHBondContact O-N 3.48Å; K181-S185 VanDerWaalsContact O-N 3.08Å |
| 182 | T | 93.6 | Very high | 88.4 | Confident | 78 Ų | 78 | 105 Ų | 105 | 48% | 0.479 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.5 | -51.1 | 176.3 | -58.3 | 0 | 0 | 0 | 0 | 111.5 | R178 G179 Y180 K184 S185 L186 | R178-T182 PolarHBondContact O-N 3.45Å; R178-T182 VanDerWaalsContact O-N 3.11Å; R178-T182 PolarHBondContact O-OG1 2.88Å; G179-T182 PolarHBondContact O-N 3.37Å; Y180-T182 VanDerWaalsContact C-N 3.35Å; Y180-T182 PolarHBondContact O-N 3.23Å; T182-K184 VanDerWaalsContact C-N 3.33Å; T182-K184 PolarHBondContact O-N 3.46Å; T182-S185 PolarHBondContact O-N 2.87Å; T182-S185 VanDerWaalsContact O-N 3.14Å; T182-S185 PolarHBondContact O-OG 2.98Å; T182-L186 HydrophobicContact CG2-CD1 3.91Å; T182-L186 HydrophobicContact CG2-CG 4.47Å; T182-L186 WeakPolarHBondContact O-CG 3.37Å; T182-L186 PolarHBondContact O-N 2.9Å |
| 183 | R | 92.5 | Very high | 86.4 | Confident | 158 Ų | 158 | 102.3 Ų | 102.3 | 60% | 0.596 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.3 | -40.9 | 179.8 | -74.2 | -176.1 | -66.9 | -87.2 | 2.7 | 112.5 | G179 Y180 S185 L186 A187 | G179-R183 WeakPolarHBondContact O-CB 3.33Å; G179-R183 WeakPolarHBondContact O-CG 3.25Å; G179-R183 PolarHBondContact O-N 3.48Å; G179-R183 PolarHBondContact O-NH1 3.25Å; Y180-R183 PolarHBondContact O-N 3.01Å; R183-S185 VanDerWaalsContact C-N 3.34Å; R183-S185 PolarHBondContact O-N 2.74Å; R183-L186 PolarHBondContact O-N 2.82Å; R183-A187 PolarHBondContact O-N 3.38Å |
| 184 | K | 92.7 | Very high | 84.6 | Confident | 133 Ų | 133 | 102.1 Ų | 102.1 | 58% | 0.578 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.7 | -41.1 | 175.9 | -171.3 | 176 | -171 | 171.5 | 0 | 111.9 | Y180 K181 T182 L186 | Y180-K184 HydrophobicContact CE1-CD 4.02Å; Y180-K184 VanDerWaalsContact O-CB 3.3Å; Y180-K184 WeakPolarHBondContact O-CB 3.44Å; Y180-K184 PolarHBondContact O-N 2.9Å; Y180-K184 PolarHBondContact OH-NZ 3.34Å; K181-K184 PolarHBondContact O-N 2.92Å; T182-K184 VanDerWaalsContact C-N 3.33Å; T182-K184 PolarHBondContact O-N 3.46Å; K184-L186 VanDerWaalsContact C-N 3.32Å; K184-L186 PolarHBondContact O-N 3.41Å |
| 185 | S | 90.6 | Very high | 82.6 | Confident | 80 Ų | 80 | 103.1 Ų | 103.1 | 56% | 0.559 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -68.3 | -29 | 176.2 | 71.1 | 0 | 0 | 0 | 0 | 113.6 | K181 T182 R183 P188 | K181-S185 PolarHBondContact O-N 3.48Å; K181-S185 VanDerWaalsContact O-N 3.08Å; T182-S185 PolarHBondContact O-N 2.87Å; T182-S185 VanDerWaalsContact O-N 3.14Å; T182-S185 PolarHBondContact O-OG 2.98Å; R183-S185 VanDerWaalsContact C-N 3.34Å; R183-S185 PolarHBondContact O-N 2.74Å; S185-P188 WeakPolarHBondContact O-CD 3.3Å |
| 186 | L | 89.2 | Confident | 80.8 | Confident | 89 Ų | 89 | 104 Ų | 104 | 47% | 0.466 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -89.1 | -17.5 | -180 | -65.6 | 176.5 | 0 | 0 | 0 | 113.7 | T182 R183 K184 P188 L189 L190 | T182-L186 HydrophobicContact CG2-CD1 3.91Å; T182-L186 HydrophobicContact CG2-CG 4.47Å; T182-L186 WeakPolarHBondContact O-CG 3.37Å; T182-L186 PolarHBondContact O-N 2.9Å; R183-L186 PolarHBondContact O-N 2.82Å; K184-L186 VanDerWaalsContact C-N 3.32Å; K184-L186 PolarHBondContact O-N 3.41Å; L186-P188 VanDerWaalsContact C-CD 3.43Å; L186-L189 HydrophobicContact CD2-CD1 3.76Å; L186-L189 WeakPolarHBondContact O-CB 2.96Å; L186-L189 PolarHBondContact O-N 3.05Å; L186-L190 PolarHBondContact O-N 2.78Å; L186-L190 VanDerWaalsContact O-N 3.13Å |
| 187 | A | 82.9 | Confident | 78.9 | Confident | 40 Ų | 40 | 106.7 Ų | 106.7 | 33% | 0.331 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -53.8 | -41.1 | -179 | 0 | 0 | 0 | 0 | 0 | 114.3 | R183 L189 L190 N191 | R183-A187 PolarHBondContact O-N 3.38Å; A187-L189 VanDerWaalsContact C-N 3.32Å; A187-L189 PolarHBondContact O-N 3.35Å; A187-L190 PolarHBondContact O-N 2.99Å; A187-N191 PolarHBondContact O-N 3.32Å; A187-N191 PolarHBondContact O-ND2 3.48Å |
| 188 | P | 81.9 | Confident | 77 | Confident | 73 Ų | 73 | 106.2 Ų | 106.2 | 47% | 0.474 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64 | -35 | 176.6 | -21.4 | 33.6 | 0 | 0 | 0 | 113.5 | S185 L186 H192 | S185-P188 WeakPolarHBondContact O-CD 3.3Å; L186-P188 VanDerWaalsContact C-CD 3.43Å; P188-H192 WeakPolarHBondContact O-CB 3.46Å; P188-H192 PolarHBondContact O-N 3.49Å; P188-H192 PolarHBondContact O-ND1 3.12Å |
| 189 | L | 79.5 | Confident | 75.1 | Confident | 121 Ų | 121 | 101.8 Ų | 101.8 | 63% | 0.634 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -69.2 | -38.7 | 178.4 | -67 | 163.1 | 0 | 0 | 0 | 110.9 | L186 A187 H193 | L186-L189 HydrophobicContact CD2-CD1 3.76Å; L186-L189 WeakPolarHBondContact O-CB 2.96Å; L186-L189 PolarHBondContact O-N 3.05Å; A187-L189 VanDerWaalsContact C-N 3.32Å; A187-L189 PolarHBondContact O-N 3.35Å; L189-H193 WeakPolarHBondContact O-CB 3.48Å; L189-H193 PolarHBondContact O-N 3.03Å |
| 190 | L | 69.5 | Low | 73.1 | Confident | 98 Ų | 98 | 105.8 Ų | 105.8 | 51% | 0.513 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -71 | -41.4 | 177.3 | -171 | 63.2 | 0 | 0 | 0 | 112 | L186 A187 H193 H194 | L186-L190 PolarHBondContact O-N 2.78Å; L186-L190 VanDerWaalsContact O-N 3.13Å; A187-L190 PolarHBondContact O-N 2.99Å; L190-H193 WeakPolarHBondContact O-CB 3.29Å; L190-H193 PolarHBondContact O-N 2.89Å; L190-H193 VanDerWaalsContact O-N 3.09Å; L190-H194 PolarHBondContact O-N 3Å |
| 191 | N | 65.7 | Low | 71.4 | Confident | 104 Ų | 104 | 104 Ų | 104 | 56% | 0.556 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.6 | -39.6 | 177 | -72.6 | -21.2 | 0 | 0 | 0 | 112.2 | A187 H193 H194 H195 | A187-N191 PolarHBondContact O-N 3.32Å; A187-N191 PolarHBondContact O-ND2 3.48Å; N191-H193 VanDerWaalsContact C-N 3.27Å; N191-H193 PolarHBondContact O-N 3.39Å; N191-H194 PolarHBondContact O-N 3.5Å; N191-H195 PolarHBondContact O-N 3.1Å |
| 192 | H | 58 | Low | 69.6 | Low | 131 Ų | 131 | 99.8 Ų | 99.8 | 61% | 0.606 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.8 | -34.9 | 170.8 | -85.4 | 72.7 | 0 | 0 | 0 | 111.7 | P188 N196 | P188-H192 WeakPolarHBondContact O-CB 3.46Å; P188-H192 PolarHBondContact O-N 3.49Å; P188-H192 PolarHBondContact O-ND1 3.12Å; H192-N196 WeakPolarHBondContact O-CB 3.41Å; H192-N196 PolarHBondContact O-N 2.87Å; H192-N196 PolarHBondContact O-ND2 3.04Å |
| 193 | H | 54.6 | Low | 68.3 | Low | 101 Ų | 101 | 99.2 Ų | 99.2 | 47% | 0.468 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -68.5 | -41.9 | 177.2 | -162.8 | 69.3 | 0 | 0 | 0 | 112.2 | L189 L190 N191 N196 Q197 | L189-H193 WeakPolarHBondContact O-CB 3.48Å; L189-H193 PolarHBondContact O-N 3.03Å; L190-H193 WeakPolarHBondContact O-CB 3.29Å; L190-H193 PolarHBondContact O-N 2.89Å; L190-H193 VanDerWaalsContact O-N 3.09Å; N191-H193 VanDerWaalsContact C-N 3.27Å; N191-H193 PolarHBondContact O-N 3.39Å; H193-N196 PolarHBondContact O-N 3.42Å; H193-Q197 PolarHBondContact NE2-NE2 3.42Å; H193-Q197 WeakPolarHBondContact O-CB 3.36Å; H193-Q197 WeakPolarHBondContact O-CG 3.45Å; H193-Q197 PolarHBondContact O-N 3.16Å |
| 194 | H | 55.7 | Low | 67.2 | Low | 119 Ų | 119 | 99.6 Ų | 99.6 | 55% | 0.551 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -65.3 | -40.4 | 174.8 | -78.4 | 158.2 | 0 | 0 | 0 | 113 | L190 N191 Q197 H198 | L190-H194 PolarHBondContact O-N 3Å; N191-H194 PolarHBondContact O-N 3.5Å; H194-Q197 PolarHBondContact O-N 2.94Å; H194-H198 PolarHBondContact O-N 3.09Å |
| 195 | H | 54.7 | Low | 65.9 | Low | 133 Ų | 133 | 99.4 Ų | 99.4 | 62% | 0.616 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.5 | -41.1 | 175.6 | -170.2 | 63.1 | 0 | 0 | 0 | 111.8 | N191 H199 | N191-H195 PolarHBondContact O-N 3.1Å; H195-H199 WeakPolarHBondContact O-CB 3.26Å; H195-H199 PolarHBondContact O-N 3.32Å |
| 196 | N | 56.3 | Low | 65 | Low | 79 Ų | 79 | 99.9 Ų | 99.9 | 42% | 0.422 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -65.8 | -46.2 | 174.4 | -80.2 | -62.7 | 0 | 0 | 0 | 111.8 | H192 H193 H198 H199 L200 | H192-N196 WeakPolarHBondContact O-CB 3.41Å; H192-N196 PolarHBondContact O-N 2.87Å; H192-N196 PolarHBondContact O-ND2 3.04Å; H193-N196 PolarHBondContact O-N 3.42Å; N196-H198 VanDerWaalsContact C-N 3.32Å; N196-H198 PolarHBondContact O-N 3.13Å; N196-H199 CarbonylContact O-C 3.49Å; N196-H199 PolarHBondContact O-N 3.05Å; N196-H199 VanDerWaalsContact O-N 3.12Å; N196-L200 VanDerWaalsContact C-CD2 3.48Å; N196-L200 HydrophobicContact CB-CD2 4.08Å; N196-L200 WeakPolarHBondContact O-CB 3.45Å; N196-L200 WeakPolarHBondContact O-CD2 3.26Å; N196-L200 PolarHBondContact O-N 3.03Å |
| 197 | Q | 57.2 | Low | 64.1 | Low | 91 Ų | 91 | 101.9 Ų | 101.9 | 43% | 0.425 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -55.4 | -46.1 | 177.5 | -73 | -93.7 | -5.2 | 0 | 0 | 111.5 | H193 H194 H199 L200 I201 | H193-Q197 PolarHBondContact NE2-NE2 3.42Å; H193-Q197 WeakPolarHBondContact O-CB 3.36Å; H193-Q197 WeakPolarHBondContact O-CG 3.45Å; H193-Q197 PolarHBondContact O-N 3.16Å; H194-Q197 PolarHBondContact O-N 2.94Å; Q197-H199 PolarHBondContact O-N 3.06Å; Q197-L200 PolarHBondContact O-N 3.03Å; Q197-I201 VanDerWaalsContact O-CG1 3.27Å; Q197-I201 WeakPolarHBondContact O-CG1 3.32Å; Q197-I201 PolarHBondContact O-N 3.05Å |
| 198 | H | 57.6 | Low | 63.7 | Low | 139 Ų | 139 | 105.3 Ų | 105.3 | 64% | 0.644 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.2 | -37.7 | 177.6 | -139.8 | -83.1 | 0 | 0 | 0 | 112.3 | H194 N196 I201 S202 | H194-H198 PolarHBondContact O-N 3.09Å; N196-H198 VanDerWaalsContact C-N 3.32Å; N196-H198 PolarHBondContact O-N 3.13Å; H198-I201 PolarHBondContact O-N 2.99Å; H198-S202 VanDerWaalsContact O-CB 3.29Å; H198-S202 WeakPolarHBondContact O-CB 3.27Å; H198-S202 PolarHBondContact O-N 2.84Å |
| 199 | H | 55.9 | Low | 63.3 | Low | 96 Ų | 96 | 107.4 Ų | 107.4 | 44% | 0.444 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.4 | -35.8 | 174 | -162.5 | -28.1 | 0 | 0 | 0 | 111.9 | H195 N196 Q197 N203 | H195-H199 WeakPolarHBondContact O-CB 3.26Å; H195-H199 PolarHBondContact O-N 3.32Å; N196-H199 CarbonylContact O-C 3.49Å; N196-H199 PolarHBondContact O-N 3.05Å; N196-H199 VanDerWaalsContact O-N 3.12Å; Q197-H199 PolarHBondContact O-N 3.06Å; H199-N203 PolarHBondContact CE1-ND2 3.2Å; H199-N203 PolarHBondContact CE1-OD1 3.42Å; H199-N203 VanDerWaalsContact CE1-OD1 3.24Å; H199-N203 VanDerWaalsContact ND1-CG 3.34Å; H199-N203 PolarHBondContact ND1-ND2 3.42Å; H199-N203 PolarHBondContact ND1-OD1 2.8Å; H199-N203 VanDerWaalsContact O-CB 3.23Å; H199-N203 WeakPolarHBondContact O-CB 3.07Å; H199-N203 PolarHBondContact O-N 3.4Å; H199-N203 PolarHBondContact O-ND2 2.98Å; H199-N203 PolarHBondContact O-OD1 3.31Å |
| 200 | L | 55.2 | Low | 62.9 | Low | 102 Ų | 102 | 106.1 Ų | 106.1 | 53% | 0.534 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -70.1 | -38.9 | 175.1 | -82.7 | -13.8 | 0 | 0 | 0 | 112.1 | N196 Q197 N203 K204 | N196-L200 VanDerWaalsContact C-CD2 3.48Å; N196-L200 HydrophobicContact CB-CD2 4.08Å; N196-L200 WeakPolarHBondContact O-CB 3.45Å; N196-L200 WeakPolarHBondContact O-CD2 3.26Å; N196-L200 PolarHBondContact O-N 3.03Å; Q197-L200 PolarHBondContact O-N 3.03Å; L200-N203 PolarHBondContact O-N 3.45Å; L200-K204 WeakPolarHBondContact O-CB 3.33Å; L200-K204 PolarHBondContact O-N 2.86Å |
| 201 | I | 60.5 | Low | 63 | Low | 84 Ų | 84 | 106.3 Ų | 106.3 | 43% | 0.431 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.7 | -50 | 174.2 | -66.4 | 162.3 | 0 | 0 | 0 | 109.8 | Q197 H198 N203 K204 E205 | Q197-I201 VanDerWaalsContact O-CG1 3.27Å; Q197-I201 WeakPolarHBondContact O-CG1 3.32Å; Q197-I201 PolarHBondContact O-N 3.05Å; H198-I201 PolarHBondContact O-N 2.99Å; I201-N203 VanDerWaalsContact C-N 3.33Å; I201-N203 PolarHBondContact O-N 3.25Å; I201-K204 PolarHBondContact O-N 3.44Å; I201-E205 WeakPolarHBondContact O-CG 3.35Å; I201-E205 PolarHBondContact O-N 3.49Å |
| 202 | S | 58.2 | Low | 63.3 | Low | 46 Ų | 46 | 105.8 Ų | 105.8 | 32% | 0.322 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -56.5 | -43.9 | 174.6 | 162.7 | 0 | 0 | 0 | 0 | 112.4 | H198 K204 E205 N206 | H198-S202 VanDerWaalsContact O-CB 3.29Å; H198-S202 WeakPolarHBondContact O-CB 3.27Å; H198-S202 PolarHBondContact O-N 2.84Å; S202-K204 VanDerWaalsContact C-N 3.32Å; S202-K204 PolarHBondContact O-N 3.27Å; S202-E205 PolarHBondContact O-N 2.99Å; S202-N206 WeakPolarHBondContact O-CB 3.48Å; S202-N206 VanDerWaalsContact O-CG 3.3Å; S202-N206 PolarHBondContact O-N 3.24Å; S202-N206 PolarHBondContact O-ND2 3.47Å |
| 203 | N | 66.4 | Low | 64.2 | Low | 67 Ų | 67 | 104.3 Ų | 104.3 | 36% | 0.358 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.9 | -38 | 176.7 | -73.9 | -16.7 | 0 | 0 | 0 | 111.5 | H199 L200 I201 Q207 | H199-N203 PolarHBondContact CE1-ND2 3.2Å; H199-N203 PolarHBondContact CE1-OD1 3.42Å; H199-N203 VanDerWaalsContact CE1-OD1 3.24Å; H199-N203 VanDerWaalsContact ND1-CG 3.34Å; H199-N203 PolarHBondContact ND1-ND2 3.42Å; H199-N203 PolarHBondContact ND1-OD1 2.8Å; H199-N203 VanDerWaalsContact O-CB 3.23Å; H199-N203 WeakPolarHBondContact O-CB 3.07Å; H199-N203 PolarHBondContact O-N 3.4Å; H199-N203 PolarHBondContact O-ND2 2.98Å; H199-N203 PolarHBondContact O-OD1 3.31Å; L200-N203 PolarHBondContact O-N 3.45Å; I201-N203 VanDerWaalsContact C-N 3.33Å; I201-N203 PolarHBondContact O-N 3.25Å; N203-Q207 WeakPolarHBondContact O-CB 3.41Å; N203-Q207 WeakPolarHBondContact O-CG 3.48Å; N203-Q207 PolarHBondContact O-N 3.04Å |
| 204 | K | 68.3 | Low | 65 | Low | 165 Ų | 165 | 102.4 Ų | 102.4 | 72% | 0.717 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -70.3 | -38.8 | 179.1 | -166.3 | 171.8 | -176.3 | 177.6 | 0 | 111.9 | L200 I201 S202 Q207 N208 | L200-K204 WeakPolarHBondContact O-CB 3.33Å; L200-K204 PolarHBondContact O-N 2.86Å; I201-K204 PolarHBondContact O-N 3.44Å; S202-K204 VanDerWaalsContact C-N 3.32Å; S202-K204 PolarHBondContact O-N 3.27Å; K204-Q207 PolarHBondContact O-N 3.49Å; K204-N208 WeakPolarHBondContact O-CB 3.42Å; K204-N208 PolarHBondContact O-N 3.08Å |
| 205 | E | 65.7 | Low | 65.6 | Low | 129 Ų | 129 | 100.1 Ų | 100.1 | 60% | 0.603 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.1 | -43.7 | 173.3 | -71.5 | 174.9 | 170.7 | 0 | 0 | 111.6 | I201 S202 Q207 N208 Y209 | I201-E205 WeakPolarHBondContact O-CG 3.35Å; I201-E205 PolarHBondContact O-N 3.49Å; S202-E205 PolarHBondContact O-N 2.99Å; E205-Q207 PolarHBondContact O-N 3.2Å; E205-N208 PolarHBondContact O-N 3.32Å; E205-Y209 WeakPolarHBondContact O-CB 3.45Å; E205-Y209 PolarHBondContact O-N 2.87Å |
| 206 | N | 71.3 | Confident | 66 | Low | 90 Ų | 90 | 97.9 Ų | 97.9 | 48% | 0.481 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.9 | -39 | 174.5 | -77.2 | -32.4 | 0 | 0 | 0 | 112.2 | S202 Y209 L210 | S202-N206 WeakPolarHBondContact O-CB 3.48Å; S202-N206 VanDerWaalsContact O-CG 3.3Å; S202-N206 PolarHBondContact O-N 3.24Å; S202-N206 PolarHBondContact O-ND2 3.47Å; N206-Y209 WeakPolarHBondContact O-CB 3.41Å; N206-Y209 PolarHBondContact O-N 2.8Å; N206-L210 WeakPolarHBondContact O-CG 3.37Å; N206-L210 PolarHBondContact O-N 3.25Å |
| 207 | Q | 71.3 | Confident | 66.1 | Low | 131 Ų | 131 | 99.6 Ų | 99.6 | 61% | 0.612 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -66.1 | -43.5 | 174.9 | -74.6 | -65.8 | -7 | 0 | 0 | 111.6 | N203 K204 E205 Y209 L210 D211 | N203-Q207 WeakPolarHBondContact O-CB 3.41Å; N203-Q207 WeakPolarHBondContact O-CG 3.48Å; N203-Q207 PolarHBondContact O-N 3.04Å; K204-Q207 PolarHBondContact O-N 3.49Å; E205-Q207 PolarHBondContact O-N 3.2Å; Q207-Y209 PolarHBondContact O-N 2.94Å; Q207-L210 PolarHBondContact O-N 3.46Å; Q207-D211 WeakPolarHBondContact O-CB 3.35Å; Q207-D211 PolarHBondContact O-N 2.93Å |
| 208 | N | 74.1 | Confident | 66.2 | Low | 113 Ų | 113 | 101.2 Ų | 101.2 | 60% | 0.604 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60.5 | -37.6 | 172.5 | -165.3 | -32.7 | 0 | 0 | 0 | 110.9 | K204 E205 D211 Y212 | K204-N208 WeakPolarHBondContact O-CB 3.42Å; K204-N208 PolarHBondContact O-N 3.08Å; E205-N208 PolarHBondContact O-N 3.32Å; N208-D211 PolarHBondContact O-N 3.03Å; N208-Y212 WeakPolarHBondContact O-CD1 3.44Å; N208-Y212 PolarHBondContact O-N 3.07Å |
| 209 | Y | 73.9 | Confident | 66.1 | Low | 116 Ų | 116 | 100.4 Ų | 100.4 | 46% | 0.455 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62 | -48.1 | 175.7 | -177.2 | -76.6 | 0 | 0 | 0 | 112.4 | E205 N206 Q207 D211 Y212 K213 | E205-Y209 WeakPolarHBondContact O-CB 3.45Å; E205-Y209 PolarHBondContact O-N 2.87Å; N206-Y209 WeakPolarHBondContact O-CB 3.41Å; N206-Y209 PolarHBondContact O-N 2.8Å; Q207-Y209 PolarHBondContact O-N 2.94Å; Y209-D211 VanDerWaalsContact C-N 3.35Å; Y209-Y212 AromaticContact CD1-CE1 3.99Å; Y209-Y212 HydrophobicContact CD1-CE1 3.99Å; Y209-Y212 HydrophobicContact CD2-CD1 4.49Å; Y209-Y212 AromaticContact CD2-CE1 3.27Å; Y209-Y212 HydrophobicContact CD2-CE1 3.27Å; Y209-Y212 AromaticContact CD2-CZ 3.61Å; Y209-Y212 WeakPolarHBondContact CD2-OH 3.36Å; Y209-Y212 HydrophobicContact CE1-CE1 4.44Å; Y209-Y212 WeakPolarHBondContact CE1-OH 3.41Å; Y209-Y212 AromaticContact CE2-CE1 3.82Å; Y209-Y212 HydrophobicContact CE2-CE1 3.82Å; Y209-Y212 AromaticContact CE2-CZ 3.64Å; Y209-Y212 WeakPolarHBondContact CE2-OH 3.48Å; Y209-Y212 HydrophobicContact CG-CD1 4.33Å; Y209-Y212 AromaticContact CG-CE1 3.35Å; Y209-Y212 HydrophobicContact CG-CE1 3.35Å; Y209-Y212 AromaticContact CG-CZ 3.84Å; Y209-Y212 AromaticContact CZ-CZ 3.86Å; Y209-Y212 WeakPolarHBondContact O-CD1 3.32Å; Y209-Y212 WeakPolarHBondContact O-CE1 3.47Å; Y209-Y212 PolarHBondContact OH-OH 3.15Å; Y209-K213 HydrophobicContact CE1-CD 4.13Å; Y209-K213 WeakPolarHBondContact O-CB 3.42Å; Y209-K213 PolarHBondContact O-N 3.46Å; Y209-K213 VanDerWaalsContact O-N 3.14Å |
| 210 | L | 69.9 | Low | 65.9 | Low | 94 Ų | 94 | 100.7 Ų | 100.7 | 49% | 0.492 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -66.8 | -38.1 | 178.4 | -67.6 | -177.2 | 0 | 0 | 0 | 111.7 | N206 Q207 K213 T214 | N206-L210 WeakPolarHBondContact O-CG 3.37Å; N206-L210 PolarHBondContact O-N 3.25Å; Q207-L210 PolarHBondContact O-N 3.46Å; L210-K213 PolarHBondContact O-N 2.69Å; L210-T214 WeakPolarHBondContact O-CB 3.44Å; L210-T214 PolarHBondContact O-N 2.69Å; L210-T214 PolarHBondContact O-OG1 3.29Å |
| 211 | D | 73 | Confident | 65.9 | Low | 102 Ų | 102 | 101.4 Ų | 101.4 | 55% | 0.545 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.1 | -46.9 | 179.4 | -152.1 | 35.6 | 0 | 0 | 0 | 111.2 | Q207 N208 Y209 K213 T214 I215 | Q207-D211 WeakPolarHBondContact O-CB 3.35Å; Q207-D211 PolarHBondContact O-N 2.93Å; N208-D211 PolarHBondContact O-N 3.03Å; Y209-D211 VanDerWaalsContact C-N 3.35Å; D211-K213 VanDerWaalsContact C-N 3.28Å; D211-K213 PolarHBondContact O-N 3.21Å; D211-T214 PolarHBondContact O-N 3.14Å; D211-I215 WeakPolarHBondContact O-CB 3.49Å; D211-I215 WeakPolarHBondContact O-CD1 3.4Å; D211-I215 WeakPolarHBondContact O-CG1 3.35Å; D211-I215 PolarHBondContact O-N 3.36Å |
| 212 | Y | 70.9 | Confident | 65.5 | Low | 93 Ų | 93 | 100.9 Ų | 100.9 | 37% | 0.365 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.6 | -37.3 | 175.2 | 88.7 | -109.7 | 0 | 0 | 0 | 111.6 | N208 Y209 I215 Q216 | N208-Y212 WeakPolarHBondContact O-CD1 3.44Å; N208-Y212 PolarHBondContact O-N 3.07Å; Y209-Y212 AromaticContact CD1-CE1 3.99Å; Y209-Y212 HydrophobicContact CD1-CE1 3.99Å; Y209-Y212 HydrophobicContact CD2-CD1 4.49Å; Y209-Y212 AromaticContact CD2-CE1 3.27Å; Y209-Y212 HydrophobicContact CD2-CE1 3.27Å; Y209-Y212 AromaticContact CD2-CZ 3.61Å; Y209-Y212 WeakPolarHBondContact CD2-OH 3.36Å; Y209-Y212 HydrophobicContact CE1-CE1 4.44Å; Y209-Y212 WeakPolarHBondContact CE1-OH 3.41Å; Y209-Y212 AromaticContact CE2-CE1 3.82Å; Y209-Y212 HydrophobicContact CE2-CE1 3.82Å; Y209-Y212 AromaticContact CE2-CZ 3.64Å; Y209-Y212 WeakPolarHBondContact CE2-OH 3.48Å; Y209-Y212 HydrophobicContact CG-CD1 4.33Å; Y209-Y212 AromaticContact CG-CE1 3.35Å; Y209-Y212 HydrophobicContact CG-CE1 3.35Å; Y209-Y212 AromaticContact CG-CZ 3.84Å; Y209-Y212 AromaticContact CZ-CZ 3.86Å; Y209-Y212 WeakPolarHBondContact O-CD1 3.32Å; Y209-Y212 WeakPolarHBondContact O-CE1 3.47Å; Y209-Y212 PolarHBondContact OH-OH 3.15Å; Y212-I215 PolarHBondContact O-N 3.02Å; Y212-Q216 HydrophobicContact CD2-CG 4.29Å; Y212-Q216 WeakPolarHBondContact O-CB 3.47Å; Y212-Q216 WeakPolarHBondContact O-CG 3.3Å; Y212-Q216 PolarHBondContact O-N 3.43Å |
| 213 | K | 77.8 | Confident | 65 | Low | 100 Ų | 100 | 104 Ų | 104 | 44% | 0.435 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -69.6 | -39.9 | -178 | -173.1 | 172.7 | -178.2 | 177.5 | 0 | 111.3 | Y209 L210 D211 Q216 Q217 | Y209-K213 HydrophobicContact CE1-CD 4.13Å; Y209-K213 WeakPolarHBondContact O-CB 3.42Å; Y209-K213 PolarHBondContact O-N 3.46Å; Y209-K213 VanDerWaalsContact O-N 3.14Å; L210-K213 PolarHBondContact O-N 2.69Å; D211-K213 VanDerWaalsContact C-N 3.28Å; D211-K213 PolarHBondContact O-N 3.21Å; K213-Q216 PolarHBondContact O-N 3.11Å; K213-Q217 PolarHBondContact O-N 2.73Å |
| 214 | T | 71.9 | Confident | 64.1 | Low | 62 Ų | 62 | 105 Ų | 105 | 38% | 0.38 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63 | -46.5 | 171.9 | -60.9 | 0 | 0 | 0 | 0 | 110.7 | L210 D211 Q216 Q217 E218 | L210-T214 WeakPolarHBondContact O-CB 3.44Å; L210-T214 PolarHBondContact O-N 2.69Å; L210-T214 PolarHBondContact O-OG1 3.29Å; D211-T214 PolarHBondContact O-N 3.14Å; T214-Q216 VanDerWaalsContact C-N 3.25Å; T214-Q216 PolarHBondContact O-N 3.5Å; T214-Q217 PolarHBondContact O-N 3.08Å; T214-E218 HydrophobicContact CG2-CG 4.43Å; T214-E218 WeakPolarHBondContact O-CB 2.83Å; T214-E218 WeakPolarHBondContact O-CG 3.39Å; T214-E218 PolarHBondContact O-N 3.47Å |
| 215 | I | 67.9 | Low | 63.1 | Low | 70 Ų | 70 | 104.3 Ų | 104.3 | 36% | 0.359 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.9 | -31.8 | 177.4 | -63.7 | 163.8 | 0 | 0 | 0 | 111.5 | D211 Y212 R219 | D211-I215 WeakPolarHBondContact O-CB 3.49Å; D211-I215 WeakPolarHBondContact O-CD1 3.4Å; D211-I215 WeakPolarHBondContact O-CG1 3.35Å; D211-I215 PolarHBondContact O-N 3.36Å; Y212-I215 PolarHBondContact O-N 3.02Å; I215-R219 WeakPolarHBondContact O-CB 3.34Å; I215-R219 VanDerWaalsContact O-CG 3.28Å; I215-R219 WeakPolarHBondContact O-CG 3.22Å; I215-R219 PolarHBondContact O-N 2.98Å; I215-R219 VanDerWaalsContact O-N 3.14Å; I215-R219 PolarHBondContact O-NE 2.69Å; I215-R219 VanDerWaalsContact O-NE 3.17Å |
| 216 | Q | 62.7 | Low | 62.2 | Low | 87 Ų | 87 | 105.3 Ų | 105.3 | 41% | 0.407 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -74.1 | -43.3 | 174.2 | -68.1 | -90.2 | 90.3 | 0 | 0 | 111.4 | Y212 K213 T214 E218 R219 D220 | Y212-Q216 HydrophobicContact CD2-CG 4.29Å; Y212-Q216 WeakPolarHBondContact O-CB 3.47Å; Y212-Q216 WeakPolarHBondContact O-CG 3.3Å; Y212-Q216 PolarHBondContact O-N 3.43Å; K213-Q216 PolarHBondContact O-N 3.11Å; T214-Q216 VanDerWaalsContact C-N 3.25Å; T214-Q216 PolarHBondContact O-N 3.5Å; Q216-E218 VanDerWaalsContact C-N 3.33Å; Q216-E218 PolarHBondContact O-N 2.83Å; Q216-R219 CarbonylContact O-C 3.56Å; Q216-R219 WeakPolarHBondContact O-CB 3.44Å; Q216-R219 PolarHBondContact O-N 3.19Å; Q216-R219 VanDerWaalsContact O-N 3.13Å; Q216-R219 VanDerWaalsContact OE1-NH1 3.11Å; Q216-R219 VanDerWaalsContact OE1-NH2 3.12Å; Q216-D220 PolarHBondContact O-N 2.94Å |
| 217 | Q | 58.8 | Low | 61.1 | Low | 114 Ų | 114 | 106.7 Ų | 106.7 | 53% | 0.533 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.1 | -37 | 174.5 | -97.6 | 179.8 | -27.4 | 0 | 0 | 112.8 | K213 T214 D220 N221 | K213-Q217 PolarHBondContact O-N 2.73Å; T214-Q217 PolarHBondContact O-N 3.08Å; Q217-D220 PolarHBondContact O-N 3.37Å; Q217-N221 VanDerWaalsContact O-CB 3.23Å; Q217-N221 WeakPolarHBondContact O-CB 3.47Å; Q217-N221 VanDerWaalsContact O-CG 3.28Å; Q217-N221 PolarHBondContact O-N 3.41Å; Q217-N221 PolarHBondContact O-ND2 3.48Å |
| 218 | E | 58.1 | Low | 59.9 | Low | 125 Ų | 125 | 106.3 Ų | 106.3 | 58% | 0.584 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -68.3 | -34.9 | 173.3 | -72.9 | -179.7 | -176.3 | 0 | 0 | 111.6 | T214 Q216 S222 | T214-E218 HydrophobicContact CG2-CG 4.43Å; T214-E218 WeakPolarHBondContact O-CB 2.83Å; T214-E218 WeakPolarHBondContact O-CG 3.39Å; T214-E218 PolarHBondContact O-N 3.47Å; Q216-E218 VanDerWaalsContact C-N 3.33Å; Q216-E218 PolarHBondContact O-N 2.83Å; E218-S222 VanDerWaalsContact O-CB 3.24Å; E218-S222 WeakPolarHBondContact O-CB 3.28Å; E218-S222 PolarHBondContact O-N 2.81Å; E218-S222 PolarHBondContact O-OG 3.24Å |
| 219 | R | 56.3 | Low | 59 | Low | 122 Ų | 122 | 108.7 Ų | 108.7 | 46% | 0.46 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -70.5 | -36.2 | 172.8 | -80.8 | -175.4 | -84.9 | 166.5 | -9.9 | 113.3 | I215 Q216 S222 N223 | I215-R219 WeakPolarHBondContact O-CB 3.34Å; I215-R219 VanDerWaalsContact O-CG 3.28Å; I215-R219 WeakPolarHBondContact O-CG 3.22Å; I215-R219 PolarHBondContact O-N 2.98Å; I215-R219 VanDerWaalsContact O-N 3.14Å; I215-R219 PolarHBondContact O-NE 2.69Å; I215-R219 VanDerWaalsContact O-NE 3.17Å; Q216-R219 CarbonylContact O-C 3.56Å; Q216-R219 WeakPolarHBondContact O-CB 3.44Å; Q216-R219 PolarHBondContact O-N 3.19Å; Q216-R219 VanDerWaalsContact O-N 3.13Å; Q216-R219 VanDerWaalsContact OE1-NH1 3.11Å; Q216-R219 VanDerWaalsContact OE1-NH2 3.12Å; R219-S222 WeakPolarHBondContact CA-OG 3.27Å; R219-S222 PolarHBondContact O-OG 2.91Å; R219-N223 VanDerWaalsContact O-CB 3.25Å; R219-N223 WeakPolarHBondContact O-CB 3.46Å; R219-N223 PolarHBondContact O-N 3.26Å; R219-N223 PolarHBondContact O-ND2 3.4Å; R219-N223 VanDerWaalsContact O-ND2 3.09Å |
| 220 | D | 52.2 | Low | 58 | Low | 103 Ų | 103 | 106.8 Ų | 106.8 | 55% | 0.551 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -76.7 | -37 | 178 | -68 | -25.2 | 0 | 0 | 0 | 111.4 | Q216 Q217 S224 | Q216-D220 PolarHBondContact O-N 2.94Å; Q217-D220 PolarHBondContact O-N 3.37Å; D220-S224 WeakPolarHBondContact O-CB 3.36Å; D220-S224 PolarHBondContact O-N 3.4Å |
| 221 | N | 54.4 | Low | 57.6 | Low | 117 Ų | 117 | 109.9 Ų | 109.9 | 63% | 0.626 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -72.6 | -32.5 | 175 | -75.1 | -27.1 | 0 | 0 | 0 | 112.9 | Q217 | Q217-N221 VanDerWaalsContact O-CB 3.23Å; Q217-N221 WeakPolarHBondContact O-CB 3.47Å; Q217-N221 VanDerWaalsContact O-CG 3.28Å; Q217-N221 PolarHBondContact O-N 3.41Å; Q217-N221 PolarHBondContact O-ND2 3.48Å |
| 222 | S | 52.1 | Low | 57.3 | Low | 72 Ų | 72 | 114.9 Ų | 114.9 | 50% | 0.503 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -79 | -29.9 | 174.6 | 55.4 | 0 | 0 | 0 | 0 | 113.3 | E218 R219 | E218-S222 VanDerWaalsContact O-CB 3.24Å; E218-S222 WeakPolarHBondContact O-CB 3.28Å; E218-S222 PolarHBondContact O-N 2.81Å; E218-S222 PolarHBondContact O-OG 3.24Å; R219-S222 WeakPolarHBondContact CA-OG 3.27Å; R219-S222 PolarHBondContact O-OG 2.91Å |
| 223 | N | 48.9 | Very low | 57.5 | Low | 111 Ų | 111 | 113.6 Ų | 113.6 | 59% | 0.594 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -81.4 | -21.1 | 173.1 | -81.5 | -45.8 | 0 | 0 | 0 | 114.1 | R219 H225 | R219-N223 VanDerWaalsContact O-CB 3.25Å; R219-N223 WeakPolarHBondContact O-CB 3.46Å; R219-N223 PolarHBondContact O-N 3.26Å; R219-N223 PolarHBondContact O-ND2 3.4Å; R219-N223 VanDerWaalsContact O-ND2 3.09Å; N223-H225 VanDerWaalsContact C-N 3.28Å; N223-H225 PolarHBondContact O-N 2.87Å |
| 224 | S | 47.1 | Very low | 57.7 | Low | 89 Ų | 89 | 113.8 Ų | 113.8 | 62% | 0.622 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.7 | -19 | 175.9 | -169.6 | 0 | 0 | 0 | 0 | 113.1 | D220 | D220-S224 WeakPolarHBondContact O-CB 3.36Å; D220-S224 PolarHBondContact O-N 3.4Å |
| 225 | H | 47.7 | Very low | 58.3 | Low | 151 Ų | 151 | 117.9 Ų | 117.9 | 70% | 0.699 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100 | 2.6 | -178.5 | -146.6 | 65.9 | 0 | 0 | 0 | 115.3 | N223 | N223-H225 VanDerWaalsContact C-N 3.28Å; N223-H225 PolarHBondContact O-N 2.87Å |
| 226 | M | 46.9 | Very low | 59.1 | Low | 149 Ų | 149 | 117 Ų | 117 | 73% | 0.734 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -121.4 | 15.9 | -180 | -71.6 | -68.9 | 145.1 | 0 | 0 | 113.4 | ||
| 227 | N | 46.4 | Very low | 60.2 | Low | 120 Ų | 120 | 115.1 Ų | 115.1 | 64% | 0.642 | 60% | 0.595 | S | S | * | * | trans | -129.9 | 28.1 | -178.1 | -152.9 | -0.3 | 0 | 0 | 0 | 113.4 | Y229 | N227-Y229 PolarHBondContact O-N 3.09Å; N227-Y229 VanDerWaalsContact OD1-CD2 3.31Å; N227-Y229 WeakPolarHBondContact OD1-CD2 3.35Å | ||
| 228 | T | 47.9 | Very low | 61.7 | Low | 122 Ų | 122 | 111.7 Ų | 111.7 | 75% | 0.748 | 59% | 0.586 | S | S | * | * | trans | -91.5 | 62.4 | 162.5 | 51.4 | 0 | 0 | 0 | 0 | 108.9 | S230 | T228-S230 PolarHBondContact O-N 3.29Š| ||
| 229 | Y | 55.3 | Low | 63.2 | Low | 164 Ų | 164 | 109.3 Ų | 109.3 | 64% | 0.643 | 58% | 0.58 | S | S | * | * | trans | -59.6 | 102.6 | 166.6 | -81.4 | -87.6 | 0 | 0 | 0 | 108.1 | N227 L231 L236 | N227-Y229 PolarHBondContact O-N 3.09Å; N227-Y229 VanDerWaalsContact OD1-CD2 3.31Å; N227-Y229 WeakPolarHBondContact OD1-CD2 3.35Å; Y229-L231 PolarHBondContact O-N 3.3Å; Y229-L236 HydrophobicContact CD1-CD2 3.77Å; Y229-L236 HydrophobicContact CE1-CD2 4.22Å | ||
| 230 | S | 53 | Low | 64.9 | Low | 75 Ų | 75 | 109.6 Ų | 109.6 | 52% | 0.524 | 59% | 0.585 | S | S | . | * | trans | -56.1 | 104.4 | 165.5 | -178.9 | 0 | 0 | 0 | 0 | 107.5 | T228 Y232 D233 | T228-S230 PolarHBondContact O-N 3.29Å; S230-Y232 PolarHBondContact O-N 3.21Å; S230-D233 PolarHBondContact O-N 3.26Å | ||
| 231 | L | 59.6 | Low | 66.9 | Low | 160 Ų | 160 | 110.2 Ų | 110.2 | 84% | 0.838 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.7 | -4.8 | 178.6 | -171.5 | 60.6 | 0 | 0 | 0 | 112.5 | Y229 | Y229-L231 PolarHBondContact O-N 3.3Š|
| 232 | Y | 66.5 | Low | 68.8 | Low | 206 Ų | 206 | 111 Ų | 111 | 81% | 0.808 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126 | 27.9 | -177.6 | -75.1 | -84.6 | 0 | 0 | 0 | 113.8 | S230 P234 | S230-Y232 PolarHBondContact O-N 3.21Å; Y232-P234 WeakPolarHBondContact O-CD 3.3Å |
| 233 | D | 76.2 | Confident | 70.7 | Confident | 66 Ų | 66 | 110.5 Ų | 110.5 | 35% | 0.353 | 59% | 0.587 | S | S | . | * | trans | -80.6 | 108.6 | 170.5 | -176.8 | 4.7 | 0 | 0 | 0 | 111.1 | S230 E235 L236 A237 | S230-D233 PolarHBondContact O-N 3.26Å; D233-E235 PolarHBondContact O-N 3.45Å; D233-E235 WeakPolarHBondContact OD1-CB 3.48Å; D233-E235 PolarHBondContact OD1-N 2.87Å; D233-L236 HydrophobicContact CB-CB 3.99Å; D233-L236 PolarHBondContact O-N 3.44Å; D233-A237 PolarHBondContact O-N 2.85Å | ||
| 234 | P | 82.3 | Confident | 73 | Confident | 105 Ų | 105 | 109.6 Ų | 109.6 | 68% | 0.682 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -60.4 | -26.3 | 178 | 26 | -34.5 | 0 | 0 | 0 | 112.8 | Y232 A238 | Y232-P234 WeakPolarHBondContact O-CD 3.3Å; P234-A238 VanDerWaalsContact O-CB 3.31Å; P234-A238 WeakPolarHBondContact O-CB 3.3Å; P234-A238 PolarHBondContact O-N 3.49Å |
| 235 | E | 84.4 | Confident | 75.3 | Confident | 148 Ų | 148 | 110.8 Ų | 110.8 | 69% | 0.692 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -75.4 | -40.4 | -179.8 | -162.2 | 166.5 | -164.8 | 0 | 0 | 111.5 | D233 A238 T239 | D233-E235 PolarHBondContact O-N 3.45Å; D233-E235 WeakPolarHBondContact OD1-CB 3.48Å; D233-E235 PolarHBondContact OD1-N 2.87Å; E235-A238 PolarHBondContact O-N 2.9Å; E235-T239 WeakPolarHBondContact O-CB 3.33Å; E235-T239 PolarHBondContact O-N 2.91Å; E235-T239 PolarHBondContact O-OG1 2.78Å |
| 236 | L | 83.6 | Confident | 77.4 | Confident | 51 Ų | 51 | 112.7 Ų | 112.7 | 27% | 0.267 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.4 | -41.7 | 171.1 | -176.1 | 64.5 | 0 | 0 | 0 | 111.7 | Y229 D233 T239 K240 | Y229-L236 HydrophobicContact CD1-CD2 3.77Å; Y229-L236 HydrophobicContact CE1-CD2 4.22Å; D233-L236 HydrophobicContact CB-CB 3.99Å; D233-L236 PolarHBondContact O-N 3.44Å; L236-T239 PolarHBondContact O-N 2.69Å; L236-K240 WeakPolarHBondContact O-CG 3.36Å; L236-K240 PolarHBondContact O-N 2.99Å |
| 237 | A | 86 | Confident | 79.7 | Confident | 48 Ų | 48 | 106.4 Ų | 106.4 | 40% | 0.397 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.6 | -46.2 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | D233 T239 K240 I241 | D233-A237 PolarHBondContact O-N 2.85Å; A237-T239 VanDerWaalsContact C-N 3.34Å; A237-T239 PolarHBondContact O-N 2.96Å; A237-K240 PolarHBondContact O-N 3.38Å; A237-I241 WeakPolarHBondContact O-CG1 3.5Å; A237-I241 PolarHBondContact O-N 3.46Å |
| 238 | A | 90.6 | Very high | 81.9 | Confident | 42 Ų | 42 | 106.5 Ų | 106.5 | 35% | 0.347 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -58.9 | -44.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | P234 E235 K240 I241 Q242 | P234-A238 VanDerWaalsContact O-CB 3.31Å; P234-A238 WeakPolarHBondContact O-CB 3.3Å; P234-A238 PolarHBondContact O-N 3.49Å; E235-A238 PolarHBondContact O-N 2.9Å; A238-K240 PolarHBondContact O-N 3.46Å; A238-I241 PolarHBondContact O-N 3.44Å; A238-Q242 WeakPolarHBondContact O-CB 3.22Å; A238-Q242 VanDerWaalsContact O-CG 3.26Å; A238-Q242 WeakPolarHBondContact O-CG 3.33Å; A238-Q242 PolarHBondContact O-N 3.18Å |
| 239 | T | 90 | Very high | 84 | Confident | 75 Ų | 75 | 107.2 Ų | 107.2 | 46% | 0.46 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -60 | -43.9 | 177.6 | -59.6 | 0 | 0 | 0 | 0 | 111.7 | E235 L236 A237 Q242 A243 | E235-T239 WeakPolarHBondContact O-CB 3.33Å; E235-T239 PolarHBondContact O-N 2.91Å; E235-T239 PolarHBondContact O-OG1 2.78Å; L236-T239 PolarHBondContact O-N 2.69Å; A237-T239 VanDerWaalsContact C-N 3.34Å; A237-T239 PolarHBondContact O-N 2.96Å; T239-Q242 PolarHBondContact O-N 2.96Å; T239-A243 WeakPolarHBondContact O-CB 3.1Å; T239-A243 PolarHBondContact O-N 2.6Å |
| 240 | K | 92.4 | Very high | 85.7 | Confident | 128 Ų | 128 | 103.8 Ų | 103.8 | 56% | 0.557 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -62.8 | -43.1 | 175.8 | -73.3 | 176.5 | 179.6 | 178.7 | 0 | 111.9 | L236 A237 A238 A243 T244 | L236-K240 WeakPolarHBondContact O-CG 3.36Å; L236-K240 PolarHBondContact O-N 2.99Å; A237-K240 PolarHBondContact O-N 3.38Å; A238-K240 PolarHBondContact O-N 3.46Å; K240-A243 PolarHBondContact O-N 2.94Å; K240-T244 VanDerWaalsContact O-CG2 3.32Å; K240-T244 WeakPolarHBondContact O-CG2 3.49Å; K240-T244 PolarHBondContact O-N 3.37Å; K240-T244 PolarHBondContact O-OG1 3.21Å |
| 241 | I | 92.9 | Very high | 87.5 | Confident | 116 Ų | 116 | 107.6 Ų | 107.6 | 60% | 0.595 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -64.8 | -43 | 177.4 | -67.9 | 167.7 | 0 | 0 | 0 | 111.2 | A237 A238 A243 T244 F245 | A237-I241 WeakPolarHBondContact O-CG1 3.5Å; A237-I241 PolarHBondContact O-N 3.46Å; A238-I241 PolarHBondContact O-N 3.44Å; I241-A243 PolarHBondContact O-N 3.47Å; I241-T244 PolarHBondContact O-N 2.9Å; I241-T244 PolarHBondContact O-OG1 2.87Å; I241-F245 WeakPolarHBondContact O-CB 3.4Å; I241-F245 PolarHBondContact O-N 3.44Å |
| 242 | Q | 94.2 | Very high | 89 | Confident | 132 Ų | 132 | 106.8 Ų | 106.8 | 62% | 0.617 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.7 | -42 | 177.1 | -71.9 | 172.4 | -4.4 | 0 | 0 | 111.7 | A238 T239 F245 R246 | A238-Q242 WeakPolarHBondContact O-CB 3.22Å; A238-Q242 VanDerWaalsContact O-CG 3.26Å; A238-Q242 WeakPolarHBondContact O-CG 3.33Å; A238-Q242 PolarHBondContact O-N 3.18Å; T239-Q242 PolarHBondContact O-N 2.96Å; Q242-F245 PolarHBondContact O-N 3.48Å; Q242-R246 WeakPolarHBondContact O-CB 3.32Å; Q242-R246 PolarHBondContact O-N 3.21Å |
| 243 | A | 93.8 | Very high | 89.8 | Confident | 62 Ų | 62 | 103.4 Ų | 103.4 | 51% | 0.512 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.2 | -45.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | T239 K240 I241 R246 G247 | T239-A243 WeakPolarHBondContact O-CB 3.1Å; T239-A243 PolarHBondContact O-N 2.6Å; K240-A243 PolarHBondContact O-N 2.94Å; I241-A243 PolarHBondContact O-N 3.47Å; A243-R246 PolarHBondContact O-N 3.16Å; A243-G247 PolarHBondContact O-N 2.87Å |
| 244 | T | 95.5 | Very high | 90.1 | Very high | 92 Ų | 92 | 105.6 Ų | 105.6 | 56% | 0.564 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.8 | -41.6 | 177.7 | 55.8 | 0 | 0 | 0 | 0 | 111.7 | K240 I241 G247 Y248 | K240-T244 VanDerWaalsContact O-CG2 3.32Å; K240-T244 WeakPolarHBondContact O-CG2 3.49Å; K240-T244 PolarHBondContact O-N 3.37Å; K240-T244 PolarHBondContact O-OG1 3.21Å; I241-T244 PolarHBondContact O-N 2.9Å; I241-T244 PolarHBondContact O-OG1 2.87Å; T244-G247 PolarHBondContact O-N 3.08Å; T244-Y248 WeakPolarHBondContact O-CB 3.28Å; T244-Y248 PolarHBondContact O-N 3.12Å |
| 245 | F | 95.3 | Very high | 89.9 | Confident | 114 Ų | 114 | 106.4 Ų | 106.4 | 50% | 0.5 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.8 | -43 | 176.3 | -176.2 | -109.5 | 0 | 0 | 0 | 112.5 | I241 Q242 G247 Y248 R249 | I241-F245 WeakPolarHBondContact O-CB 3.4Å; I241-F245 PolarHBondContact O-N 3.44Å; Q242-F245 PolarHBondContact O-N 3.48Å; F245-G247 VanDerWaalsContact C-N 3.34Å; F245-G247 PolarHBondContact O-N 2.94Å; F245-Y248 PolarHBondContact O-N 2.88Å; F245-R249 HydrophobicContact CD1-CG 4.4Å; F245-R249 VanDerWaalsContact CE1-CD 3.43Å; F245-R249 HydrophobicContact CE1-CG 4.07Å; F245-R249 HydrophobicContact CE2-CG 4.42Å; F245-R249 HydrophobicContact CZ-CG 4.07Å; F245-R249 WeakPolarHBondContact O-CG 3.38Å; F245-R249 PolarHBondContact O-N 3.1Å |
| 246 | R | 93.1 | Very high | 89.4 | Confident | 191 Ų | 191 | 112.8 Ų | 112.8 | 72% | 0.721 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -59.6 | -45.4 | 174.4 | -175.9 | 130 | 69.3 | 127 | -3.1 | 111 | Q242 A243 Y248 R249 T250 | Q242-R246 WeakPolarHBondContact O-CB 3.32Å; Q242-R246 PolarHBondContact O-N 3.21Å; A243-R246 PolarHBondContact O-N 3.16Å; R246-Y248 PolarHBondContact O-N 3.42Å; R246-R249 PolarHBondContact O-N 3.32Å; R246-T250 PolarHBondContact O-N 3.47Å; R246-T250 VanDerWaalsContact O-N 3.07Å; R246-T250 PolarHBondContact O-OG1 3.1Å; R246-T250 VanDerWaalsContact O-OG1 3.11Å |
| 247 | G | 94.2 | Very high | 89.7 | Confident | 18 Ų | 18 | 115.9 Ų | 115.9 | 19% | 0.186 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -61.7 | -41.3 | 175 | 0 | 0 | 0 | 0 | 0 | 113.4 | A243 T244 F245 T250 R251 | A243-G247 PolarHBondContact O-N 2.87Å; T244-G247 PolarHBondContact O-N 3.08Å; F245-G247 VanDerWaalsContact C-N 3.34Å; F245-G247 PolarHBondContact O-N 2.94Å; G247-T250 PolarHBondContact O-N 3.48Å; G247-R251 WeakPolarHBondContact O-CG 3.24Å; G247-R251 VanDerWaalsContact O-CZ 3.31Å; G247-R251 PolarHBondContact O-N 2.7Å; G247-R251 PolarHBondContact O-NE 3.11Å |
| 248 | Y | 93.9 | Very high | 89.9 | Confident | 122 Ų | 122 | 119.5 Ų | 119.5 | 48% | 0.478 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -62 | -45.2 | 175.8 | 169.8 | -97 | 0 | 0 | 0 | 111.7 | T244 F245 R246 T250 R251 R252 | T244-Y248 WeakPolarHBondContact O-CB 3.28Å; T244-Y248 PolarHBondContact O-N 3.12Å; F245-Y248 PolarHBondContact O-N 2.88Å; R246-Y248 PolarHBondContact O-N 3.42Å; Y248-T250 VanDerWaalsContact C-N 3.33Å; Y248-T250 PolarHBondContact O-N 3.14Å; Y248-R251 PolarHBondContact O-N 3.46Å; Y248-R252 WeakPolarHBondContact O-CB 3.42Å; Y248-R252 PolarHBondContact O-N 3.19Å |
| 249 | R | 90.8 | Very high | 89.8 | Confident | 136 Ų | 136 | 123.8 Ų | 123.8 | 51% | 0.513 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -59.5 | -42.8 | 176.1 | -74.9 | -174.8 | 67.3 | 156.1 | 3.2 | 112.3 | F245 R246 H253 | F245-R249 HydrophobicContact CD1-CG 4.4Å; F245-R249 VanDerWaalsContact CE1-CD 3.43Å; F245-R249 HydrophobicContact CE1-CG 4.07Å; F245-R249 HydrophobicContact CE2-CG 4.42Å; F245-R249 HydrophobicContact CZ-CG 4.07Å; F245-R249 WeakPolarHBondContact O-CG 3.38Å; F245-R249 PolarHBondContact O-N 3.1Å; R246-R249 PolarHBondContact O-N 3.32Å; R249-H253 PolarHBondContact O-ND1 3.33Å |
| 250 | T | 90.7 | Very high | 89.8 | Confident | 92 Ų | 92 | 126.6 Ų | 126.6 | 56% | 0.564 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63.5 | -46.7 | 176.2 | -55.9 | 0 | 0 | 0 | 0 | 110.9 | R246 G247 Y248 R252 H253 | R246-T250 PolarHBondContact O-N 3.47Å; R246-T250 VanDerWaalsContact O-N 3.07Å; R246-T250 PolarHBondContact O-OG1 3.1Å; R246-T250 VanDerWaalsContact O-OG1 3.11Å; G247-T250 PolarHBondContact O-N 3.48Å; Y248-T250 VanDerWaalsContact C-N 3.33Å; Y248-T250 PolarHBondContact O-N 3.14Å; T250-R252 VanDerWaalsContact C-N 3.31Å; T250-R252 PolarHBondContact O-N 3.36Å; T250-H253 PolarHBondContact O-N 3.32Å |
| 251 | R | 92.6 | Very high | 89.7 | Confident | 156 Ų | 156 | 126.6 Ų | 126.6 | 59% | 0.589 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -67.9 | -27.4 | -177.7 | -73.1 | -177.1 | -65.5 | -91.6 | 1.7 | 114.2 | G247 Y248 H253 L254 | G247-R251 WeakPolarHBondContact O-CG 3.24Å; G247-R251 VanDerWaalsContact O-CZ 3.31Å; G247-R251 PolarHBondContact O-N 2.7Å; G247-R251 PolarHBondContact O-NE 3.11Å; Y248-R251 PolarHBondContact O-N 3.46Å; R251-H253 VanDerWaalsContact C-N 3.25Å; R251-H253 PolarHBondContact O-N 3.14Å; R251-L254 HydrophobicContact CG-CD1 4.41Å; R251-L254 PolarHBondContact O-N 2.8Å |
| 252 | R | 89.9 | Confident | 89.5 | Confident | 142 Ų | 142 | 127.3 Ų | 127.3 | 54% | 0.536 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -66.8 | -23.6 | -179.9 | -165.1 | 178.7 | 69.7 | -161.9 | 4 | 113.8 | Y248 T250 | Y248-R252 WeakPolarHBondContact O-CB 3.42Å; Y248-R252 PolarHBondContact O-N 3.19Å; T250-R252 VanDerWaalsContact C-N 3.31Å; T250-R252 PolarHBondContact O-N 3.36Å |
| 253 | H | 84.1 | Confident | 89.1 | Confident | 136 Ų | 136 | 126.9 Ų | 126.9 | 63% | 0.63 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.1 | 2.2 | -179.7 | -56.8 | 88.3 | 0 | 0 | 0 | 112.9 | R249 T250 R251 | R249-H253 PolarHBondContact O-ND1 3.33Å; T250-H253 PolarHBondContact O-N 3.32Å; R251-H253 VanDerWaalsContact C-N 3.25Å; R251-H253 PolarHBondContact O-N 3.14Å |
| 254 | L | 82.6 | Confident | 88.8 | Confident | 112 Ų | 112 | 131.9 Ų | 131.9 | 59% | 0.586 | 61% | 0.606 | S | S | * | * | S | Bend | trans | -79.7 | 130.2 | 170.9 | -70.3 | 164.3 | 0 | 0 | 0 | 108.3 | R251 | R251-L254 HydrophobicContact CG-CD1 4.41Å; R251-L254 PolarHBondContact O-N 2.8Å |
| 255 | P | 77.9 | Confident | 88.2 | Confident | 121 Ų | 121 | 135.3 Ų | 135.3 | 79% | 0.786 | 61% | 0.61 | S | S | * | * | trans | -59.3 | 141.8 | 170.4 | 25.3 | -31.3 | 0 | 0 | 0 | 109.4 | ||||
| 256 | K | 73.3 | Confident | 87.5 | Confident | 283 Ų | 283 | 137.2 Ų | 137.2 | 100% | 1.23 | 62% | 0.62 | S | S | * | * | trans | -65.5 | 0 | 173.3 | -78.1 | -176.5 | 177.5 | 177 | 0 | 111.4 |
Retrieved 256 of 256 residues in 104.8 ms
(Link to these results)