| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 35.7 | Very low | 33.2 | Very low | 247 Ų | 247 | 143.5 Ų | 143.5 | 100% | 1.217 | 75% | 0.75 | S | S | * | * | 0 | 144.4 | 0 | -164.8 | 174.2 | -83.6 | 0 | 0 | 107.9 | |||||
| 2 | V | 25.8 | Very low | 33.2 | Very low | 119 Ų | 119 | 144 Ų | 144 | 72% | 0.721 | 75% | 0.754 | S | S | * | * | trans | -76 | 133.5 | -152.6 | 170 | 0 | 0 | 0 | 0 | 113 | ||||
| 3 | V | 29.9 | Very low | 33.6 | Very low | 111 Ų | 111 | 146.3 Ų | 146.3 | 67% | 0.673 | 77% | 0.765 | S | S | * | * | 25.9 | 134.6 | 128.5 | -155.5 | 0 | 0 | 0 | 0 | 118.2 | |||||
| 4 | L | 30.4 | Very low | 33.6 | Very low | 133 Ų | 133 | 146.1 Ų | 146.1 | 70% | 0.696 | 76% | 0.763 | S | S | * | * | 153.3 | 121.3 | 116.1 | -101.1 | 117 | 0 | 0 | 0 | 113.7 | |||||
| 5 | T | 34.8 | Very low | 34.1 | Very low | 99 Ų | 99 | 147.5 Ų | 147.5 | 61% | 0.607 | 77% | 0.77 | S | S | * | * | 71.4 | 123.2 | 123 | 64.7 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 6 | N | 33.6 | Very low | 34.3 | Very low | 127 Ų | 127 | 148 Ų | 148 | 68% | 0.679 | 77% | 0.772 | S | S | * | * | 76.4 | 131.5 | 113.6 | -67.5 | 0.4 | 0 | 0 | 0 | 122.2 | |||||
| 7 | N | 33.3 | Very low | 34.4 | Very low | 135 Ų | 135 | 149.4 Ų | 149.4 | 72% | 0.722 | 77% | 0.774 | S | S | * | * | trans | 72.2 | 112.5 | 130.8 | -65.2 | -0.9 | 0 | 0 | 0 | 117.4 | ||||
| 8 | N | 34.6 | Very low | 34.9 | Very low | 139 Ų | 139 | 151.6 Ų | 151.6 | 74% | 0.743 | 78% | 0.78 | S | S | * | * | 80 | 110.3 | 78.1 | -153.9 | 53.1 | 0 | 0 | 0 | 109.4 | |||||
| 9 | E | 33.6 | Very low | 35 | Very low | 171 Ų | 171 | 155.8 Ų | 155.8 | 80% | 0.799 | 79% | 0.785 | S | S | * | * | trans | 172.7 | 112.5 | 135.7 | -93.1 | 165.1 | -157.7 | 0 | 0 | 109.9 | ||||
| 10 | E | 36.8 | Very low | 35.5 | Very low | 154 Ų | 154 | 158.2 Ų | 158.2 | 72% | 0.72 | 79% | 0.79 | S | S | * | * | trans | 41 | 112.6 | 130.7 | -62.2 | -156.8 | 137.8 | 0 | 0 | 118.4 | ||||
| 11 | Q | 36.9 | Very low | 35.4 | Very low | 144 Ų | 144 | 156.3 Ų | 156.3 | 67% | 0.673 | 79% | 0.79 | S | S | * | * | 111.3 | 127.7 | 88.8 | -88.2 | -177.7 | 43.5 | 0 | 0 | 106.1 | |||||
| 12 | D | 32.5 | Very low | 35.6 | Very low | 149 Ų | 149 | 150.3 Ų | 150.3 | 80% | 0.797 | 77% | 0.768 | S | S | * | * | trans | 176.9 | 117.1 | 131.6 | -90.8 | -23.4 | 0 | 0 | 0 | 110.5 | ||||
| 13 | I | 39.3 | Very low | 36.6 | Very low | 174 Ų | 174 | 149.8 Ų | 149.8 | 89% | 0.892 | 77% | 0.769 | S | S | * | * | trans | -87.3 | 112.4 | 171.9 | -64 | 170.3 | 0 | 0 | 0 | 106.5 | ||||
| 14 | I | 33.9 | Very low | 37.2 | Very low | 144 Ų | 144 | 152.4 Ų | 152.4 | 74% | 0.738 | 78% | 0.778 | S | S | * | * | trans | -132.5 | 132.7 | 165.7 | -60 | -178.6 | 0 | 0 | 0 | 110.6 | ||||
| 15 | L | 40.1 | Very low | 37.8 | Very low | 167 Ų | 167 | 151.9 Ų | 151.9 | 87% | 0.874 | 78% | 0.783 | S | S | * | * | trans | -50.2 | 132.9 | 178.9 | -71.5 | 137.6 | 0 | 0 | 0 | 114.5 | ||||
| 16 | I | 37.9 | Very low | 38 | Very low | 155 Ų | 155 | 154.7 Ų | 154.7 | 80% | 0.795 | 79% | 0.794 | S | S | * | * | trans | -136.1 | 102.9 | 156.4 | -58.3 | -179.9 | 0 | 0 | 0 | 109.2 | ||||
| 17 | E | 35.6 | Very low | 38.5 | Very low | 172 Ų | 172 | 153.9 Ų | 153.9 | 80% | 0.804 | 80% | 0.799 | S | S | * | * | 51.6 | 140.6 | 118.4 | -146.5 | 162.3 | -174.1 | 0 | 0 | 121 | R19 | E17-R19 PolarHBondContact O-N 2.75Š| |||
| 18 | E | 43.1 | Very low | 39.1 | Very low | 189 Ų | 189 | 152.3 Ų | 152.3 | 88% | 0.883 | 80% | 0.796 | S | S | * | * | trans | -41.6 | 115.7 | -170.5 | -61.2 | -177.6 | 144.3 | 0 | 0 | 115.7 | ||||
| 19 | R | 37.3 | Very low | 39.7 | Very low | 232 Ų | 232 | 150 Ų | 150 | 88% | 0.875 | 80% | 0.796 | S | S | * | * | trans | -107.2 | 103.1 | 151.9 | -73.4 | -172.9 | 179.8 | 139.6 | 1.6 | 109.7 | E17 C21 | E17-R19 PolarHBondContact O-N 2.75Å; R19-C21 PolarHBondContact O-N 2.75Å | ||
| 20 | K | 44.6 | Very low | 40.6 | Very low | 203 Ų | 203 | 150.1 Ų | 150.1 | 88% | 0.883 | 79% | 0.794 | S | S | * | * | trans | -50.2 | 95.1 | 165 | -163.4 | 177.4 | -171.3 | 177.1 | 0 | 109.7 | ||||
| 21 | C | 34.5 | Very low | 41.7 | Very low | 119 Ų | 119 | 154.6 Ų | 154.6 | 80% | 0.804 | 80% | 0.804 | S | S | * | * | trans | -89.9 | 110.4 | 170.3 | -76.6 | 0 | 0 | 0 | 0 | 109.3 | R19 S23 | R19-C21 PolarHBondContact O-N 2.75Å; C21-S23 PolarHBondContact O-N 3.16Å | ||
| 22 | T | 40.3 | Very low | 42.4 | Very low | 121 Ų | 121 | 151.4 Ų | 151.4 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | trans | -63.1 | 118.7 | 169.5 | 39.3 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 23 | S | 45.8 | Very low | 43.7 | Very low | 108 Ų | 108 | 146.6 Ų | 146.6 | 76% | 0.755 | 77% | 0.773 | S | S | * | * | trans | 46.3 | 101.5 | 151.6 | 61.8 | 0 | 0 | 0 | 0 | 118.7 | C21 | C21-S23 PolarHBondContact O-N 3.16Š| ||
| 24 | L | 42.9 | Very low | 44.6 | Very low | 165 Ų | 165 | 143.7 Ų | 143.7 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | trans | -97.5 | 129.6 | 146.6 | -73.2 | 169.4 | 0 | 0 | 0 | 108.4 | N26 | L24-N26 PolarHBondContact O-N 3.04Š| ||
| 25 | P | 43.5 | Very low | 45.8 | Very low | 123 Ų | 123 | 141.8 Ų | 141.8 | 80% | 0.799 | 76% | 0.76 | S | S | * | * | trans | -67.2 | 122.9 | 175.9 | 25.9 | -30.6 | 0 | 0 | 0 | 109.6 | S27 | P25-S27 PolarHBondContact O-N 3.3Š| ||
| 26 | N | 38 | Very low | 46.9 | Very low | 157 Ų | 157 | 140.5 Ų | 140.5 | 84% | 0.84 | 75% | 0.748 | S | S | * | * | trans | -42.8 | 122.3 | 169.3 | -81.6 | -28.7 | 0 | 0 | 0 | 111.1 | L24 | L24-N26 PolarHBondContact O-N 3.04Š| ||
| 27 | S | 45.2 | Very low | 48.3 | Very low | 111 Ų | 111 | 139 Ų | 139 | 78% | 0.776 | 74% | 0.735 | S | S | * | * | trans | -57.4 | 121.5 | 166.5 | -159 | 0 | 0 | 0 | 0 | 108.7 | P25 A29 | P25-S27 PolarHBondContact O-N 3.3Å; S27-A29 PolarHBondContact O-N 3.14Å | ||
| 28 | P | 44.9 | Very low | 49.8 | Very low | 101 Ų | 101 | 137.9 Ų | 137.9 | 66% | 0.656 | 73% | 0.728 | S | S | * | * | trans | -82.5 | 80.3 | -179.6 | 34 | -30.9 | 0 | 0 | 0 | 107.6 | K30 | P28-K30 HydrophobicContact CB-CG 4.4Å; P28-K30 PolarHBondContact O-N 3.44Å | ||
| 29 | A | 47.8 | Very low | 51.1 | Low | 91 Ų | 91 | 133.8 Ų | 133.8 | 75% | 0.752 | 71% | 0.708 | S | S | * | * | trans | -64.7 | 80.1 | 154.7 | 0 | 0 | 0 | 0 | 0 | 106.8 | S27 R31 | S27-A29 PolarHBondContact O-N 3.14Å; A29-R31 VanDerWaalsContact C-N 3.32Å; A29-R31 PolarHBondContact O-N 2.93Å | ||
| 30 | K | 52.5 | Low | 52.7 | Low | 173 Ų | 173 | 127.8 Ų | 127.8 | 75% | 0.752 | 69% | 0.689 | S | S | * | * | trans | -60.5 | 100.2 | 172.8 | -75.4 | -179.1 | -179.9 | 175.5 | 0 | 105.9 | P28 V32 | P28-K30 HydrophobicContact CB-CG 4.4Å; P28-K30 PolarHBondContact O-N 3.44Å; K30-V32 HydrophobicContact CB-CG2 4.25Å; K30-V32 WeakPolarHBondContact O-CG2 3.31Å; K30-V32 PolarHBondContact O-N 2.8Å | ||
| 31 | R | 58.2 | Low | 54 | Low | 249 Ų | 249 | 123.7 Ų | 123.7 | 94% | 0.94 | 67% | 0.671 | S | S | * | * | trans | -62.8 | 86.5 | 162.5 | -68.9 | -172.8 | -173.6 | -176.6 | 2.7 | 106.5 | A29 S33 | A29-R31 VanDerWaalsContact C-N 3.32Å; A29-R31 PolarHBondContact O-N 2.93Å; R31-S33 PolarHBondContact O-N 3.09Å | ||
| 32 | V | 52.8 | Low | 55.5 | Low | 77 Ų | 77 | 121.3 Ų | 121.3 | 47% | 0.467 | 65% | 0.65 | S | S | . | * | trans | -68.1 | 118.2 | 174 | -176 | 0 | 0 | 0 | 0 | 105.8 | K30 K36 K37 | K30-V32 HydrophobicContact CB-CG2 4.25Å; K30-V32 WeakPolarHBondContact O-CG2 3.31Å; K30-V32 PolarHBondContact O-N 2.8Å; V32-K36 HydrophobicContact CG1-CB 3.3Å; V32-K37 HydrophobicContact CG1-CB 4.31Å | ||
| 33 | S | 59.4 | Low | 56.7 | Low | 48 Ų | 48 | 118.7 Ų | 118.7 | 34% | 0.336 | 63% | 0.632 | S | S | . | * | trans | -53.9 | 148.2 | 177.9 | 59.5 | 0 | 0 | 0 | 0 | 110.3 | R31 T35 K36 K37 | R31-S33 PolarHBondContact O-N 3.09Å; S33-T35 PolarHBondContact O-N 2.7Å; S33-K36 WeakPolarHBondContact O-CA 3.27Å; S33-K36 PolarHBondContact O-N 2.72Å; S33-K36 WeakPolarHBondContact OG-CG 3.44Å; S33-K36 PolarHBondContact OG-N 2.84Å; S33-K37 PolarHBondContact O-N 3.45Å | ||
| 34 | P | 59.4 | Low | 57.6 | Low | 113 Ų | 113 | 117.5 Ų | 117.5 | 73% | 0.734 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -50.8 | -35.8 | -179.7 | -26.9 | 33.8 | 0 | 0 | 0 | 112.7 | K37 K38 | P34-K37 PolarHBondContact O-N 3.08Å; P34-K38 WeakPolarHBondContact O-CB 3.09Å; P34-K38 PolarHBondContact O-N 2.83Å |
| 35 | T | 58.3 | Low | 58.4 | Low | 103 Ų | 103 | 112.7 Ų | 112.7 | 63% | 0.632 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -63.6 | -43.8 | 174.6 | -39.6 | 0 | 0 | 0 | 0 | 112.8 | S33 K37 K38 Q39 | S33-T35 PolarHBondContact O-N 2.7Å; T35-K37 VanDerWaalsContact C-N 3.35Å; T35-K38 PolarHBondContact O-N 3.23Å; T35-Q39 WeakPolarHBondContact O-CB 3.33Å; T35-Q39 PolarHBondContact O-N 2.81Å |
| 36 | K | 62.6 | Low | 59.1 | Low | 141 Ų | 141 | 110.8 Ų | 110.8 | 61% | 0.613 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -70.5 | -31.6 | 176.8 | -75.2 | 177 | 179.6 | 176.8 | 0 | 111.9 | V32 S33 F40 | V32-K36 HydrophobicContact CG1-CB 3.3Å; S33-K36 WeakPolarHBondContact O-CA 3.27Å; S33-K36 PolarHBondContact O-N 2.72Å; S33-K36 WeakPolarHBondContact OG-CG 3.44Å; S33-K36 PolarHBondContact OG-N 2.84Å; K36-F40 WeakPolarHBondContact O-CB 3.39Å; K36-F40 PolarHBondContact O-N 3.15Å |
| 37 | K | 67.1 | Low | 60 | Low | 123 Ų | 123 | 112 Ų | 112 | 54% | 0.535 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -70.3 | -41.7 | 174.1 | -166.7 | 174.2 | -177.1 | 180 | 0 | 111.2 | V32 S33 P34 T35 F40 F41 | V32-K37 HydrophobicContact CG1-CB 4.31Å; S33-K37 PolarHBondContact O-N 3.45Å; P34-K37 PolarHBondContact O-N 3.08Å; T35-K37 VanDerWaalsContact C-N 3.35Å; K37-F40 WeakPolarHBondContact O-CB 3.46Å; K37-F40 PolarHBondContact O-N 2.66Å; K37-F41 HydrophobicContact CD-CE2 4.32Å; K37-F41 HydrophobicContact CG-CD2 4.13Å; K37-F41 HydrophobicContact CG-CE2 3.67Å; K37-F41 WeakPolarHBondContact O-CD2 3.37Å; K37-F41 PolarHBondContact O-N 3Å; K37-F41 VanDerWaalsContact O-N 3.09Å |
| 38 | K | 67.2 | Low | 60.5 | Low | 148 Ų | 148 | 112.8 Ų | 112.8 | 64% | 0.643 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -61.8 | -45.1 | 171.5 | -170.1 | 178.9 | 177.9 | -179.5 | 0 | 111.4 | P34 T35 F40 F41 I42 | P34-K38 WeakPolarHBondContact O-CB 3.09Å; P34-K38 PolarHBondContact O-N 2.83Å; T35-K38 PolarHBondContact O-N 3.23Å; K38-F40 VanDerWaalsContact C-N 3.27Å; K38-F40 PolarHBondContact O-N 3.11Å; K38-F41 PolarHBondContact O-N 2.93Å; K38-I42 HydrophobicContact CG-CD1 3.85Å; K38-I42 WeakPolarHBondContact O-CB 3.37Å; K38-I42 VanDerWaalsContact O-CG1 3.24Å; K38-I42 WeakPolarHBondContact O-CG1 3.48Å; K38-I42 PolarHBondContact O-N 3.11Å |
| 39 | Q | 70.3 | Confident | 61.1 | Low | 103 Ų | 103 | 110 Ų | 110 | 48% | 0.481 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.1 | -36.8 | 175.2 | -152.5 | 77.2 | 8.5 | 0 | 0 | 112.1 | T35 N43 | T35-Q39 WeakPolarHBondContact O-CB 3.33Å; T35-Q39 PolarHBondContact O-N 2.81Å; Q39-N43 WeakPolarHBondContact O-CB 3.47Å; Q39-N43 PolarHBondContact O-N 2.86Å; Q39-N43 PolarHBondContact O-ND2 3.21Å; Q39-N43 VanDerWaalsContact O-ND2 3.17Å |
| 40 | F | 71.7 | Confident | 61.4 | Low | 106 Ų | 106 | 113.7 Ų | 113.7 | 47% | 0.465 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.5 | -48.5 | 176.4 | 176.9 | -92.7 | 0 | 0 | 0 | 111.8 | K36 K37 K38 N43 Q44 | K36-F40 WeakPolarHBondContact O-CB 3.39Å; K36-F40 PolarHBondContact O-N 3.15Å; K37-F40 WeakPolarHBondContact O-CB 3.46Å; K37-F40 PolarHBondContact O-N 2.66Å; K38-F40 VanDerWaalsContact C-N 3.27Å; K38-F40 PolarHBondContact O-N 3.11Å; F40-N43 PolarHBondContact O-N 3.32Å; F40-Q44 WeakPolarHBondContact O-CB 3.29Å; F40-Q44 PolarHBondContact O-N 3.35Å |
| 41 | F | 72 | Confident | 61.5 | Low | 117 Ų | 117 | 113.1 Ų | 113.1 | 51% | 0.513 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -68.2 | -36.8 | 177.7 | -71 | -64.6 | 0 | 0 | 0 | 112.9 | K37 K38 Q44 A45 | K37-F41 HydrophobicContact CD-CE2 4.32Å; K37-F41 HydrophobicContact CG-CD2 4.13Å; K37-F41 HydrophobicContact CG-CE2 3.67Å; K37-F41 WeakPolarHBondContact O-CD2 3.37Å; K37-F41 PolarHBondContact O-N 3Å; K37-F41 VanDerWaalsContact O-N 3.09Å; K38-F41 PolarHBondContact O-N 2.93Å; F41-Q44 PolarHBondContact O-N 3.42Å; F41-A45 WeakPolarHBondContact O-CB 3.33Å; F41-A45 PolarHBondContact O-N 3.49Å |
| 42 | I | 66.3 | Low | 61.2 | Low | 70 Ų | 70 | 104.7 Ų | 104.7 | 36% | 0.359 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.1 | -47.7 | 171.9 | -70 | 167.7 | 0 | 0 | 0 | 110.1 | K38 Q44 A45 I46 | K38-I42 HydrophobicContact CG-CD1 3.85Å; K38-I42 WeakPolarHBondContact O-CB 3.37Å; K38-I42 VanDerWaalsContact O-CG1 3.24Å; K38-I42 WeakPolarHBondContact O-CG1 3.48Å; K38-I42 PolarHBondContact O-N 3.11Å; I42-Q44 PolarHBondContact O-N 3.21Å; I42-A45 PolarHBondContact O-N 3.04Å; I42-I46 HydrophobicContact CG2-CD1 3.6Å; I42-I46 HydrophobicContact CG2-CG1 4.37Å; I42-I46 WeakPolarHBondContact O-CB 3.32Å; I42-I46 WeakPolarHBondContact O-CD1 3.46Å; I42-I46 WeakPolarHBondContact O-CG1 3.35Å; I42-I46 PolarHBondContact O-N 2.89Å |
| 43 | N | 63.9 | Low | 61.3 | Low | 66 Ų | 66 | 106.9 Ų | 106.9 | 35% | 0.353 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -68.8 | -22.8 | 178 | -71.2 | -22.7 | 0 | 0 | 0 | 113.3 | Q39 F40 R47 | Q39-N43 WeakPolarHBondContact O-CB 3.47Å; Q39-N43 PolarHBondContact O-N 2.86Å; Q39-N43 PolarHBondContact O-ND2 3.21Å; Q39-N43 VanDerWaalsContact O-ND2 3.17Å; F40-N43 PolarHBondContact O-N 3.32Å; N43-R47 WeakPolarHBondContact O-CB 3.49Å; N43-R47 WeakPolarHBondContact O-CG 3.46Å; N43-R47 PolarHBondContact O-N 3.33Å; N43-R47 PolarHBondContact O-NE 3.02Å |
| 44 | Q | 65 | Low | 61.1 | Low | 83 Ų | 83 | 113.6 Ų | 113.6 | 39% | 0.388 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -80.6 | -40 | 174.3 | -171.4 | 157.8 | 27.9 | 0 | 0 | 111.2 | F40 F41 I42 R47 N48 | F40-Q44 WeakPolarHBondContact O-CB 3.29Å; F40-Q44 PolarHBondContact O-N 3.35Å; F41-Q44 PolarHBondContact O-N 3.42Å; I42-Q44 PolarHBondContact O-N 3.21Å; Q44-R47 PolarHBondContact O-N 3.24Å; Q44-N48 PolarHBondContact O-N 2.98Å; Q44-N48 VanDerWaalsContact O-N 3.16Å; Q44-N48 PolarHBondContact O-ND2 3.02Å |
| 45 | A | 60 | Low | 61.1 | Low | 63 Ų | 63 | 113.4 Ų | 113.4 | 52% | 0.521 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -65.6 | -41.3 | 173 | 0 | 0 | 0 | 0 | 0 | 111.8 | F41 I42 R47 N48 S49 | F41-A45 WeakPolarHBondContact O-CB 3.33Å; F41-A45 PolarHBondContact O-N 3.49Å; I42-A45 PolarHBondContact O-N 3.04Å; A45-R47 VanDerWaalsContact C-N 3.34Å; A45-R47 PolarHBondContact O-N 2.62Å; A45-N48 CarbonylContact O-C 3.57Å; A45-N48 PolarHBondContact O-N 2.91Å; A45-S49 WeakPolarHBondContact O-CB 3.5Å; A45-S49 PolarHBondContact O-N 2.71Å |
| 46 | I | 59.1 | Low | 61.2 | Low | 83 Ų | 83 | 112.1 Ų | 112.1 | 43% | 0.426 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.9 | -39.3 | 174.4 | -67.7 | 166.3 | 0 | 0 | 0 | 111.1 | I42 N48 S49 T52 | I42-I46 HydrophobicContact CG2-CD1 3.6Å; I42-I46 HydrophobicContact CG2-CG1 4.37Å; I42-I46 WeakPolarHBondContact O-CB 3.32Å; I42-I46 WeakPolarHBondContact O-CD1 3.46Å; I42-I46 WeakPolarHBondContact O-CG1 3.35Å; I42-I46 PolarHBondContact O-N 2.89Å; I46-N48 PolarHBondContact O-N 3.29Å; I46-S49 PolarHBondContact O-N 3.29Å; I46-S49 PolarHBondContact O-OG 3.32Å; I46-T52 PolarHBondContact O-OG1 3.01Å |
| 47 | R | 57.2 | Low | 61.7 | Low | 183 Ų | 183 | 107.8 Ų | 107.8 | 69% | 0.691 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -66.1 | -25.6 | 177 | -85.3 | -175.1 | -98.2 | -172.1 | -7.5 | 113.7 | N43 Q44 A45 | N43-R47 WeakPolarHBondContact O-CB 3.49Å; N43-R47 WeakPolarHBondContact O-CG 3.46Å; N43-R47 PolarHBondContact O-N 3.33Å; N43-R47 PolarHBondContact O-NE 3.02Å; Q44-R47 PolarHBondContact O-N 3.24Å; A45-R47 VanDerWaalsContact C-N 3.34Å; A45-R47 PolarHBondContact O-N 2.62Å |
| 48 | N | 54 | Low | 62.1 | Low | 128 Ų | 128 | 110 Ų | 110 | 68% | 0.684 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.7 | 2.3 | 179.9 | -69.1 | -23.7 | 0 | 0 | 0 | 113.2 | Q44 A45 I46 | Q44-N48 PolarHBondContact O-N 2.98Å; Q44-N48 VanDerWaalsContact O-N 3.16Å; Q44-N48 PolarHBondContact O-ND2 3.02Å; A45-N48 CarbonylContact O-C 3.57Å; A45-N48 PolarHBondContact O-N 2.91Å; I46-N48 PolarHBondContact O-N 3.29Å |
| 49 | S | 57.4 | Low | 62.6 | Low | 42 Ų | 42 | 110.1 Ų | 110.1 | 29% | 0.294 | 57% | 0.573 | S | S | . | * | trans | -88.2 | 122.2 | 177 | 69.6 | 0 | 0 | 0 | 0 | 110.5 | A45 I46 L51 T52 | A45-S49 WeakPolarHBondContact O-CB 3.5Å; A45-S49 PolarHBondContact O-N 2.71Å; I46-S49 PolarHBondContact O-N 3.29Å; I46-S49 PolarHBondContact O-OG 3.32Å; S49-L51 PolarHBondContact O-N 3.4Å; S49-L51 VanDerWaalsContact O-N 3.13Å; S49-T52 PolarHBondContact OG-OG1 2.99Å; S49-T52 VanDerWaalsContact OG-OG1 3.12Å | ||
| 50 | D | 55.5 | Low | 63 | Low | 169 Ų | 169 | 107.2 Ų | 107.2 | 90% | 0.904 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65 | -9.3 | 170.8 | -69.6 | -41.4 | 0 | 0 | 0 | 113.2 | ||
| 51 | L | 55.1 | Low | 63.4 | Low | 161 Ų | 161 | 106.5 Ų | 106.5 | 84% | 0.843 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -8 | -174.6 | -62.5 | 174.8 | 0 | 0 | 0 | 114.6 | S49 | S49-L51 PolarHBondContact O-N 3.4Å; S49-L51 VanDerWaalsContact O-N 3.13Å |
| 52 | T | 51.6 | Low | 63.9 | Low | 72 Ų | 72 | 109.5 Ų | 109.5 | 44% | 0.442 | 57% | 0.569 | S | S | . | * | S | Bend | trans | -113.8 | 106.2 | 171.8 | 42.7 | 0 | 0 | 0 | 0 | 110.7 | I46 S49 R54 | I46-T52 PolarHBondContact O-OG1 3.01Å; S49-T52 PolarHBondContact OG-OG1 2.99Å; S49-T52 VanDerWaalsContact OG-OG1 3.12Å; T52-R54 PolarHBondContact O-N 3.12Å |
| 53 | P | 54.6 | Low | 64.9 | Low | 123 Ų | 123 | 114.2 Ų | 114.2 | 80% | 0.799 | 58% | 0.583 | S | S | * | * | trans | -63.8 | 116.5 | 175.7 | 24.3 | -29.2 | 0 | 0 | 0 | 108 | A55 | P53-A55 PolarHBondContact O-N 3.38Š| ||
| 54 | R | 54.4 | Low | 65.8 | Low | 188 Ų | 188 | 114.6 Ų | 114.6 | 71% | 0.709 | 58% | 0.583 | S | S | * | * | trans | -51.4 | 146.9 | 168.8 | -55.1 | -178.4 | 74.6 | -176.4 | 0.9 | 107.3 | T52 K56 | T52-R54 PolarHBondContact O-N 3.12Å; R54-K56 HydrophobicContact CB-CD 3.94Å; R54-K56 HydrophobicContact CB-CG 4.12Å; R54-K56 WeakPolarHBondContact O-CG 3.38Å; R54-K56 PolarHBondContact O-N 3.46Å | ||
| 55 | A | 59.8 | Low | 66.7 | Low | 110 Ų | 110 | 115.2 Ų | 115.2 | 91% | 0.909 | 59% | 0.585 | S | S | * | * | trans | -63.6 | 84.9 | 155.5 | 0 | 0 | 0 | 0 | 0 | 107.1 | P53 G57 | P53-A55 PolarHBondContact O-N 3.38Å; A55-G57 PolarHBondContact O-N 3.43Å | ||
| 56 | K | 60.9 | Low | 68.1 | Low | 75 Ų | 75 | 116.6 Ų | 116.6 | 33% | 0.326 | 58% | 0.584 | S | S | . | * | trans | -72.5 | 113.9 | -179.6 | -62 | -79.7 | 177.6 | 171.8 | 0 | 105.2 | R54 S60 Q61 | R54-K56 HydrophobicContact CB-CD 3.94Å; R54-K56 HydrophobicContact CB-CG 4.12Å; R54-K56 WeakPolarHBondContact O-CG 3.38Å; R54-K56 PolarHBondContact O-N 3.46Å; K56-S60 WeakPolarHBondContact CD-OG 3.25Å; K56-Q61 HydrophobicContact CB-CB 4.33Å | ||
| 57 | G | 72.8 | Confident | 69.4 | Low | 51 Ų | 51 | 116.1 Ų | 116.1 | 53% | 0.526 | 59% | 0.588 | S | S | . | * | trans | -55.9 | 157.1 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | A55 K59 S60 Q61 | A55-G57 PolarHBondContact O-N 3.43Å; G57-K59 CarbonylContact O-C 3.58Å; G57-K59 PolarHBondContact O-N 3.36Å; G57-S60 WeakPolarHBondContact O-CA 3.45Å; G57-S60 PolarHBondContact O-N 3.48Å; G57-Q61 PolarHBondContact O-N 3.05Å | ||
| 58 | K | 75.1 | Confident | 70.7 | Confident | 169 Ų | 169 | 114.6 Ų | 114.6 | 74% | 0.735 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -43.2 | -38.9 | -175.4 | -67.4 | -177.3 | 178.3 | 179.9 | 0 | 113.7 | R62 | K58-R62 WeakPolarHBondContact O-CB 3.45Å; K58-R62 VanDerWaalsContact O-CG 3.26Å; K58-R62 WeakPolarHBondContact O-CG 3.48Å; K58-R62 PolarHBondContact O-N 3.32Å |
| 59 | K | 78.5 | Confident | 72.2 | Confident | 151 Ų | 151 | 115.5 Ų | 115.5 | 66% | 0.657 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -64.4 | -42.7 | 176.2 | -173.8 | 174.4 | -176.6 | 173.8 | 0 | 113.8 | G57 R63 | G57-K59 CarbonylContact O-C 3.58Å; G57-K59 PolarHBondContact O-N 3.36Å; K59-R63 WeakPolarHBondContact O-CG 3.48Å; K59-R63 PolarHBondContact O-N 2.87Å; K59-R63 VanDerWaalsContact O-N 3.1Å |
| 60 | S | 78.4 | Confident | 73.5 | Confident | 42 Ų | 42 | 117.7 Ų | 117.7 | 29% | 0.294 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -76.5 | -29.3 | 179.2 | -169.9 | 0 | 0 | 0 | 0 | 112.3 | K56 G57 Q64 | K56-S60 WeakPolarHBondContact CD-OG 3.25Å; G57-S60 WeakPolarHBondContact O-CA 3.45Å; G57-S60 PolarHBondContact O-N 3.48Å; S60-Q64 PolarHBondContact O-N 2.81Å; S60-Q64 VanDerWaalsContact O-N 3.12Å |
| 61 | Q | 79.6 | Confident | 74.5 | Confident | 91 Ų | 91 | 111.5 Ų | 111.5 | 43% | 0.425 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.8 | -49.2 | 170.7 | 179.5 | 175.9 | 7.4 | 0 | 0 | 110.2 | K56 G57 R63 Q64 E65 | K56-Q61 HydrophobicContact CB-CB 4.33Å; G57-Q61 PolarHBondContact O-N 3.05Å; Q61-R63 VanDerWaalsContact C-N 3.27Å; Q61-R63 PolarHBondContact O-N 2.99Å; Q61-Q64 WeakPolarHBondContact O-CB 3.48Å; Q61-Q64 PolarHBondContact O-N 2.81Å; Q61-E65 HydrophobicContact CG-CG 4.33Å; Q61-E65 WeakPolarHBondContact CG-OE1 3.41Å; Q61-E65 PolarHBondContact NE2-OE1 3.18Å; Q61-E65 WeakPolarHBondContact O-CG 3.34Å; Q61-E65 PolarHBondContact O-N 3.38Å |
| 62 | R | 82.8 | Confident | 75.6 | Confident | 179 Ų | 179 | 108.1 Ų | 108.1 | 68% | 0.675 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -55 | -39.4 | 173.4 | -74.9 | 176.4 | -176.3 | -172.7 | 0.3 | 113 | K58 N66 | K58-R62 WeakPolarHBondContact O-CB 3.45Å; K58-R62 VanDerWaalsContact O-CG 3.26Å; K58-R62 WeakPolarHBondContact O-CG 3.48Å; K58-R62 PolarHBondContact O-N 3.32Å; R62-N66 WeakPolarHBondContact O-CB 3.32Å; R62-N66 PolarHBondContact O-N 3.15Å |
| 63 | R | 86.4 | Confident | 76.7 | Confident | 170 Ų | 170 | 107.9 Ų | 107.9 | 64% | 0.642 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -64.5 | -40.7 | 174.8 | -75.3 | 178 | 178.9 | -166.8 | -3.6 | 112.5 | K59 Q61 S67 | K59-R63 WeakPolarHBondContact O-CG 3.48Å; K59-R63 PolarHBondContact O-N 2.87Å; K59-R63 VanDerWaalsContact O-N 3.1Å; Q61-R63 VanDerWaalsContact C-N 3.27Å; Q61-R63 PolarHBondContact O-N 2.99Å; R63-S67 WeakPolarHBondContact O-CB 3.28Å; R63-S67 PolarHBondContact O-N 3.15Å |
| 64 | Q | 82.6 | Confident | 76.9 | Confident | 74 Ų | 74 | 107.8 Ų | 107.8 | 35% | 0.346 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -70.8 | -42.2 | 178.3 | -174 | 177.9 | 26.6 | 0 | 0 | 111.6 | S60 Q61 S67 R68 | S60-Q64 PolarHBondContact O-N 2.81Å; S60-Q64 VanDerWaalsContact O-N 3.12Å; Q61-Q64 WeakPolarHBondContact O-CB 3.48Å; Q61-Q64 PolarHBondContact O-N 2.81Å; Q64-S67 PolarHBondContact O-N 2.98Å; Q64-R68 WeakPolarHBondContact O-CB 3.43Å; Q64-R68 WeakPolarHBondContact O-CG 3.45Å; Q64-R68 PolarHBondContact O-N 3.42Å |
| 65 | E | 85.3 | Confident | 77 | Confident | 95 Ų | 95 | 105.4 Ų | 105.4 | 44% | 0.444 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.5 | -44.6 | 174 | -72.2 | 167.1 | 178.7 | 0 | 0 | 110.8 | Q61 R68 Y69 | Q61-E65 HydrophobicContact CG-CG 4.33Å; Q61-E65 WeakPolarHBondContact CG-OE1 3.41Å; Q61-E65 PolarHBondContact NE2-OE1 3.18Å; Q61-E65 WeakPolarHBondContact O-CG 3.34Å; Q61-E65 PolarHBondContact O-N 3.38Å; E65-R68 PolarHBondContact O-N 3.11Å; E65-Y69 VanDerWaalsContact O-CB 3.26Å; E65-Y69 WeakPolarHBondContact O-CB 3.33Å; E65-Y69 PolarHBondContact O-N 2.89Å |
| 66 | N | 89.9 | Confident | 76.8 | Confident | 92 Ų | 92 | 108.9 Ų | 108.9 | 49% | 0.492 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62 | -44.2 | 174.4 | -173.8 | -84.8 | 0 | 0 | 0 | 111.8 | R62 R68 Y69 L70 | R62-N66 WeakPolarHBondContact O-CB 3.32Å; R62-N66 PolarHBondContact O-N 3.15Å; N66-R68 VanDerWaalsContact C-N 3.35Å; N66-R68 PolarHBondContact O-N 2.63Å; N66-Y69 WeakPolarHBondContact O-CB 3.39Å; N66-Y69 PolarHBondContact O-N 2.85Å; N66-L70 WeakPolarHBondContact O-CG 3.28Å; N66-L70 PolarHBondContact O-N 3.33Å; N66-L70 WeakPolarHBondContact OD1-CD1 3.42Å |
| 67 | S | 85.8 | Confident | 76.2 | Confident | 74 Ų | 74 | 110.9 Ų | 110.9 | 52% | 0.517 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.5 | -41.3 | 175.9 | -170.8 | 0 | 0 | 0 | 0 | 112.4 | R63 Q64 A71 | R63-S67 WeakPolarHBondContact O-CB 3.28Å; R63-S67 PolarHBondContact O-N 3.15Å; Q64-S67 PolarHBondContact O-N 2.98Å; S67-A71 WeakPolarHBondContact O-CB 3.17Å; S67-A71 PolarHBondContact O-N 3.44Å |
| 68 | R | 84.6 | Confident | 75 | Confident | 150 Ų | 150 | 114.5 Ų | 114.5 | 57% | 0.566 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.5 | -37.7 | 175.6 | -78.5 | -177.8 | 172.4 | 137.6 | -3 | 112.3 | Q64 E65 N66 A71 N72 | Q64-R68 WeakPolarHBondContact O-CB 3.43Å; Q64-R68 WeakPolarHBondContact O-CG 3.45Å; Q64-R68 PolarHBondContact O-N 3.42Å; E65-R68 PolarHBondContact O-N 3.11Å; N66-R68 VanDerWaalsContact C-N 3.35Å; N66-R68 PolarHBondContact O-N 2.63Å; R68-A71 PolarHBondContact O-N 3.2Å; R68-N72 WeakPolarHBondContact O-CB 3.47Å; R68-N72 PolarHBondContact O-N 3.02Å; R68-N72 PolarHBondContact O-ND2 2.9Å |
| 69 | Y | 84.9 | Confident | 73.3 | Confident | 147 Ų | 147 | 111.2 Ų | 111.2 | 58% | 0.576 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.6 | -45.7 | 175.4 | 177.6 | -98.2 | 0 | 0 | 0 | 111.1 | E65 N66 N72 L73 | E65-Y69 VanDerWaalsContact O-CB 3.26Å; E65-Y69 WeakPolarHBondContact O-CB 3.33Å; E65-Y69 PolarHBondContact O-N 2.89Å; N66-Y69 WeakPolarHBondContact O-CB 3.39Å; N66-Y69 PolarHBondContact O-N 2.85Å; Y69-N72 PolarHBondContact O-N 2.75Å; Y69-L73 HydrophobicContact CD1-CD1 3.97Å; Y69-L73 HydrophobicContact CD2-CD1 4.17Å; Y69-L73 HydrophobicContact CE1-CD1 3.53Å; Y69-L73 HydrophobicContact CE1-CD2 4.36Å; Y69-L73 HydrophobicContact CE2-CD1 3.75Å; Y69-L73 HydrophobicContact CG-CD1 4.28Å; Y69-L73 VanDerWaalsContact CZ-CD1 3.4Å; Y69-L73 WeakPolarHBondContact O-CD1 3.5Å; Y69-L73 PolarHBondContact O-N 3.49Å |
| 70 | L | 83.8 | Confident | 71.6 | Confident | 88 Ų | 88 | 107.6 Ų | 107.6 | 46% | 0.461 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.3 | -42.9 | 175.4 | -69.9 | 173.6 | 0 | 0 | 0 | 112 | N66 L73 L74 | N66-L70 WeakPolarHBondContact O-CG 3.28Å; N66-L70 PolarHBondContact O-N 3.33Å; N66-L70 WeakPolarHBondContact OD1-CD1 3.42Å; L70-L73 WeakPolarHBondContact O-CB 3.26Å; L70-L73 PolarHBondContact O-N 3.42Å; L70-L74 WeakPolarHBondContact O-CG 3.31Å; L70-L74 PolarHBondContact O-N 2.97Å |
| 71 | A | 77.1 | Confident | 69.9 | Low | 40 Ų | 40 | 112.4 Ų | 112.4 | 33% | 0.331 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.1 | -44 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | S67 R68 L73 L74 E75 | S67-A71 WeakPolarHBondContact O-CB 3.17Å; S67-A71 PolarHBondContact O-N 3.44Å; R68-A71 PolarHBondContact O-N 3.2Å; A71-L73 VanDerWaalsContact C-N 3.31Å; A71-L73 PolarHBondContact O-N 3.32Å; A71-L74 PolarHBondContact O-N 3.36Å; A71-L74 VanDerWaalsContact O-N 3.14Å; A71-E75 PolarHBondContact O-N 3.49Å |
| 72 | N | 77.9 | Confident | 68.2 | Low | 89 Ų | 89 | 115.2 Ų | 115.2 | 48% | 0.476 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.7 | -30.9 | 174.8 | -86.8 | -82.2 | 0 | 0 | 0 | 113.3 | R68 Y69 L74 K76 | R68-N72 WeakPolarHBondContact O-CB 3.47Å; R68-N72 PolarHBondContact O-N 3.02Å; R68-N72 PolarHBondContact O-ND2 2.9Å; Y69-N72 PolarHBondContact O-N 2.75Å; N72-L74 VanDerWaalsContact C-N 3.34Å; N72-K76 PolarHBondContact O-N 3.47Å |
| 73 | L | 75.2 | Confident | 66.5 | Low | 68 Ų | 68 | 115.2 Ų | 115.2 | 36% | 0.356 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -66.6 | -39 | 172.3 | -106.8 | 79.8 | 0 | 0 | 0 | 111.3 | Y69 L70 A71 K76 D77 | Y69-L73 HydrophobicContact CD1-CD1 3.97Å; Y69-L73 HydrophobicContact CD2-CD1 4.17Å; Y69-L73 HydrophobicContact CE1-CD1 3.53Å; Y69-L73 HydrophobicContact CE1-CD2 4.36Å; Y69-L73 HydrophobicContact CE2-CD1 3.75Å; Y69-L73 HydrophobicContact CG-CD1 4.28Å; Y69-L73 VanDerWaalsContact CZ-CD1 3.4Å; Y69-L73 WeakPolarHBondContact O-CD1 3.5Å; Y69-L73 PolarHBondContact O-N 3.49Å; L70-L73 WeakPolarHBondContact O-CB 3.26Å; L70-L73 PolarHBondContact O-N 3.42Å; A71-L73 VanDerWaalsContact C-N 3.31Å; A71-L73 PolarHBondContact O-N 3.32Å; L73-K76 PolarHBondContact O-N 3.44Å; L73-D77 PolarHBondContact O-N 2.97Å |
| 74 | L | 58.5 | Low | 64.8 | Low | 120 Ų | 120 | 111.1 Ų | 111.1 | 63% | 0.628 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -72.6 | -36.5 | 178.5 | -70.6 | 167.6 | 0 | 0 | 0 | 112.4 | L70 A71 N72 K76 D77 E78 | L70-L74 WeakPolarHBondContact O-CG 3.31Å; L70-L74 PolarHBondContact O-N 2.97Å; A71-L74 PolarHBondContact O-N 3.36Å; A71-L74 VanDerWaalsContact O-N 3.14Å; N72-L74 VanDerWaalsContact C-N 3.34Å; L74-K76 PolarHBondContact O-N 3.25Å; L74-D77 CarbonylContact O-C 3.56Å; L74-D77 VanDerWaalsContact O-C 3.3Å; L74-D77 WeakPolarHBondContact O-CA 3.33Å; L74-D77 WeakPolarHBondContact O-CB 3.41Å; L74-D77 PolarHBondContact O-N 3.49Å; L74-E78 PolarHBondContact O-N 3.44Å |
| 75 | E | 57.9 | Low | 63.2 | Low | 138 Ų | 138 | 116.4 Ų | 116.4 | 65% | 0.645 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -66.4 | -27.9 | 174.4 | -73.7 | 175.4 | -163.2 | 0 | 0 | 112.4 | A71 D77 | A71-E75 PolarHBondContact O-N 3.49Å; E75-D77 VanDerWaalsContact C-N 3.28Å |
| 76 | K | 54.4 | Low | 61.5 | Low | 183 Ų | 183 | 118.1 Ų | 118.1 | 80% | 0.796 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.1 | -11 | 169.9 | -72.8 | 178.8 | 176.8 | 179.4 | 0 | 113.5 | N72 L73 L74 | N72-K76 PolarHBondContact O-N 3.47Å; L73-K76 PolarHBondContact O-N 3.44Å; L74-K76 PolarHBondContact O-N 3.25Å |
| 77 | D | 48.6 | Very low | 59.3 | Low | 117 Ų | 117 | 119.4 Ų | 119.4 | 63% | 0.626 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | 25.1 | 173.3 | -154.9 | 36.1 | 0 | 0 | 0 | 110.5 | L73 L74 E75 C79 | L73-D77 PolarHBondContact O-N 2.97Å; L74-D77 CarbonylContact O-C 3.56Å; L74-D77 VanDerWaalsContact O-C 3.3Å; L74-D77 WeakPolarHBondContact O-CA 3.33Å; L74-D77 WeakPolarHBondContact O-CB 3.41Å; L74-D77 PolarHBondContact O-N 3.49Å; E75-D77 VanDerWaalsContact C-N 3.28Å; D77-C79 PolarHBondContact O-N 3.36Å |
| 78 | E | 47.1 | Very low | 57.7 | Low | 127 Ų | 127 | 121.6 Ų | 121.6 | 59% | 0.593 | 64% | 0.644 | S | S | * | * | trans | -62.6 | 78.7 | 146.4 | -78.4 | -145.3 | 167.7 | 0 | 0 | 107.1 | L74 S80 K81 | L74-E78 PolarHBondContact O-N 3.44Å; E78-S80 PolarHBondContact O-N 2.98Å; E78-K81 IonicContact OE1-NZ 3.6Å; E78-K81 PolarHBondContact OE1-NZ 3.46Å; E78-K81 IonicContact OE2-NZ 3.64Å; E78-K81 PolarHBondContact OE2-NZ 2.99Å | ||
| 79 | C | 40 | Very low | 56.2 | Low | 100 Ų | 100 | 120.6 Ų | 120.6 | 68% | 0.676 | 65% | 0.649 | S | S | * | * | trans | -33.7 | 121.9 | 150.1 | -169.6 | 0 | 0 | 0 | 0 | 107.6 | D77 K81 | D77-C79 PolarHBondContact O-N 3.36Å; C79-K81 PolarHBondContact O-N 3.48Å | ||
| 80 | S | 42 | Very low | 55 | Low | 76 Ų | 76 | 118.9 Ų | 118.9 | 53% | 0.531 | 66% | 0.656 | S | S | . | * | trans | -24.5 | 108.7 | 173.1 | 47.9 | 0 | 0 | 0 | 0 | 112 | E78 D82 | E78-S80 PolarHBondContact O-N 2.98Å; S80-D82 PolarHBondContact O-N 3.01Å | ||
| 81 | K | 43.4 | Very low | 54.2 | Low | 142 Ų | 142 | 119.3 Ų | 119.3 | 62% | 0.617 | 67% | 0.673 | S | S | * | * | G | 310 helix | trans | -62.4 | 0 | 174.4 | -99.7 | 174.7 | -177.9 | 137.5 | 0 | 113.9 | E78 C79 E83 | E78-K81 IonicContact OE1-NZ 3.6Å; E78-K81 PolarHBondContact OE1-NZ 3.46Å; E78-K81 IonicContact OE2-NZ 3.64Å; E78-K81 PolarHBondContact OE2-NZ 2.99Å; C79-K81 PolarHBondContact O-N 3.48Å; K81-E83 VanDerWaalsContact C-N 3.3Å; K81-E83 PolarHBondContact O-N 3.27Å |
| 82 | D | 44.7 | Very low | 53.7 | Low | 150 Ų | 150 | 125 Ų | 125 | 80% | 0.802 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -80.2 | -5 | -178.4 | -66.3 | -24.7 | 0 | 0 | 0 | 114 | S80 | S80-D82 PolarHBondContact O-N 3.01Š|
| 83 | E | 47.4 | Very low | 53.4 | Low | 179 Ų | 179 | 124.3 Ų | 124.3 | 84% | 0.836 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -107.6 | 26.1 | 178.1 | -68.9 | -69.6 | 167.5 | 0 | 0 | 112.9 | K81 | K81-E83 VanDerWaalsContact C-N 3.3Å; K81-E83 PolarHBondContact O-N 3.27Å |
| 84 | A | 49.4 | Very low | 53.7 | Low | 85 Ų | 85 | 124 Ų | 124 | 70% | 0.702 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -118 | 3.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 85 | E | 48.4 | Very low | 54.8 | Low | 185 Ų | 185 | 124.9 Ų | 124.9 | 86% | 0.864 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -123.2 | 29.2 | -175.8 | -153.7 | 166.3 | -168.8 | 0 | 0 | 114.3 | ||
| 86 | V | 50.3 | Low | 55.9 | Low | 130 Ų | 130 | 126.2 Ų | 126.2 | 79% | 0.788 | 71% | 0.709 | S | S | * | * | trans | -141.1 | 71.6 | 159.9 | -171.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 87 | C | 44.4 | Very low | 57.3 | Low | 120 Ų | 120 | 120.9 Ų | 120.9 | 81% | 0.811 | 69% | 0.692 | S | S | * | * | trans | -118.7 | 60 | 165.2 | -136.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 88 | S | 52.1 | Low | 59 | Low | 119 Ų | 119 | 119.7 Ų | 119.7 | 83% | 0.832 | 68% | 0.682 | S | S | * | * | trans | -96.6 | 0.9 | 159.7 | -61.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 89 | D | 53.1 | Low | 60.6 | Low | 129 Ų | 129 | 116 Ų | 116 | 69% | 0.69 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -81.6 | 129.9 | 172.5 | -94.6 | -28.6 | 0 | 0 | 0 | 110.2 | A91 | D89-A91 PolarHBondContact O-N 2.84Š|
| 90 | P | 60.3 | Low | 62.4 | Low | 111 Ų | 111 | 115.9 Ų | 115.9 | 72% | 0.721 | 67% | 0.673 | S | S | * | * | trans | -56.3 | 130 | 169.4 | 24.7 | -30.9 | 0 | 0 | 0 | 107.8 | L92 | P90-L92 PolarHBondContact O-N 2.77Å; P90-L92 VanDerWaalsContact O-N 3.11Å | ||
| 91 | A | 66.1 | Low | 64.4 | Low | 98 Ų | 98 | 117 Ų | 117 | 81% | 0.81 | 68% | 0.676 | S | S | * | * | trans | -44.9 | 123.3 | -179.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | D89 | D89-A91 PolarHBondContact O-N 2.84Š| ||
| 92 | L | 65.7 | Low | 66.3 | Low | 160 Ų | 160 | 112.5 Ų | 112.5 | 84% | 0.838 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 133 | 175.4 | -67.9 | 171.2 | 0 | 0 | 0 | 108.3 | P90 S94 | P90-L92 PolarHBondContact O-N 2.77Å; P90-L92 VanDerWaalsContact O-N 3.11Å; L92-S94 PolarHBondContact O-N 3.02Å |
| 93 | P | 73.4 | Confident | 68.1 | Low | 74 Ų | 74 | 107.4 Ų | 107.4 | 48% | 0.481 | 64% | 0.642 | S | S | . | * | P | Polyproline II helix | trans | -55.5 | 133.8 | -178.2 | 22.5 | -31.8 | 0 | 0 | 0 | 108.9 | T97 | P93-T97 HydrophobicContact CB-CG2 3.85Š|
| 94 | S | 81.6 | Confident | 69.8 | Low | 62 Ų | 62 | 103.1 Ų | 103.1 | 43% | 0.434 | 63% | 0.625 | S | S | . | * | P | Polyproline II helix | trans | -53.9 | 150.9 | 173.1 | 174.3 | 0 | 0 | 0 | 0 | 109.4 | L92 F96 T97 E98 | L92-S94 PolarHBondContact O-N 3.02Å; S94-F96 CarbonylContact O-C 3.3Å; S94-F96 PolarHBondContact O-N 2.9Å; S94-F96 PolarHBondContact OG-N 3.11Å; S94-T97 CarbonylContact O-C 3.57Å; S94-T97 WeakPolarHBondContact O-CA 3.49Å; S94-T97 VanDerWaalsContact O-CB 3.31Å; S94-T97 WeakPolarHBondContact O-CB 3.38Å; S94-T97 PolarHBondContact O-N 3.47Å; S94-E98 PolarHBondContact O-N 3.3Å |
| 95 | I | 80.8 | Confident | 71.4 | Confident | 138 Ų | 138 | 105.1 Ų | 105.1 | 71% | 0.708 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -49.9 | -36.3 | 175.2 | -59.8 | 171.3 | 0 | 0 | 0 | 110.7 | A99 | I95-A99 VanDerWaalsContact O-CB 3.26Å; I95-A99 WeakPolarHBondContact O-CB 3.23Å; I95-A99 PolarHBondContact O-N 3.49Å |
| 96 | F | 81.2 | Confident | 73.2 | Confident | 165 Ų | 165 | 99.4 Ų | 99.4 | 72% | 0.724 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -68.8 | -40.5 | 174.7 | -63.9 | -74.9 | 0 | 0 | 0 | 113 | S94 A99 C100 | S94-F96 CarbonylContact O-C 3.3Å; S94-F96 PolarHBondContact O-N 2.9Å; S94-F96 PolarHBondContact OG-N 3.11Å; F96-A99 PolarHBondContact O-N 3.37Å; F96-C100 PolarHBondContact O-N 2.88Å; F96-C100 VanDerWaalsContact O-N 3.11Å; F96-C100 PolarHBondContact O-SG 3.31Å |
| 97 | T | 84.1 | Confident | 74.9 | Confident | 72 Ų | 72 | 99.6 Ų | 99.6 | 44% | 0.442 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64.1 | -45.5 | 175.6 | -54.2 | 0 | 0 | 0 | 0 | 110.4 | P93 S94 C100 T101 | P93-T97 HydrophobicContact CB-CG2 3.85Å; S94-T97 CarbonylContact O-C 3.57Å; S94-T97 WeakPolarHBondContact O-CA 3.49Å; S94-T97 VanDerWaalsContact O-CB 3.31Å; S94-T97 WeakPolarHBondContact O-CB 3.38Å; S94-T97 PolarHBondContact O-N 3.47Å; T97-C100 PolarHBondContact O-N 3.22Å; T97-T101 HydrophobicContact CG2-CG2 4.38Å; T97-T101 WeakPolarHBondContact O-CB 3.48Å; T97-T101 WeakPolarHBondContact O-CG2 3.29Å; T97-T101 PolarHBondContact O-N 3.24Å; T97-T101 PolarHBondContact O-OG1 3.41Å |
| 98 | E | 83.9 | Confident | 76.8 | Confident | 91 Ų | 91 | 99.6 Ų | 99.6 | 43% | 0.425 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61.9 | -46.5 | 176 | -172.5 | 178.5 | 178.6 | 0 | 0 | 111.1 | S94 C100 T101 N102 | S94-E98 PolarHBondContact O-N 3.3Å; E98-C100 PolarHBondContact O-N 3Å; E98-T101 PolarHBondContact O-N 3.2Å; E98-T101 VanDerWaalsContact O-N 3.15Å; E98-N102 WeakPolarHBondContact O-CB 3.26Å; E98-N102 PolarHBondContact O-N 2.74Å |
| 99 | A | 80.2 | Confident | 78.5 | Confident | 49 Ų | 49 | 101.7 Ų | 101.7 | 41% | 0.405 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -58 | -35.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | I95 F96 | I95-A99 VanDerWaalsContact O-CB 3.26Å; I95-A99 WeakPolarHBondContact O-CB 3.23Å; I95-A99 PolarHBondContact O-N 3.49Å; F96-A99 PolarHBondContact O-N 3.37Å |
| 100 | C | 78.8 | Confident | 80.2 | Confident | 99 Ų | 99 | 99.9 Ų | 99.9 | 67% | 0.669 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -87.6 | -13.5 | -179.8 | -64.9 | 0 | 0 | 0 | 0 | 114.6 | F96 T97 E98 V106 | F96-C100 PolarHBondContact O-N 2.88Å; F96-C100 VanDerWaalsContact O-N 3.11Å; F96-C100 PolarHBondContact O-SG 3.31Å; T97-C100 PolarHBondContact O-N 3.22Å; E98-C100 PolarHBondContact O-N 3Å; C100-V106 WeakPolarHBondContact O-CG2 3.32Å |
| 101 | T | 82.3 | Confident | 81.6 | Confident | 98 Ų | 98 | 99.4 Ų | 99.4 | 60% | 0.601 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -117 | -16.6 | -175.1 | 56.5 | 0 | 0 | 0 | 0 | 113.6 | T97 E98 G103 | T97-T101 HydrophobicContact CG2-CG2 4.38Å; T97-T101 WeakPolarHBondContact O-CB 3.48Å; T97-T101 WeakPolarHBondContact O-CG2 3.29Å; T97-T101 PolarHBondContact O-N 3.24Å; T97-T101 PolarHBondContact O-OG1 3.41Å; E98-T101 PolarHBondContact O-N 3.2Å; E98-T101 VanDerWaalsContact O-N 3.15Å; T101-G103 PolarHBondContact O-N 3.32Å; T101-G103 VanDerWaalsContact O-N 3.16Å |
| 102 | N | 84.1 | Confident | 82.8 | Confident | 49 Ų | 49 | 96.9 Ų | 96.9 | 26% | 0.262 | 52% | 0.515 | S | S | . | . | trans | -67 | 114.2 | 176.5 | -173.5 | -45 | 0 | 0 | 0 | 109.4 | E98 N104 Y105 V106 | E98-N102 WeakPolarHBondContact O-CB 3.26Å; E98-N102 PolarHBondContact O-N 2.74Å; N102-N104 PolarHBondContact O-N 3.03Å; N102-N104 VanDerWaalsContact O-N 3.14Å; N102-N104 VanDerWaalsContact OD1-CB 3.31Å; N102-N104 WeakPolarHBondContact OD1-CB 3.35Å; N102-N104 PolarHBondContact OD1-N 3.03Å; N102-Y105 HydrophobicContact CB-CD2 3.54Å; N102-Y105 HydrophobicContact CB-CE2 4.08Å; N102-Y105 HydrophobicContact CB-CG 4.27Å; N102-Y105 PolarHBondContact O-N 3.38Å; N102-Y105 VanDerWaalsContact O-N 3.11Å; N102-V106 WeakPolarHBondContact O-CG2 3.45Å; N102-V106 PolarHBondContact O-N 2.94Å | ||
| 103 | G | 82.6 | Confident | 84 | Confident | 42 Ų | 42 | 93.7 Ų | 93.7 | 43% | 0.433 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -55.3 | -34.1 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | T101 V106 E107 | T101-G103 PolarHBondContact O-N 3.32Å; T101-G103 VanDerWaalsContact O-N 3.16Å; G103-V106 PolarHBondContact O-N 2.87Å; G103-E107 WeakPolarHBondContact O-CB 3.15Å; G103-E107 VanDerWaalsContact O-CG 3.27Å; G103-E107 WeakPolarHBondContact O-CG 3.39Å; G103-E107 PolarHBondContact O-N 3.39Å |
| 104 | N | 83.7 | Confident | 85 | Confident | 90 Ų | 90 | 96 Ų | 96 | 48% | 0.481 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.6 | -43.9 | 179.7 | -165.9 | -26.9 | 0 | 0 | 0 | 111.7 | N102 Q108 | N102-N104 PolarHBondContact O-N 3.03Å; N102-N104 VanDerWaalsContact O-N 3.14Å; N102-N104 VanDerWaalsContact OD1-CB 3.31Å; N102-N104 WeakPolarHBondContact OD1-CB 3.35Å; N102-N104 PolarHBondContact OD1-N 3.03Å; N104-Q108 WeakPolarHBondContact O-CG 3.37Å; N104-Q108 PolarHBondContact O-N 3.12Å; N104-Q108 PolarHBondContact OD1-NE2 3.34Å |
| 105 | Y | 82.8 | Confident | 85.5 | Confident | 126 Ų | 126 | 98.6 Ų | 98.6 | 49% | 0.494 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -68.5 | -41.4 | 176 | -59.9 | -37.7 | 0 | 0 | 0 | 111.6 | N102 E107 Q108 W109 | N102-Y105 HydrophobicContact CB-CD2 3.54Å; N102-Y105 HydrophobicContact CB-CE2 4.08Å; N102-Y105 HydrophobicContact CB-CG 4.27Å; N102-Y105 PolarHBondContact O-N 3.38Å; N102-Y105 VanDerWaalsContact O-N 3.11Å; Y105-E107 PolarHBondContact O-N 2.88Å; Y105-Q108 PolarHBondContact O-N 3.43Å; Y105-W109 WeakPolarHBondContact O-CB 3.32Å; Y105-W109 PolarHBondContact O-N 3.49Å |
| 106 | V | 85.9 | Confident | 86 | Confident | 65 Ų | 65 | 94.9 Ų | 94.9 | 39% | 0.394 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.8 | -41 | -179.6 | 173.4 | 0 | 0 | 0 | 0 | 111.7 | C100 N102 G103 W109 N110 | C100-V106 WeakPolarHBondContact O-CG2 3.32Å; N102-V106 WeakPolarHBondContact O-CG2 3.45Å; N102-V106 PolarHBondContact O-N 2.94Å; G103-V106 PolarHBondContact O-N 2.87Å; V106-W109 PolarHBondContact O-N 2.97Å; V106-N110 VanDerWaalsContact O-CB 3.29Å; V106-N110 WeakPolarHBondContact O-CB 3.1Å; V106-N110 PolarHBondContact O-N 3.31Å |
| 107 | E | 86.9 | Confident | 86.5 | Confident | 134 Ų | 134 | 89.5 Ų | 89.5 | 63% | 0.626 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62 | -49.8 | 176.1 | -77.8 | 174.1 | -172.9 | 0 | 0 | 111.7 | G103 Y105 W109 N110 D111 | G103-E107 WeakPolarHBondContact O-CB 3.15Å; G103-E107 VanDerWaalsContact O-CG 3.27Å; G103-E107 WeakPolarHBondContact O-CG 3.39Å; G103-E107 PolarHBondContact O-N 3.39Å; Y105-E107 PolarHBondContact O-N 2.88Å; E107-W109 VanDerWaalsContact C-N 3.26Å; E107-W109 PolarHBondContact O-N 2.66Å; E107-N110 PolarHBondContact O-N 3.25Å; E107-D111 WeakPolarHBondContact O-CB 3.15Å; E107-D111 PolarHBondContact O-N 2.72Å |
| 108 | Q | 84.2 | Confident | 86.8 | Confident | 120 Ų | 120 | 92.6 Ų | 92.6 | 56% | 0.561 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.6 | -37.8 | 176.8 | -67.1 | 177.7 | 37.7 | 0 | 0 | 112.2 | N104 Y105 F112 | N104-Q108 WeakPolarHBondContact O-CG 3.37Å; N104-Q108 PolarHBondContact O-N 3.12Å; N104-Q108 PolarHBondContact OD1-NE2 3.34Å; Y105-Q108 PolarHBondContact O-N 3.43Å; Q108-F112 WeakPolarHBondContact O-CB 3.21Å; Q108-F112 PolarHBondContact O-N 3.26Å |
| 109 | W | 87.2 | Confident | 87.1 | Confident | 164 Ų | 164 | 92.7 Ų | 92.7 | 62% | 0.621 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -68.6 | -41.2 | 178 | -142.6 | 99.5 | 0 | 0 | 0 | 111.8 | Y105 V106 E107 F112 M113 | Y105-W109 WeakPolarHBondContact O-CB 3.32Å; Y105-W109 PolarHBondContact O-N 3.49Å; V106-W109 PolarHBondContact O-N 2.97Å; E107-W109 VanDerWaalsContact C-N 3.26Å; E107-W109 PolarHBondContact O-N 2.66Å; W109-F112 WeakPolarHBondContact O-CB 3.39Å; W109-F112 PolarHBondContact O-N 3.46Å; W109-M113 HydrophobicContact CD2-CG 4.24Å; W109-M113 HydrophobicContact CE3-CB 4.44Å; W109-M113 HydrophobicContact CE3-CG 3.19Å; W109-M113 HydrophobicContact CE3-SD 4.03Å; W109-M113 HydrophobicContact CH2-CE 3.97Å; W109-M113 HydrophobicContact CH2-CG 3.71Å; W109-M113 HydrophobicContact CH2-SD 3.32Å; W109-M113 WeakPolarHBondContact CH2-SD 3.31Å; W109-M113 HydrophobicContact CZ2-SD 4.29Å; W109-M113 HydrophobicContact CZ3-CB 4.34Å; W109-M113 HydrophobicContact CZ3-CE 3.78Å; W109-M113 HydrophobicContact CZ3-CG 2.92Å; W109-M113 HydrophobicContact CZ3-SD 3.23Å; W109-M113 WeakPolarHBondContact CZ3-SD 3.43Å; W109-M113 WeakPolarHBondContact O-CG 3.4Å; W109-M113 PolarHBondContact O-N 3.18Å |
| 110 | N | 89.4 | Confident | 87.7 | Confident | 90 Ų | 90 | 92.5 Ų | 92.5 | 48% | 0.481 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.2 | -43.7 | 177.4 | -160.8 | 12.8 | 0 | 0 | 0 | 110.9 | V106 E107 F112 M113 N114 | V106-N110 VanDerWaalsContact O-CB 3.29Å; V106-N110 WeakPolarHBondContact O-CB 3.1Å; V106-N110 PolarHBondContact O-N 3.31Å; E107-N110 PolarHBondContact O-N 3.25Å; N110-F112 VanDerWaalsContact C-N 3.25Å; N110-F112 PolarHBondContact O-N 3.2Å; N110-M113 PolarHBondContact O-N 3.3Å; N110-N114 WeakPolarHBondContact O-CB 3.1Å; N110-N114 VanDerWaalsContact O-CG 3.29Å; N110-N114 PolarHBondContact O-N 3.2Å; N110-N114 PolarHBondContact O-ND2 3.33Å; N110-N114 PolarHBondContact OD1-ND2 2.78Å |
| 111 | D | 89.9 | Confident | 88.2 | Confident | 102 Ų | 102 | 94.6 Ų | 94.6 | 55% | 0.545 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -60.5 | -34.3 | 174.1 | -80.3 | -0.8 | 0 | 0 | 0 | 112.6 | E107 R115 | E107-D111 WeakPolarHBondContact O-CB 3.15Å; E107-D111 PolarHBondContact O-N 2.72Å; D111-R115 WeakPolarHBondContact O-CG 3.36Å; D111-R115 PolarHBondContact O-NE 2.8Å |
| 112 | F | 91.3 | Very high | 88.7 | Confident | 44 Ų | 44 | 96.1 Ų | 96.1 | 19% | 0.193 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -69.3 | -46.4 | 173.9 | 178.5 | -104.6 | 0 | 0 | 0 | 112 | Q108 W109 N110 N114 R115 Q120 L123 L124 | Q108-F112 WeakPolarHBondContact O-CB 3.21Å; Q108-F112 PolarHBondContact O-N 3.26Å; W109-F112 WeakPolarHBondContact O-CB 3.39Å; W109-F112 PolarHBondContact O-N 3.46Å; N110-F112 VanDerWaalsContact C-N 3.25Å; N110-F112 PolarHBondContact O-N 3.2Å; F112-N114 VanDerWaalsContact C-N 3.29Å; F112-N114 PolarHBondContact O-N 3.44Å; F112-R115 WeakPolarHBondContact O-CB 3.45Å; F112-R115 PolarHBondContact O-N 2.98Å; F112-Q120 HydrophobicContact CD2-CG 4.12Å; F112-Q120 HydrophobicContact CE1-CB 4.49Å; F112-Q120 HydrophobicContact CE1-CG 4.14Å; F112-Q120 HydrophobicContact CE2-CB 3.68Å; F112-Q120 HydrophobicContact CE2-CG 3.67Å; F112-Q120 HydrophobicContact CZ-CB 3.64Å; F112-Q120 HydrophobicContact CZ-CG 3.68Å; F112-Q120 PolarHBondContact O-NE2 3.05Å; F112-L123 HydrophobicContact CD2-CD2 3.72Å; F112-L123 HydrophobicContact CE2-CD2 4.12Å; F112-L124 HydrophobicContact CE2-CG 4.28Å; F112-L124 HydrophobicContact CZ-CD1 4.17Å; F112-L124 HydrophobicContact CZ-CD2 4.37Å; F112-L124 HydrophobicContact CZ-CG 4.15Å |
| 113 | M | 90.9 | Very high | 89.1 | Confident | 94 Ų | 94 | 96.7 Ų | 96.7 | 46% | 0.463 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67 | -29.4 | -178.2 | -72.7 | -59.7 | -76.8 | 0 | 0 | 114.4 | W109 N110 R115 | W109-M113 HydrophobicContact CD2-CG 4.24Å; W109-M113 HydrophobicContact CE3-CB 4.44Å; W109-M113 HydrophobicContact CE3-CG 3.19Å; W109-M113 HydrophobicContact CE3-SD 4.03Å; W109-M113 HydrophobicContact CH2-CE 3.97Å; W109-M113 HydrophobicContact CH2-CG 3.71Å; W109-M113 HydrophobicContact CH2-SD 3.32Å; W109-M113 WeakPolarHBondContact CH2-SD 3.31Å; W109-M113 HydrophobicContact CZ2-SD 4.29Å; W109-M113 HydrophobicContact CZ3-CB 4.34Å; W109-M113 HydrophobicContact CZ3-CE 3.78Å; W109-M113 HydrophobicContact CZ3-CG 2.92Å; W109-M113 HydrophobicContact CZ3-SD 3.23Å; W109-M113 WeakPolarHBondContact CZ3-SD 3.43Å; W109-M113 WeakPolarHBondContact O-CG 3.4Å; W109-M113 PolarHBondContact O-N 3.18Å; N110-M113 PolarHBondContact O-N 3.3Å; M113-R115 PolarHBondContact O-N 3.27Å |
| 114 | N | 93.4 | Very high | 89.6 | Confident | 122 Ų | 122 | 99.3 Ų | 99.3 | 65% | 0.652 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.4 | -1.3 | 179 | -67.3 | -41.8 | 0 | 0 | 0 | 113.2 | N110 F112 | N110-N114 WeakPolarHBondContact O-CB 3.1Å; N110-N114 VanDerWaalsContact O-CG 3.29Å; N110-N114 PolarHBondContact O-N 3.2Å; N110-N114 PolarHBondContact O-ND2 3.33Å; N110-N114 PolarHBondContact OD1-ND2 2.78Å; F112-N114 VanDerWaalsContact C-N 3.29Å; F112-N114 PolarHBondContact O-N 3.44Å |
| 115 | R | 91.4 | Very high | 90 | Very high | 117 Ų | 117 | 97.5 Ų | 97.5 | 44% | 0.442 | 49% | 0.485 | S | S | . | . | S | Bend | trans | -81.9 | 158.2 | 173.5 | -70.5 | 166.8 | -169.1 | -84.9 | -0.3 | 111.7 | D111 F112 M113 E119 Q120 | D111-R115 WeakPolarHBondContact O-CG 3.36Å; D111-R115 PolarHBondContact O-NE 2.8Å; F112-R115 WeakPolarHBondContact O-CB 3.45Å; F112-R115 PolarHBondContact O-N 2.98Å; M113-R115 PolarHBondContact O-N 3.27Å; R115-E119 HydrophobicContact CB-CB 4.09Å; R115-Q120 HydrophobicContact CB-CG 4.07Å |
| 116 | S | 92.9 | Very high | 90.4 | Very high | 59 Ų | 59 | 96.7 Ų | 96.7 | 41% | 0.413 | 49% | 0.489 | S | S | . | . | trans | -67.1 | 153.8 | 170.3 | 63.6 | 0 | 0 | 0 | 0 | 111.2 | E118 E119 Q120 | S116-E118 VanDerWaalsContact C-N 3.26Å; S116-E118 PolarHBondContact O-N 3.36Å; S116-E119 PolarHBondContact N-OE2 3.09Å; S116-E119 WeakPolarHBondContact O-CB 3.3Å; S116-E119 PolarHBondContact O-N 3.44Å; S116-E119 WeakPolarHBondContact OG-CG 3.41Å; S116-E119 PolarHBondContact OG-OE2 3.01Å; S116-Q120 PolarHBondContact O-N 3.25Å | ||
| 117 | G | 90.4 | Very high | 90.5 | Very high | 52 Ų | 52 | 97.9 Ų | 97.9 | 54% | 0.536 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.3 | -37.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | E119 Q120 E121 | G117-E119 VanDerWaalsContact C-N 3.34Å; G117-E119 PolarHBondContact O-N 2.82Å; G117-Q120 PolarHBondContact O-N 2.81Å; G117-E121 PolarHBondContact O-N 3Å |
| 118 | E | 90.6 | Very high | 90.6 | Very high | 138 Ų | 138 | 96.7 Ų | 96.7 | 65% | 0.645 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66 | -34.4 | 175.7 | -64.1 | -175.2 | -173.9 | 0 | 0 | 112.8 | S116 K122 | S116-E118 VanDerWaalsContact C-N 3.26Å; S116-E118 PolarHBondContact O-N 3.36Å; E118-K122 WeakPolarHBondContact O-CD 3.43Å; E118-K122 VanDerWaalsContact O-CG 3.28Å; E118-K122 WeakPolarHBondContact O-CG 3.37Å; E118-K122 PolarHBondContact O-N 2.88Å; E118-K122 VanDerWaalsContact O-N 3.15Å |
| 119 | E | 90.3 | Very high | 90.7 | Very high | 93 Ų | 93 | 95.2 Ų | 95.2 | 44% | 0.435 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -74.8 | -35.5 | 176.7 | -72.2 | 169.8 | 144.1 | 0 | 0 | 111.8 | R115 S116 G117 K122 L123 | R115-E119 HydrophobicContact CB-CB 4.09Å; S116-E119 PolarHBondContact N-OE2 3.09Å; S116-E119 WeakPolarHBondContact O-CB 3.3Å; S116-E119 PolarHBondContact O-N 3.44Å; S116-E119 WeakPolarHBondContact OG-CG 3.41Å; S116-E119 PolarHBondContact OG-OE2 3.01Å; G117-E119 VanDerWaalsContact C-N 3.34Å; G117-E119 PolarHBondContact O-N 2.82Å; E119-K122 PolarHBondContact O-N 2.91Å; E119-L123 WeakPolarHBondContact O-CB 3.38Å; E119-L123 PolarHBondContact O-N 3.46Å |
| 120 | Q | 93.2 | Very high | 90.6 | Very high | 45 Ų | 45 | 93.2 Ų | 93.2 | 21% | 0.21 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -60.9 | -47 | 172.6 | -71.1 | -177.9 | -12.5 | 0 | 0 | 110.8 | F112 R115 S116 G117 K122 L123 L124 | F112-Q120 HydrophobicContact CD2-CG 4.12Å; F112-Q120 HydrophobicContact CE1-CB 4.49Å; F112-Q120 HydrophobicContact CE1-CG 4.14Å; F112-Q120 HydrophobicContact CE2-CB 3.68Å; F112-Q120 HydrophobicContact CE2-CG 3.67Å; F112-Q120 HydrophobicContact CZ-CB 3.64Å; F112-Q120 HydrophobicContact CZ-CG 3.68Å; F112-Q120 PolarHBondContact O-NE2 3.05Å; R115-Q120 HydrophobicContact CB-CG 4.07Å; S116-Q120 PolarHBondContact O-N 3.25Å; G117-Q120 PolarHBondContact O-N 2.81Å; Q120-K122 PolarHBondContact O-N 3.38Å; Q120-L123 PolarHBondContact O-N 3.25Å; Q120-L124 WeakPolarHBondContact O-CG 3.27Å; Q120-L124 PolarHBondContact O-N 2.98Å |
| 121 | E | 89.8 | Confident | 90.2 | Very high | 142 Ų | 142 | 91 Ų | 91 | 66% | 0.664 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -62.2 | -43.8 | 178.6 | -171.3 | 175.1 | -170.4 | 0 | 0 | 111.9 | G117 L123 L124 A125 | G117-E121 PolarHBondContact O-N 3Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-L123 PolarHBondContact O-N 2.93Å; E121-L124 PolarHBondContact O-N 2.79Å; E121-A125 WeakPolarHBondContact O-CB 3.42Å; E121-A125 PolarHBondContact O-N 3.02Å |
| 122 | K | 92.9 | Very high | 89.8 | Confident | 131 Ų | 131 | 90.8 Ų | 90.8 | 57% | 0.57 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -60.3 | -42.7 | 174.6 | -74.4 | 168 | -173.6 | 162.8 | 0 | 112.2 | E118 E119 Q120 A125 L126 | E118-K122 WeakPolarHBondContact O-CD 3.43Å; E118-K122 VanDerWaalsContact O-CG 3.28Å; E118-K122 WeakPolarHBondContact O-CG 3.37Å; E118-K122 PolarHBondContact O-N 2.88Å; E118-K122 VanDerWaalsContact O-N 3.15Å; E119-K122 PolarHBondContact O-N 2.91Å; Q120-K122 PolarHBondContact O-N 3.38Å; K122-A125 PolarHBondContact O-N 3.05Å; K122-L126 WeakPolarHBondContact O-CG 3.37Å; K122-L126 PolarHBondContact O-N 3.24Å |
| 123 | L | 91.3 | Very high | 89 | Confident | 61 Ų | 61 | 95.5 Ų | 95.5 | 32% | 0.319 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.8 | -44 | 179.3 | -174.3 | 68.7 | 0 | 0 | 0 | 111.6 | F112 E119 Q120 E121 A125 L126 L127 | F112-L123 HydrophobicContact CD2-CD2 3.72Å; F112-L123 HydrophobicContact CE2-CD2 4.12Å; E119-L123 WeakPolarHBondContact O-CB 3.38Å; E119-L123 PolarHBondContact O-N 3.46Å; Q120-L123 PolarHBondContact O-N 3.25Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-L123 PolarHBondContact O-N 2.93Å; L123-A125 VanDerWaalsContact C-N 3.33Å; L123-A125 PolarHBondContact O-N 3.39Å; L123-L126 PolarHBondContact O-N 3.49Å; L123-L127 HydrophobicContact CG-CD1 4.23Å; L123-L127 WeakPolarHBondContact O-CG 3.49Å; L123-L127 PolarHBondContact O-N 3.06Å |
| 124 | L | 92.9 | Very high | 87.5 | Confident | 97 Ų | 97 | 93.4 Ų | 93.4 | 51% | 0.508 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.8 | -43.3 | 176.6 | -72.6 | 174.1 | 0 | 0 | 0 | 111.4 | F112 Q120 E121 L126 L127 E128 | F112-L124 HydrophobicContact CE2-CG 4.28Å; F112-L124 HydrophobicContact CZ-CD1 4.17Å; F112-L124 HydrophobicContact CZ-CD2 4.37Å; F112-L124 HydrophobicContact CZ-CG 4.15Å; Q120-L124 WeakPolarHBondContact O-CG 3.27Å; Q120-L124 PolarHBondContact O-N 2.98Å; E121-L124 PolarHBondContact O-N 2.79Å; L124-L126 PolarHBondContact O-N 3.15Å; L124-L127 PolarHBondContact O-N 2.76Å; L124-E128 WeakPolarHBondContact O-CB 3.26Å; L124-E128 PolarHBondContact O-N 3.22Å |
| 125 | A | 91.9 | Very high | 85.7 | Confident | 51 Ų | 51 | 92 Ų | 92 | 42% | 0.421 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.8 | -41.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | E121 K122 L123 E128 E129 | E121-A125 WeakPolarHBondContact O-CB 3.42Å; E121-A125 PolarHBondContact O-N 3.02Å; K122-A125 PolarHBondContact O-N 3.05Å; L123-A125 VanDerWaalsContact C-N 3.33Å; L123-A125 PolarHBondContact O-N 3.39Å; A125-E128 PolarHBondContact O-N 3.23Å; A125-E129 WeakPolarHBondContact O-CG 3.47Å; A125-E129 PolarHBondContact O-N 3.46Å |
| 126 | L | 90.8 | Very high | 84 | Confident | 110 Ų | 110 | 90.5 Ų | 90.5 | 58% | 0.576 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -63.2 | -45 | 175.8 | -73.6 | 173.8 | 0 | 0 | 0 | 112.3 | K122 L123 L124 E128 E129 E130 | K122-L126 WeakPolarHBondContact O-CG 3.37Å; K122-L126 PolarHBondContact O-N 3.24Å; L123-L126 PolarHBondContact O-N 3.49Å; L124-L126 PolarHBondContact O-N 3.15Å; L126-E128 VanDerWaalsContact C-N 3.32Å; L126-E128 PolarHBondContact O-N 3.05Å; L126-E129 PolarHBondContact O-N 2.75Å; L126-E130 WeakPolarHBondContact O-CB 3.36Å; L126-E130 PolarHBondContact O-N 2.86Å |
| 127 | L | 88.8 | Confident | 82 | Confident | 90 Ų | 90 | 94 Ų | 94 | 47% | 0.471 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.6 | -36.8 | 177.2 | -71.5 | 172.6 | 0 | 0 | 0 | 111.9 | L123 L124 E130 A131 | L123-L127 HydrophobicContact CG-CD1 4.23Å; L123-L127 WeakPolarHBondContact O-CG 3.49Å; L123-L127 PolarHBondContact O-N 3.06Å; L124-L127 PolarHBondContact O-N 2.76Å; L127-E130 PolarHBondContact O-N 3.41Å; L127-A131 VanDerWaalsContact O-CB 3.3Å; L127-A131 WeakPolarHBondContact O-CB 3.38Å; L127-A131 PolarHBondContact O-N 2.91Å |
| 128 | E | 89 | Confident | 79.9 | Confident | 108 Ų | 108 | 98.2 Ų | 98.2 | 51% | 0.505 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.2 | -43.9 | 175.8 | -164.9 | -169.6 | 150.7 | 0 | 0 | 111.5 | L124 A125 L126 E130 A131 K132 | L124-E128 WeakPolarHBondContact O-CB 3.26Å; L124-E128 PolarHBondContact O-N 3.22Å; A125-E128 PolarHBondContact O-N 3.23Å; L126-E128 VanDerWaalsContact C-N 3.32Å; L126-E128 PolarHBondContact O-N 3.05Å; E128-E130 VanDerWaalsContact C-N 3.33Å; E128-E130 PolarHBondContact O-N 2.84Å; E128-A131 PolarHBondContact O-N 3.4Å; E128-K132 VanDerWaalsContact O-CG 3.29Å; E128-K132 WeakPolarHBondContact O-CG 3.1Å; E128-K132 PolarHBondContact O-N 3.08Å; E128-K132 WeakPolarHBondContact OE1-CE 3.36Å; E128-K132 IonicContact OE1-NZ 2.66Å; E128-K132 PolarHBondContact OE1-NZ 3.33Å |
| 129 | E | 87.5 | Confident | 77.7 | Confident | 90 Ų | 90 | 97.8 Ų | 97.8 | 42% | 0.421 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -66.1 | -34.8 | 175.3 | -72.5 | -58.1 | 124.3 | 0 | 0 | 112.4 | A125 L126 K132 R133 | A125-E129 WeakPolarHBondContact O-CG 3.47Å; A125-E129 PolarHBondContact O-N 3.46Å; L126-E129 PolarHBondContact O-N 2.75Å; E129-K132 IonicContact OE1-NZ 2.75Å; E129-K132 PolarHBondContact OE1-NZ 2.84Å; E129-R133 WeakPolarHBondContact O-CB 3.17Å; E129-R133 VanDerWaalsContact O-CG 3.28Å; E129-R133 WeakPolarHBondContact O-CG 3.29Å; E129-R133 PolarHBondContact O-N 3.17Å; E129-R133 VanDerWaalsContact O-N 3.09Å; E129-R133 PolarHBondContact O-NE 3.27Å |
| 130 | E | 84.8 | Confident | 75.5 | Confident | 122 Ų | 122 | 98.6 Ų | 98.6 | 57% | 0.57 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -68.5 | -41.4 | 171.1 | -174.5 | 170.1 | -164.2 | 0 | 0 | 111.7 | L126 L127 E128 K132 R133 S134 | L126-E130 WeakPolarHBondContact O-CB 3.36Å; L126-E130 PolarHBondContact O-N 2.86Å; L127-E130 PolarHBondContact O-N 3.41Å; E128-E130 VanDerWaalsContact C-N 3.33Å; E128-E130 PolarHBondContact O-N 2.84Å; E130-K132 PolarHBondContact O-N 3.49Å; E130-R133 CarbonylContact O-C 3.54Å; E130-R133 PolarHBondContact O-N 2.93Å; E130-S134 WeakPolarHBondContact O-CB 3.42Å; E130-S134 PolarHBondContact O-N 3.18Å |
| 131 | A | 81 | Confident | 73 | Confident | 43 Ų | 43 | 105 Ų | 105 | 36% | 0.355 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.3 | -42 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L127 E128 S134 N135 | L127-A131 VanDerWaalsContact O-CB 3.3Å; L127-A131 WeakPolarHBondContact O-CB 3.38Å; L127-A131 PolarHBondContact O-N 2.91Å; E128-A131 PolarHBondContact O-N 3.4Å; A131-S134 PolarHBondContact O-N 2.89Å; A131-S134 PolarHBondContact O-OG 3.21Å; A131-N135 VanDerWaalsContact O-CB 3.31Å; A131-N135 WeakPolarHBondContact O-CB 3.19Å; A131-N135 PolarHBondContact O-N 3.38Å; A131-N135 PolarHBondContact O-ND2 3.13Å |
| 132 | K | 79.8 | Confident | 70.6 | Confident | 98 Ų | 98 | 104.2 Ų | 104.2 | 43% | 0.426 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.8 | -40.9 | 173.6 | -70.7 | 168.4 | -172.9 | 161.4 | 0 | 112.3 | E128 E129 E130 N135 S136 | E128-K132 VanDerWaalsContact O-CG 3.29Å; E128-K132 WeakPolarHBondContact O-CG 3.1Å; E128-K132 PolarHBondContact O-N 3.08Å; E128-K132 WeakPolarHBondContact OE1-CE 3.36Å; E128-K132 IonicContact OE1-NZ 2.66Å; E128-K132 PolarHBondContact OE1-NZ 3.33Å; E129-K132 IonicContact OE1-NZ 2.75Å; E129-K132 PolarHBondContact OE1-NZ 2.84Å; E130-K132 PolarHBondContact O-N 3.49Å; K132-N135 PolarHBondContact O-N 2.95Å; K132-S136 PolarHBondContact O-N 2.94Å; K132-S136 PolarHBondContact O-OG 3.34Å |
| 133 | R | 74.5 | Confident | 68.3 | Low | 143 Ų | 143 | 103.2 Ų | 103.2 | 54% | 0.54 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -68.5 | -36.1 | 174.3 | -75.9 | 179.9 | -82.2 | -175.2 | -2.8 | 112.9 | E129 E130 S136 N137 | E129-R133 WeakPolarHBondContact O-CB 3.17Å; E129-R133 VanDerWaalsContact O-CG 3.28Å; E129-R133 WeakPolarHBondContact O-CG 3.29Å; E129-R133 PolarHBondContact O-N 3.17Å; E129-R133 VanDerWaalsContact O-N 3.09Å; E129-R133 PolarHBondContact O-NE 3.27Å; E130-R133 CarbonylContact O-C 3.54Å; E130-R133 PolarHBondContact O-N 2.93Å; R133-S136 WeakPolarHBondContact CA-OG 3.35Å; R133-S136 PolarHBondContact O-OG 2.85Å; R133-N137 WeakPolarHBondContact O-CB 3.42Å; R133-N137 PolarHBondContact O-N 2.56Å; R133-N137 VanDerWaalsContact O-N 3.15Å; R133-N137 PolarHBondContact O-ND2 2.89Å; R133-N137 VanDerWaalsContact O-ND2 3.15Å |
| 134 | S | 59.8 | Low | 66.4 | Low | 50 Ų | 50 | 107.9 Ų | 107.9 | 35% | 0.35 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.4 | -38.5 | 174.1 | 82.9 | 0 | 0 | 0 | 0 | 111.3 | E130 A131 N137 K138 | E130-S134 WeakPolarHBondContact O-CB 3.42Å; E130-S134 PolarHBondContact O-N 3.18Å; A131-S134 PolarHBondContact O-N 2.89Å; A131-S134 PolarHBondContact O-OG 3.21Å; S134-N137 CarbonylContact O-C 3.54Å; S134-N137 VanDerWaalsContact O-C 3.28Å; S134-N137 PolarHBondContact O-N 3.39Å; S134-K138 WeakPolarHBondContact O-CG 3.46Å; S134-K138 PolarHBondContact O-N 3.15Å |
| 135 | N | 56.2 | Low | 64 | Low | 92 Ų | 92 | 109.4 Ų | 109.4 | 49% | 0.492 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -71 | -30.9 | 179.6 | -76.3 | -21.3 | 0 | 0 | 0 | 112.4 | A131 K132 K138 | A131-N135 VanDerWaalsContact O-CB 3.31Å; A131-N135 WeakPolarHBondContact O-CB 3.19Å; A131-N135 PolarHBondContact O-N 3.38Å; A131-N135 PolarHBondContact O-ND2 3.13Å; K132-N135 PolarHBondContact O-N 2.95Å; N135-K138 PolarHBondContact O-N 3.38Å; N135-K138 WeakPolarHBondContact OD1-CD 3.46Å; N135-K138 WeakPolarHBondContact OD1-CE 3.47Å; N135-K138 PolarHBondContact OD1-NZ 2.89Å |
| 136 | S | 55.9 | Low | 62.2 | Low | 86 Ų | 86 | 111.6 Ų | 111.6 | 60% | 0.601 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -72.5 | -30.6 | 169.2 | 44.6 | 0 | 0 | 0 | 0 | 112.7 | K132 R133 K138 | K132-S136 PolarHBondContact O-N 2.94Å; K132-S136 PolarHBondContact O-OG 3.34Å; R133-S136 WeakPolarHBondContact CA-OG 3.35Å; R133-S136 PolarHBondContact O-OG 2.85Å; S136-K138 VanDerWaalsContact C-N 3.34Å |
| 137 | N | 49.9 | Very low | 60.9 | Low | 133 Ų | 133 | 110.7 Ų | 110.7 | 71% | 0.711 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -85.7 | 0.9 | 170.6 | -70.4 | -37.2 | 0 | 0 | 0 | 114.2 | R133 S134 L139 | R133-N137 WeakPolarHBondContact O-CB 3.42Å; R133-N137 PolarHBondContact O-N 2.56Å; R133-N137 VanDerWaalsContact O-N 3.15Å; R133-N137 PolarHBondContact O-ND2 2.89Å; R133-N137 VanDerWaalsContact O-ND2 3.15Å; S134-N137 CarbonylContact O-C 3.54Å; S134-N137 VanDerWaalsContact O-C 3.28Å; S134-N137 PolarHBondContact O-N 3.39Å; N137-L139 PolarHBondContact O-N 2.86Å; N137-L139 VanDerWaalsContact O-N 3.11Å |
| 138 | K | 46.6 | Very low | 60.5 | Low | 139 Ų | 139 | 109.9 Ų | 109.9 | 60% | 0.604 | 56% | 0.561 | S | S | * | * | trans | -82.9 | 51.2 | 163.2 | -73.8 | 173.3 | -164 | 169.1 | 0 | 109.3 | S134 N135 S136 | S134-K138 WeakPolarHBondContact O-CG 3.46Å; S134-K138 PolarHBondContact O-N 3.15Å; N135-K138 PolarHBondContact O-N 3.38Å; N135-K138 WeakPolarHBondContact OD1-CD 3.46Å; N135-K138 WeakPolarHBondContact OD1-CE 3.47Å; N135-K138 PolarHBondContact OD1-NZ 2.89Å; S136-K138 VanDerWaalsContact C-N 3.34Å | ||
| 139 | L | 45.2 | Very low | 60.3 | Low | 129 Ų | 129 | 105.7 Ų | 105.7 | 68% | 0.675 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -55.2 | 130.7 | 136 | -169 | 69.9 | 0 | 0 | 0 | 104.7 | N137 K141 | N137-L139 PolarHBondContact O-N 2.86Å; N137-L139 VanDerWaalsContact O-N 3.11Å; L139-K141 PolarHBondContact O-N 3.1Å |
| 140 | P | 44.5 | Very low | 60.3 | Low | 110 Ų | 110 | 105.4 Ų | 105.4 | 71% | 0.714 | 54% | 0.544 | S | S | * | . | trans | -51.6 | 113.8 | -179.6 | 20.1 | -29.6 | 0 | 0 | 0 | 106.8 | D142 | P140-D142 PolarHBondContact O-N 3.43Š| ||
| 141 | K | 39.5 | Very low | 60.5 | Low | 181 Ų | 181 | 102.9 Ų | 102.9 | 79% | 0.787 | 53% | 0.534 | S | S | * | . | trans | -46.4 | 119.7 | 173.3 | -118.6 | 174.5 | 177.5 | 179.7 | 0 | 104.8 | L139 Q143 | L139-K141 PolarHBondContact O-N 3.1Å; K141-Q143 HydrophobicContact CB-CB 4.39Å; K141-Q143 PolarHBondContact O-N 3.28Å | ||
| 142 | D | 39.4 | Very low | 60.9 | Low | 125 Ų | 125 | 103 Ų | 103 | 67% | 0.668 | 53% | 0.525 | S | S | * | . | trans | -67.9 | 49.4 | 172.5 | -156.9 | 15.6 | 0 | 0 | 0 | 108.9 | P140 R144 | P140-D142 PolarHBondContact O-N 3.43Å; D142-R144 PolarHBondContact O-N 3.3Å; D142-R144 VanDerWaalsContact O-N 3.09Å; D142-R144 WeakPolarHBondContact OD1-CG 3.5Å; D142-R144 IonicContact OD1-CZ 3.66Å; D142-R144 IonicContact OD1-NE 2.8Å; D142-R144 PolarHBondContact OD1-NE 3.42Å; D142-R144 IonicContact OD1-NH2 3.65Å; D142-R144 IonicContact OD2-NE 3.99Å | ||
| 143 | Q | 44.4 | Very low | 61.5 | Low | 110 Ų | 110 | 98.3 Ų | 98.3 | 51% | 0.514 | 51% | 0.505 | S | S | . | . | trans | -85.5 | 70.9 | 170.4 | -166 | 162.8 | 12.1 | 0 | 0 | 104.8 | K141 E145 | K141-Q143 HydrophobicContact CB-CB 4.39Å; K141-Q143 PolarHBondContact O-N 3.28Å; Q143-E145 HydrophobicContact CG-CG 3.94Å; Q143-E145 PolarHBondContact NE2-OE1 3.01Å; Q143-E145 PolarHBondContact O-N 2.78Å | ||
| 144 | R | 51.3 | Low | 62.3 | Low | 159 Ų | 159 | 95.5 Ų | 95.5 | 60% | 0.6 | 50% | 0.498 | S | S | * | . | trans | -68.7 | 64.4 | 160.8 | -58.5 | 178.5 | -165.1 | -147.3 | -4 | 107.8 | D142 | D142-R144 PolarHBondContact O-N 3.3Å; D142-R144 VanDerWaalsContact O-N 3.09Å; D142-R144 WeakPolarHBondContact OD1-CG 3.5Å; D142-R144 IonicContact OD1-CZ 3.66Å; D142-R144 IonicContact OD1-NE 2.8Å; D142-R144 PolarHBondContact OD1-NE 3.42Å; D142-R144 IonicContact OD1-NH2 3.65Å; D142-R144 IonicContact OD2-NE 3.99Å | ||
| 145 | E | 44 | Very low | 63.8 | Low | 129 Ų | 129 | 97.1 Ų | 97.1 | 60% | 0.603 | 50% | 0.496 | S | S | * | . | trans | -57.3 | 135.6 | 147.1 | -75.1 | 170.1 | -162.9 | 0 | 0 | 105.4 | Q143 F147 | Q143-E145 HydrophobicContact CG-CG 3.94Å; Q143-E145 PolarHBondContact NE2-OE1 3.01Å; Q143-E145 PolarHBondContact O-N 2.78Å; E145-F147 WeakPolarHBondContact O-CD2 3.5Å; E145-F147 PolarHBondContact O-N 3.33Å | ||
| 146 | A | 52.9 | Low | 65.6 | Low | 97 Ų | 97 | 92.7 Ų | 92.7 | 80% | 0.802 | 47% | 0.473 | S | S | * | . | trans | -59.1 | 88 | -175.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | T148 | A146-T148 PolarHBondContact O-N 3.08Å; A146-T148 VanDerWaalsContact O-N 3.08Å | ||
| 147 | F | 64 | Low | 67.3 | Low | 90 Ų | 90 | 93 Ų | 93 | 40% | 0.395 | 47% | 0.468 | S | S | . | . | trans | -53.7 | 121.1 | 180 | -81.9 | -78.1 | 0 | 0 | 0 | 107.1 | E145 D151 Y152 R155 | E145-F147 WeakPolarHBondContact O-CD2 3.5Å; E145-F147 PolarHBondContact O-N 3.33Å; F147-D151 HydrophobicContact CB-CB 4.47Å; F147-D151 HydrophobicContact CD1-CB 3.74Å; F147-Y152 HydrophobicContact CB-CD2 4.21Å; F147-Y152 HydrophobicContact CB-CE1 4.12Å; F147-Y152 HydrophobicContact CB-CE2 3.48Å; F147-Y152 VanDerWaalsContact CB-CE2 3.48Å; F147-Y152 VanDerWaalsContact CB-CZ 3.43Å; F147-Y152 WeakPolarHBondContact CB-OH 3.44Å; F147-Y152 WeakPolarHBondContact O-CE2 3.37Å; F147-R155 VanDerWaalsContact CE1-NH2 3.25Å | ||
| 148 | T | 81.4 | Confident | 69.3 | Low | 74 Ų | 74 | 96.5 Ų | 96.5 | 45% | 0.454 | 47% | 0.471 | S | S | . | . | trans | -75.6 | 157.5 | 177.8 | 62.4 | 0 | 0 | 0 | 0 | 108.9 | A146 Q150 D151 Y152 | A146-T148 PolarHBondContact O-N 3.08Å; A146-T148 VanDerWaalsContact O-N 3.08Å; T148-Q150 PolarHBondContact O-N 3.4Å; T148-D151 PolarHBondContact N-OD2 2.88Å; T148-D151 WeakPolarHBondContact O-CB 3.44Å; T148-D151 PolarHBondContact O-N 2.76Å; T148-D151 VanDerWaalsContact OG1-CG 3.22Å; T148-D151 PolarHBondContact OG1-N 3.33Å; T148-D151 PolarHBondContact OG1-OD2 3.31Å; T148-Y152 VanDerWaalsContact O-CD2 3.25Å; T148-Y152 WeakPolarHBondContact O-CD2 3.34Å; T148-Y152 PolarHBondContact O-N 2.9Å | ||
| 149 | A | 83.9 | Confident | 71.3 | Confident | 19 Ų | 19 | 100.2 Ų | 100.2 | 16% | 0.157 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -51.6 | -32.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | F153 P243 Y248 | A149-F153 WeakPolarHBondContact O-CB 3.16Å; A149-F153 PolarHBondContact O-N 3Å; A149-P243 HydrophobicContact CB-CG 3.63Å; A149-Y248 HydrophobicContact CB-CD2 3.31Å; A149-Y248 HydrophobicContact CB-CE2 3.7Å; A149-Y248 HydrophobicContact CB-CG 4.15Å |
| 150 | Q | 86.9 | Confident | 73.5 | Confident | 85 Ų | 85 | 94.8 Ų | 94.8 | 40% | 0.397 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.5 | -42.9 | 174.1 | -179.5 | 68.8 | 13.5 | 0 | 0 | 112.2 | T148 F153 Q154 Y248 | T148-Q150 PolarHBondContact O-N 3.4Å; Q150-F153 WeakPolarHBondContact O-CB 3.15Å; Q150-F153 PolarHBondContact O-N 2.61Å; Q150-Q154 WeakPolarHBondContact O-CG 2.81Å; Q150-Q154 PolarHBondContact O-N 3.16Å; Q150-Y248 PolarHBondContact OE1-OH 3.27Å |
| 151 | D | 89.2 | Confident | 75.8 | Confident | 68 Ų | 68 | 92.1 Ų | 92.1 | 36% | 0.364 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66.4 | -42.8 | -178.6 | -59.3 | -45.5 | 0 | 0 | 0 | 111.2 | F147 T148 F153 Q154 R155 | F147-D151 HydrophobicContact CB-CB 4.47Å; F147-D151 HydrophobicContact CD1-CB 3.74Å; T148-D151 PolarHBondContact N-OD2 2.88Å; T148-D151 WeakPolarHBondContact O-CB 3.44Å; T148-D151 PolarHBondContact O-N 2.76Å; T148-D151 VanDerWaalsContact OG1-CG 3.22Å; T148-D151 PolarHBondContact OG1-N 3.33Å; T148-D151 PolarHBondContact OG1-OD2 3.31Å; D151-F153 VanDerWaalsContact C-N 3.3Å; D151-F153 PolarHBondContact O-N 3.49Å; D151-Q154 PolarHBondContact O-N 3.27Å; D151-R155 PolarHBondContact O-N 2.75Å |
| 152 | Y | 90.6 | Very high | 78.2 | Confident | 45 Ų | 45 | 86 Ų | 86 | 18% | 0.176 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -61.2 | -40.9 | 172.3 | -63.9 | -70.5 | 0 | 0 | 0 | 111.3 | F147 T148 Q154 R155 P241 | F147-Y152 HydrophobicContact CB-CD2 4.21Å; F147-Y152 HydrophobicContact CB-CE1 4.12Å; F147-Y152 HydrophobicContact CB-CE2 3.48Å; F147-Y152 VanDerWaalsContact CB-CE2 3.48Å; F147-Y152 VanDerWaalsContact CB-CZ 3.43Å; F147-Y152 WeakPolarHBondContact CB-OH 3.44Å; F147-Y152 WeakPolarHBondContact O-CE2 3.37Å; T148-Y152 VanDerWaalsContact O-CD2 3.25Å; T148-Y152 WeakPolarHBondContact O-CD2 3.34Å; T148-Y152 PolarHBondContact O-N 2.9Å; Y152-Q154 VanDerWaalsContact C-N 3.34Å; Y152-Q154 PolarHBondContact O-N 2.87Å; Y152-R155 WeakPolarHBondContact O-CB 3.48Å; Y152-R155 PolarHBondContact O-N 3Å; Y152-P241 HydrophobicContact CD1-CB 4.06Å; Y152-P241 HydrophobicContact CD1-CG 3.81Å; Y152-P241 HydrophobicContact CD2-CB 3.92Å; Y152-P241 HydrophobicContact CE1-CB 4.13Å; Y152-P241 HydrophobicContact CE1-CG 3.99Å; Y152-P241 HydrophobicContact CE2-CB 3.99Å; Y152-P241 HydrophobicContact CG-CB 3.94Å; Y152-P241 HydrophobicContact CG-CG 4.12Å |
| 153 | F | 91.9 | Very high | 80.5 | Confident | 1 Ų | 1 | 81.1 Ų | 81.1 | 0% | 0.004 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -64.5 | -37.6 | 177 | -171.6 | -106.1 | 0 | 0 | 0 | 112.3 | A149 Q150 D151 R155 I156 R161 L164 K165 Y212 L245 Y248 L249 | A149-F153 WeakPolarHBondContact O-CB 3.16Å; A149-F153 PolarHBondContact O-N 3Å; Q150-F153 WeakPolarHBondContact O-CB 3.15Å; Q150-F153 PolarHBondContact O-N 2.61Å; D151-F153 VanDerWaalsContact C-N 3.3Å; D151-F153 PolarHBondContact O-N 3.49Å; F153-R155 PolarHBondContact O-N 3.05Å; F153-I156 HydrophobicContact CD2-CD1 3.81Å; F153-I156 HydrophobicContact CE2-CD1 4.14Å; F153-I156 WeakPolarHBondContact O-CB 3.45Å; F153-I156 PolarHBondContact O-N 2.75Å; F153-R161 HydrophobicContact CD1-CG 4.41Å; F153-R161 HydrophobicContact CE1-CB 4.03Å; F153-R161 HydrophobicContact CE1-CG 3.91Å; F153-R161 HydrophobicContact CE2-CG 4.42Å; F153-R161 HydrophobicContact CZ-CB 3.91Å; F153-R161 HydrophobicContact CZ-CG 3.92Å; F153-R161 WeakPolarHBondContact O-CD 3.29Å; F153-L164 HydrophobicContact CE2-CB 4.3Å; F153-L164 HydrophobicContact CE2-CD1 3.95Å; F153-L164 HydrophobicContact CZ-CB 4.46Å; F153-K165 HydrophobicContact CZ-CG 4.39Å; F153-Y212 HydrophobicContact CB-CE2 4.28Å; F153-L245 HydrophobicContact CD2-CD1 3.76Å; F153-L245 HydrophobicContact CE2-CD1 4.13Å; F153-Y248 HydrophobicContact CB-CD1 4.24Å; F153-Y248 HydrophobicContact CB-CE1 3.53Å; F153-Y248 AromaticContact CD1-CE1 3.97Å; F153-Y248 HydrophobicContact CD1-CE1 3.97Å; F153-Y248 AromaticContact CD2-CD1 3.9Å; F153-Y248 HydrophobicContact CD2-CD1 3.9Å; F153-Y248 AromaticContact CD2-CE1 3.46Å; F153-Y248 HydrophobicContact CD2-CE1 3.46Å; F153-Y248 VanDerWaalsContact CD2-CE1 3.46Å; F153-Y248 HydrophobicContact CE2-CE1 4.12Å; F153-Y248 HydrophobicContact CG-CD1 4.19Å; F153-Y248 AromaticContact CG-CE1 3.37Å; F153-Y248 HydrophobicContact CG-CE1 3.37Å; F153-L249 HydrophobicContact CE2-CD2 3.83Å; F153-L249 HydrophobicContact CZ-CD2 4.34Å |
| 154 | Q | 91.5 | Very high | 82.7 | Confident | 84 Ų | 84 | 76.1 Ų | 76.1 | 39% | 0.393 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -68.5 | -17.1 | 177 | -68.4 | -61.5 | -21.7 | 0 | 0 | 113.9 | Q150 D151 Y152 I156 R161 | Q150-Q154 WeakPolarHBondContact O-CG 2.81Å; Q150-Q154 PolarHBondContact O-N 3.16Å; D151-Q154 PolarHBondContact O-N 3.27Å; Y152-Q154 VanDerWaalsContact C-N 3.34Å; Y152-Q154 PolarHBondContact O-N 2.87Å; Q154-I156 VanDerWaalsContact C-N 3.32Å; Q154-R161 PolarHBondContact O-NH1 2.96Å; Q154-R161 VanDerWaalsContact OE1-CZ 3.24Å; Q154-R161 VanDerWaalsContact OE1-NH2 3.1Å |
| 155 | R | 90.8 | Very high | 84.3 | Confident | 83 Ų | 83 | 74.9 Ų | 74.9 | 31% | 0.313 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -70.3 | -29 | 171.8 | -63.6 | 176.9 | -172.1 | -169.8 | 3.6 | 112.8 | F147 D151 Y152 F153 D214 | F147-R155 VanDerWaalsContact CE1-NH2 3.25Å; D151-R155 PolarHBondContact O-N 2.75Å; Y152-R155 WeakPolarHBondContact O-CB 3.48Å; Y152-R155 PolarHBondContact O-N 3Å; F153-R155 PolarHBondContact O-N 3.05Å; R155-D214 IonicContact NH1-OD1 2.75Å; R155-D214 PolarHBondContact NH1-OD1 2.95Å |
| 156 | I | 93.1 | Very high | 86.1 | Confident | 0 Ų | 0 | 75.4 Ų | 75.4 | 0% | 0 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -64.4 | 136.8 | 177.8 | -58.3 | 176.4 | 0 | 0 | 0 | 109 | F153 Q154 R158 L160 R161 L164 A208 Q211 Y212 L245 | F153-I156 HydrophobicContact CD2-CD1 3.81Å; F153-I156 HydrophobicContact CE2-CD1 4.14Å; F153-I156 WeakPolarHBondContact O-CB 3.45Å; F153-I156 PolarHBondContact O-N 2.75Å; Q154-I156 VanDerWaalsContact C-N 3.32Å; I156-R158 PolarHBondContact O-N 3.42Å; I156-L160 HydrophobicContact CG2-CB 3.42Å; I156-L160 VanDerWaalsContact CG2-CB 3.42Å; I156-L160 HydrophobicContact CG2-CD1 4.23Å; I156-L160 HydrophobicContact CG2-CG 4.46Å; I156-R161 HydrophobicContact CB-CG 3.75Å; I156-R161 HydrophobicContact CG2-CG 3.8Å; I156-R161 WeakPolarHBondContact O-CD 3.38Å; I156-R161 WeakPolarHBondContact O-CG 3.43Å; I156-R161 PolarHBondContact O-NH1 2.87Å; I156-L164 HydrophobicContact CD1-CD1 3.78Å; I156-L164 HydrophobicContact CG2-CD1 4.34Å; I156-A208 HydrophobicContact CG2-CB 4.18Å; I156-Q211 VanDerWaalsContact CA-OE1 3.25Å; I156-Q211 HydrophobicContact CG1-CB 4.23Å; I156-Y212 HydrophobicContact CD1-CD2 3.99Å; I156-Y212 HydrophobicContact CD1-CG 4.44Å; I156-Y212 HydrophobicContact CG1-CD2 4.45Å; I156-L245 HydrophobicContact CD1-CD1 3.77Å; I156-L245 HydrophobicContact CD1-CD2 3.93Å |
| 157 | D | 92.8 | Very high | 86.6 | Confident | 91 Ų | 91 | 80.6 Ų | 80.6 | 49% | 0.487 | 36% | 0.363 | S | S | . | . | trans | -53 | 141.8 | 179.8 | -73 | -38.3 | 0 | 0 | 0 | 112.3 | R159 L160 R161 Q211 | D157-R159 PolarHBondContact O-N 3.19Å; D157-L160 HydrophobicContact CB-CB 4.37Å; D157-L160 HydrophobicContact CB-CD1 4.15Å; D157-L160 HydrophobicContact CB-CG 4.23Å; D157-L160 WeakPolarHBondContact O-CA 3.07Å; D157-L160 WeakPolarHBondContact O-CB 3.36Å; D157-L160 PolarHBondContact O-N 3.27Å; D157-R161 PolarHBondContact O-N 3.09Å; D157-Q211 PolarHBondContact OD2-NE2 3.13Å | ||
| 158 | R | 91.1 | Very high | 87.2 | Confident | 207 Ų | 207 | 84.8 Ų | 84.8 | 78% | 0.781 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -47.9 | -40.1 | -179.7 | -177.9 | -178.4 | 173.6 | -156.9 | -1.1 | 113.1 | I156 A162 | I156-R158 PolarHBondContact O-N 3.42Å; R158-A162 WeakPolarHBondContact O-CB 3.23Å; R158-A162 PolarHBondContact O-N 3.05Å |
| 159 | R | 89 | Confident | 87.3 | Confident | 218 Ų | 218 | 82.5 Ų | 82.5 | 82% | 0.823 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -70.1 | -37.2 | 179.9 | -65.9 | 177.9 | 67 | -173.2 | 0.1 | 112.7 | D157 T163 | D157-R159 PolarHBondContact O-N 3.19Å; R159-T163 PolarHBondContact O-N 3.2Å; R159-T163 PolarHBondContact O-OG1 2.9Å |
| 160 | L | 90.9 | Very high | 87.6 | Confident | 15 Ų | 15 | 84.3 Ų | 84.3 | 8% | 0.079 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -70.2 | -45.9 | 175.8 | -69.6 | 176.3 | 0 | 0 | 0 | 109.9 | I156 D157 A162 T163 L164 L204 H207 A208 | I156-L160 HydrophobicContact CG2-CB 3.42Å; I156-L160 VanDerWaalsContact CG2-CB 3.42Å; I156-L160 HydrophobicContact CG2-CD1 4.23Å; I156-L160 HydrophobicContact CG2-CG 4.46Å; D157-L160 HydrophobicContact CB-CB 4.37Å; D157-L160 HydrophobicContact CB-CD1 4.15Å; D157-L160 HydrophobicContact CB-CG 4.23Å; D157-L160 WeakPolarHBondContact O-CA 3.07Å; D157-L160 WeakPolarHBondContact O-CB 3.36Å; D157-L160 PolarHBondContact O-N 3.27Å; L160-A162 VanDerWaalsContact C-N 3.3Å; L160-A162 PolarHBondContact O-N 3.44Å; L160-T163 CarbonylContact O-C 3.45Å; L160-T163 WeakPolarHBondContact O-CA 3.26Å; L160-T163 WeakPolarHBondContact O-CB 3.31Å; L160-T163 PolarHBondContact O-N 3.21Å; L160-L164 WeakPolarHBondContact O-CG 3.28Å; L160-L164 PolarHBondContact O-N 2.85Å; L160-L204 HydrophobicContact CD2-CD1 3.27Å; L160-L204 HydrophobicContact CD2-CD2 4.3Å; L160-L204 HydrophobicContact CD2-CG 3.46Å; L160-L204 VanDerWaalsContact CD2-CG 3.46Å; L160-H207 HydrophobicContact CD1-CB 4.39Å; L160-A208 HydrophobicContact CB-CB 4.27Å; L160-A208 HydrophobicContact CD1-CB 4.17Å; L160-A208 HydrophobicContact CD2-CB 4.49Å |
| 161 | R | 93.3 | Very high | 87.8 | Confident | 53 Ų | 53 | 82.8 Ų | 82.8 | 20% | 0.2 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -55.3 | -43.7 | 173.7 | -62.6 | -168.5 | -51.9 | -117.7 | 19.4 | 112.6 | F153 Q154 I156 D157 T163 L164 K165 | F153-R161 HydrophobicContact CD1-CG 4.41Å; F153-R161 HydrophobicContact CE1-CB 4.03Å; F153-R161 HydrophobicContact CE1-CG 3.91Å; F153-R161 HydrophobicContact CE2-CG 4.42Å; F153-R161 HydrophobicContact CZ-CB 3.91Å; F153-R161 HydrophobicContact CZ-CG 3.92Å; F153-R161 WeakPolarHBondContact O-CD 3.29Å; Q154-R161 PolarHBondContact O-NH1 2.96Å; Q154-R161 VanDerWaalsContact OE1-CZ 3.24Å; Q154-R161 VanDerWaalsContact OE1-NH2 3.1Å; I156-R161 HydrophobicContact CB-CG 3.75Å; I156-R161 HydrophobicContact CG2-CG 3.8Å; I156-R161 WeakPolarHBondContact O-CD 3.38Å; I156-R161 WeakPolarHBondContact O-CG 3.43Å; I156-R161 PolarHBondContact O-NH1 2.87Å; D157-R161 PolarHBondContact O-N 3.09Å; R161-T163 PolarHBondContact O-N 3.26Å; R161-L164 CarbonylContact O-C 3.5Å; R161-L164 PolarHBondContact O-N 3.33Å; R161-L164 VanDerWaalsContact O-N 3.16Å; R161-K165 WeakPolarHBondContact O-CG 3.41Å; R161-K165 PolarHBondContact O-N 3.25Å |
| 162 | A | 89.4 | Confident | 87.9 | Confident | 52 Ų | 52 | 81.4 Ų | 81.4 | 43% | 0.43 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.5 | -30 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | R158 L160 | R158-A162 WeakPolarHBondContact O-CB 3.23Å; R158-A162 PolarHBondContact O-N 3.05Å; L160-A162 VanDerWaalsContact C-N 3.3Å; L160-A162 PolarHBondContact O-N 3.44Å |
| 163 | T | 88.8 | Confident | 88 | Confident | 23 Ų | 23 | 81.2 Ų | 81.2 | 14% | 0.141 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -76.3 | -39.2 | 174.2 | -53.4 | 0 | 0 | 0 | 0 | 111 | R159 L160 R161 K165 R166 F201 L204 | R159-T163 PolarHBondContact O-N 3.2Å; R159-T163 PolarHBondContact O-OG1 2.9Å; L160-T163 CarbonylContact O-C 3.45Å; L160-T163 WeakPolarHBondContact O-CA 3.26Å; L160-T163 WeakPolarHBondContact O-CB 3.31Å; L160-T163 PolarHBondContact O-N 3.21Å; R161-T163 PolarHBondContact O-N 3.26Å; T163-K165 VanDerWaalsContact C-N 3.29Å; T163-K165 PolarHBondContact O-N 2.9Å; T163-R166 WeakPolarHBondContact O-CB 3.49Å; T163-R166 PolarHBondContact O-N 3.37Å; T163-F201 HydrophobicContact CG2-CE2 4.3Å; T163-L204 HydrophobicContact CG2-CD2 3.91Å |
| 164 | L | 89.2 | Confident | 88.1 | Confident | 6 Ų | 6 | 81.2 Ų | 81.2 | 3% | 0.031 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -72 | -12.3 | 177.7 | -66.7 | 178.1 | 0 | 0 | 0 | 114.9 | F153 I156 L160 R161 I169 L205 A208 L245 L249 | F153-L164 HydrophobicContact CE2-CB 4.3Å; F153-L164 HydrophobicContact CE2-CD1 3.95Å; F153-L164 HydrophobicContact CZ-CB 4.46Å; I156-L164 HydrophobicContact CD1-CD1 3.78Å; I156-L164 HydrophobicContact CG2-CD1 4.34Å; L160-L164 WeakPolarHBondContact O-CG 3.28Å; L160-L164 PolarHBondContact O-N 2.85Å; R161-L164 CarbonylContact O-C 3.5Å; R161-L164 PolarHBondContact O-N 3.33Å; R161-L164 VanDerWaalsContact O-N 3.16Å; L164-I169 HydrophobicContact CB-CD1 4.39Å; L164-I169 WeakPolarHBondContact O-CD1 3.41Å; L164-L205 HydrophobicContact CD2-CD2 3.96Å; L164-A208 HydrophobicContact CD1-CB 3.96Å; L164-L245 HydrophobicContact CD1-CD1 4.35Å; L164-L245 HydrophobicContact CD1-CD2 3.99Å; L164-L249 HydrophobicContact CB-CD1 4.15Å; L164-L249 HydrophobicContact CB-CD2 4.2Å; L164-L249 HydrophobicContact CD1-CD1 4.42Å; L164-L249 HydrophobicContact CD2-CD1 3.95Å; L164-L249 HydrophobicContact CG-CD1 4.4Å |
| 165 | K | 86.1 | Confident | 88.3 | Confident | 132 Ų | 132 | 80.8 Ų | 80.8 | 57% | 0.574 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.5 | 0.6 | 173.5 | -71.3 | -174.3 | 178.2 | -164.5 | 0 | 113.7 | F153 R161 T163 | F153-K165 HydrophobicContact CZ-CG 4.39Å; R161-K165 WeakPolarHBondContact O-CG 3.41Å; R161-K165 PolarHBondContact O-N 3.25Å; T163-K165 VanDerWaalsContact C-N 3.29Å; T163-K165 PolarHBondContact O-N 2.9Å |
| 166 | R | 81.5 | Confident | 88.6 | Confident | 141 Ų | 141 | 80.5 Ų | 80.5 | 53% | 0.532 | 38% | 0.383 | S | S | . | . | S | Bend | trans | -81.6 | 137.8 | -179.4 | -65.9 | -179.8 | 178.5 | 149.4 | 0.9 | 110 | T163 Q168 I169 | T163-R166 WeakPolarHBondContact O-CB 3.49Å; T163-R166 PolarHBondContact O-N 3.37Å; R166-Q168 PolarHBondContact O-N 3.07Å; R166-I169 WeakPolarHBondContact O-CD1 3.49Å |
| 167 | K | 63.1 | Low | 88.7 | Confident | 206 Ų | 206 | 81.1 Ų | 81.1 | 90% | 0.896 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | 8.1 | -177.6 | -62.6 | -168.2 | 175 | -167.7 | 0 | 117.1 | ||
| 168 | Q | 76.2 | Confident | 88.9 | Confident | 177 Ų | 177 | 76.8 Ų | 76.8 | 83% | 0.827 | 36% | 0.363 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -134.9 | 39.5 | -174.3 | -63.9 | -173.7 | 15.8 | 0 | 0 | 112.7 | R166 P170 | R166-Q168 PolarHBondContact O-N 3.07Å; Q168-P170 WeakPolarHBondContact O-CD 3.5Å |
| 169 | I | 83.9 | Confident | 89.2 | Confident | 27 Ų | 27 | 72.7 Ų | 72.7 | 14% | 0.138 | 35% | 0.353 | C | S | . | . | trans | -84.6 | 126.7 | 173.6 | -63.1 | 137.8 | 0 | 0 | 0 | 108.4 | L164 R166 I171 L205 | L164-I169 HydrophobicContact CB-CD1 4.39Å; L164-I169 WeakPolarHBondContact O-CD1 3.41Å; R166-I169 WeakPolarHBondContact O-CD1 3.49Å; I169-I171 VanDerWaalsContact C-N 3.32Å; I169-I171 PolarHBondContact O-N 3.39Å; I169-L205 HydrophobicContact CG2-CD2 4.39Å | ||
| 170 | P | 89.3 | Confident | 89.5 | Confident | 57 Ų | 57 | 65.5 Ų | 65.5 | 37% | 0.37 | 33% | 0.331 | S | S | . | . | trans | -67.6 | 90.8 | 171.1 | -17.7 | 32.8 | 0 | 0 | 0 | 109.8 | Q168 G172 T173 L174 F201 | Q168-P170 WeakPolarHBondContact O-CD 3.5Å; P170-G172 VanDerWaalsContact C-N 3.28Å; P170-G172 PolarHBondContact O-N 3.14Å; P170-T173 WeakPolarHBondContact CB-OG1 3.44Å; P170-T173 WeakPolarHBondContact O-CB 3.43Å; P170-T173 PolarHBondContact O-N 2.89Å; P170-L174 PolarHBondContact O-N 2.84Å; P170-F201 HydrophobicContact CG-CE1 4.02Å | ||
| 171 | I | 91.4 | Very high | 89.8 | Confident | 53 Ų | 53 | 64.8 Ų | 64.8 | 27% | 0.272 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -56.1 | -43.1 | -178.4 | -69.2 | 152.2 | 0 | 0 | 0 | 110.9 | I169 T173 L174 E175 E250 | I169-I171 VanDerWaalsContact C-N 3.32Å; I169-I171 PolarHBondContact O-N 3.39Å; I171-T173 PolarHBondContact O-N 3.44Å; I171-L174 WeakPolarHBondContact O-CA 3.41Å; I171-L174 WeakPolarHBondContact O-CB 3.48Å; I171-L174 PolarHBondContact O-N 3.33Å; I171-E175 HydrophobicContact CG2-CG 4.3Å; I171-E175 PolarHBondContact O-N 2.8Å; I171-E250 HydrophobicContact CD1-CG 3.89Å; I171-E250 HydrophobicContact CG1-CG 4.49Å; I171-E250 HydrophobicContact CG2-CG 4.2Å |
| 172 | G | 92.3 | Very high | 89.9 | Confident | 38 Ų | 38 | 65.6 Ų | 65.6 | 39% | 0.392 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.1 | -29.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | P170 L174 V176 | P170-G172 VanDerWaalsContact C-N 3.28Å; P170-G172 PolarHBondContact O-N 3.14Å; G172-L174 VanDerWaalsContact C-N 3.32Å; G172-V176 VanDerWaalsContact O-CG2 3.31Å; G172-V176 WeakPolarHBondContact O-CG2 3.34Å; G172-V176 PolarHBondContact O-N 2.97Å |
| 173 | T | 92.3 | Very high | 90.2 | Very high | 42 Ų | 42 | 66.5 Ų | 66.5 | 26% | 0.258 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -69.4 | -35.5 | 171.7 | -56 | 0 | 0 | 0 | 0 | 111.1 | P170 I171 L177 E202 L205 | P170-T173 WeakPolarHBondContact CB-OG1 3.44Å; P170-T173 WeakPolarHBondContact O-CB 3.43Å; P170-T173 PolarHBondContact O-N 2.89Å; I171-T173 PolarHBondContact O-N 3.44Å; T173-L177 HydrophobicContact CG2-CD1 4.41Å; T173-L177 VanDerWaalsContact O-CG 3.28Å; T173-L177 WeakPolarHBondContact O-CG 3.49Å; T173-L177 PolarHBondContact O-N 2.8Å; T173-E202 HydrophobicContact CG2-CG 3.99Å; T173-L205 HydrophobicContact CG2-CD1 4.16Å |
| 174 | L | 94 | Very high | 90.6 | Very high | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -67.3 | -46.9 | 177.3 | -157.2 | 68.6 | 0 | 0 | 0 | 110.9 | P170 I171 G172 V176 L177 E178 L205 V209 L245 L249 | P170-L174 PolarHBondContact O-N 2.84Å; I171-L174 WeakPolarHBondContact O-CA 3.41Å; I171-L174 WeakPolarHBondContact O-CB 3.48Å; I171-L174 PolarHBondContact O-N 3.33Å; G172-L174 VanDerWaalsContact C-N 3.32Å; L174-V176 VanDerWaalsContact C-N 3.34Å; L174-V176 PolarHBondContact O-N 3.16Å; L174-L177 PolarHBondContact O-N 3.02Å; L174-L177 VanDerWaalsContact O-N 3.13Å; L174-E178 WeakPolarHBondContact O-CB 3.36Å; L174-E178 VanDerWaalsContact O-CG 3.29Å; L174-E178 WeakPolarHBondContact O-CG 3.48Å; L174-E178 PolarHBondContact O-N 3.03Å; L174-L205 HydrophobicContact CD1-CB 4.07Å; L174-L205 HydrophobicContact CD1-CD2 4.4Å; L174-V209 HydrophobicContact CD1-CG2 3.36Å; L174-V209 HydrophobicContact CG-CG2 3.99Å; L174-L245 HydrophobicContact CD1-CD2 4.37Å; L174-L245 HydrophobicContact CD2-CB 4.31Å; L174-L245 HydrophobicContact CD2-CD2 4.06Å; L174-L245 HydrophobicContact CD2-CG 3.9Å; L174-L249 HydrophobicContact CD2-CD1 3.79Å |
| 175 | E | 95.8 | Very high | 90.9 | Very high | 75 Ų | 75 | 67.5 Ų | 67.5 | 35% | 0.35 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -54.6 | -48 | 176.3 | -68.7 | 172.1 | 168.4 | 0 | 0 | 111.7 | I171 L177 E178 E179 | I171-E175 HydrophobicContact CG2-CG 4.3Å; I171-E175 PolarHBondContact O-N 2.8Å; E175-L177 VanDerWaalsContact C-N 3.34Å; E175-L177 PolarHBondContact O-N 3.49Å; E175-E178 WeakPolarHBondContact O-CB 3.4Å; E175-E178 PolarHBondContact O-N 2.92Å; E175-E179 WeakPolarHBondContact O-CB 3.5Å; E175-E179 WeakPolarHBondContact O-CG 3.35Å; E175-E179 PolarHBondContact O-N 3.31Å |
| 176 | V | 96.5 | Very high | 91.1 | Very high | 78 Ų | 78 | 63.9 Ų | 63.9 | 47% | 0.473 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 178.4 | 171.1 | 0 | 0 | 0 | 0 | 111.6 | G172 L174 E178 N180 | G172-V176 VanDerWaalsContact O-CG2 3.31Å; G172-V176 WeakPolarHBondContact O-CG2 3.34Å; G172-V176 PolarHBondContact O-N 2.97Å; L174-V176 VanDerWaalsContact C-N 3.34Å; L174-V176 PolarHBondContact O-N 3.16Å; V176-E178 VanDerWaalsContact C-N 3.33Å; V176-N180 WeakPolarHBondContact O-CB 3.29Å; V176-N180 PolarHBondContact O-N 3.49Å; V176-N180 VanDerWaalsContact O-N 3.09Å; V176-N180 PolarHBondContact O-ND2 3.03Å |
| 177 | L | 96.4 | Very high | 91.7 | Very high | 12 Ų | 12 | 61 Ų | 61 | 6% | 0.063 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -65.1 | -40.5 | 176.9 | -69 | 171.8 | 0 | 0 | 0 | 111.5 | T173 L174 E175 L181 L205 L206 | T173-L177 HydrophobicContact CG2-CD1 4.41Å; T173-L177 VanDerWaalsContact O-CG 3.28Å; T173-L177 WeakPolarHBondContact O-CG 3.49Å; T173-L177 PolarHBondContact O-N 2.8Å; L174-L177 PolarHBondContact O-N 3.02Å; L174-L177 VanDerWaalsContact O-N 3.13Å; E175-L177 VanDerWaalsContact C-N 3.34Å; E175-L177 PolarHBondContact O-N 3.49Å; L177-L181 WeakPolarHBondContact O-CG 3.3Å; L177-L181 PolarHBondContact O-N 3.14Å; L177-L205 HydrophobicContact CD1-CB 3.86Å; L177-L206 HydrophobicContact CD1-CB 4.24Å; L177-L206 HydrophobicContact CD2-CB 4.44Å; L177-L206 HydrophobicContact CD2-CD1 4.35Å |
| 178 | E | 96.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63.8 | -48 | 177.2 | -75 | -172.5 | 127 | 0 | 0 | 112.5 | L174 E175 V176 N180 L181 L182 V209 M213 M244 L245 S246 | L174-E178 WeakPolarHBondContact O-CB 3.36Å; L174-E178 VanDerWaalsContact O-CG 3.29Å; L174-E178 WeakPolarHBondContact O-CG 3.48Å; L174-E178 PolarHBondContact O-N 3.03Å; E175-E178 WeakPolarHBondContact O-CB 3.4Å; E175-E178 PolarHBondContact O-N 2.92Å; V176-E178 VanDerWaalsContact C-N 3.33Å; E178-N180 VanDerWaalsContact C-N 3.33Å; E178-N180 PolarHBondContact O-N 2.9Å; E178-L181 PolarHBondContact O-N 2.86Å; E178-L182 VanDerWaalsContact O-CB 3.26Å; E178-L182 WeakPolarHBondContact O-CB 3.27Å; E178-L182 PolarHBondContact O-N 2.83Å; E178-V209 HydrophobicContact CB-CG1 4.49Å; E178-V209 HydrophobicContact CG-CB 4.44Å; E178-V209 HydrophobicContact CG-CG1 3.59Å; E178-V209 HydrophobicContact CG-CG2 3.91Å; E178-M213 HydrophobicContact CB-CE 3.8Å; E178-M213 HydrophobicContact CG-CE 3.75Å; E178-M244 HydrophobicContact CB-CE 3.62Å; E178-M244 HydrophobicContact CG-CE 4.3Å; E178-L245 WeakPolarHBondContact OE1-CA 3.41Å; E178-L245 WeakPolarHBondContact OE1-CB 3.42Å; E178-L245 PolarHBondContact OE1-N 3.09Å; E178-S246 WeakPolarHBondContact OE2-CB 3.41Å; E178-S246 PolarHBondContact OE2-N 3.28Å; E178-S246 PolarHBondContact OE2-OG 3.3Å |
| 179 | E | 96.5 | Very high | 93.9 | Very high | 122 Ų | 122 | 48.5 Ų | 48.5 | 57% | 0.57 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -61.3 | -40.5 | 177.5 | -74.1 | 179.8 | 176.4 | 0 | 0 | 112.1 | E175 L181 L182 S183 | E175-E179 WeakPolarHBondContact O-CB 3.5Å; E175-E179 WeakPolarHBondContact O-CG 3.35Å; E175-E179 PolarHBondContact O-N 3.31Å; E179-L181 PolarHBondContact O-N 3.39Å; E179-L182 PolarHBondContact O-N 2.9Å; E179-S183 VanDerWaalsContact O-CB 3.27Å; E179-S183 WeakPolarHBondContact O-CB 3.46Å; E179-S183 PolarHBondContact O-N 2.76Å; E179-S183 PolarHBondContact O-OG 3.08Å |
| 180 | N | 96.7 | Very high | 94.2 | Very high | 66 Ų | 66 | 53.5 Ų | 53.5 | 35% | 0.353 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 176.7 | -74.5 | -36.7 | 0 | 0 | 0 | 111.7 | V176 E178 S183 F184 | V176-N180 WeakPolarHBondContact O-CB 3.29Å; V176-N180 PolarHBondContact O-N 3.49Å; V176-N180 VanDerWaalsContact O-N 3.09Å; V176-N180 PolarHBondContact O-ND2 3.03Å; E178-N180 VanDerWaalsContact C-N 3.33Å; E178-N180 PolarHBondContact O-N 2.9Å; N180-S183 PolarHBondContact O-OG 3.35Å; N180-S183 VanDerWaalsContact O-OG 3.06Å; N180-F184 VanDerWaalsContact O-CB 3.23Å; N180-F184 WeakPolarHBondContact O-CB 3.47Å; N180-F184 PolarHBondContact O-N 3.18Å; N180-F184 VanDerWaalsContact O-N 3.08Å |
| 181 | L | 96.2 | Very high | 94.5 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -70.6 | -42.3 | 177.6 | -66.7 | 174.3 | 0 | 0 | 0 | 111.5 | L177 E178 E179 F184 F185 Y193 L206 V209 M213 L215 V230 | L177-L181 WeakPolarHBondContact O-CG 3.3Å; L177-L181 PolarHBondContact O-N 3.14Å; E178-L181 PolarHBondContact O-N 2.86Å; E179-L181 PolarHBondContact O-N 3.39Å; L181-F184 PolarHBondContact O-N 3.44Å; L181-F185 HydrophobicContact CB-CD2 4.41Å; L181-F185 HydrophobicContact CD2-CD2 4.39Å; L181-F185 HydrophobicContact CD2-CE2 3.93Å; L181-F185 WeakPolarHBondContact O-CB 3.36Å; L181-F185 WeakPolarHBondContact O-CD2 3.44Å; L181-F185 PolarHBondContact O-N 2.86Å; L181-Y193 HydrophobicContact CD2-CD1 3.6Å; L181-Y193 HydrophobicContact CD2-CE1 3.91Å; L181-Y193 HydrophobicContact CD2-CG 4.04Å; L181-L206 HydrophobicContact CD1-CD1 3.78Å; L181-L206 HydrophobicContact CD2-CD1 4.31Å; L181-L206 HydrophobicContact CG-CD1 4.27Å; L181-V209 HydrophobicContact CD1-CB 4.4Å; L181-V209 HydrophobicContact CD1-CG1 3.66Å; L181-M213 HydrophobicContact CB-SD 4.2Å; L181-M213 HydrophobicContact CD1-SD 4.34Å; L181-L215 HydrophobicContact CB-CD1 4.44Å; L181-L215 HydrophobicContact CD1-CD1 4.19Å; L181-L215 HydrophobicContact CD2-CD1 4.47Å; L181-V230 HydrophobicContact CD2-CB 4.3Å; L181-V230 HydrophobicContact CD2-CG1 4.09Å; L181-V230 HydrophobicContact CD2-CG2 4.34Å |
| 182 | L | 95.4 | Very high | 94.7 | Very high | 70 Ų | 70 | 54.4 Ų | 54.4 | 37% | 0.366 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -63.8 | -44.4 | -179.3 | -172.8 | 148 | 0 | 0 | 0 | 111.5 | E178 E179 G186 P240 M244 | E178-L182 VanDerWaalsContact O-CB 3.26Å; E178-L182 WeakPolarHBondContact O-CB 3.27Å; E178-L182 PolarHBondContact O-N 2.83Å; E179-L182 PolarHBondContact O-N 2.9Å; L182-G186 WeakPolarHBondContact O-CA 3.45Å; L182-G186 PolarHBondContact O-N 3.11Å; L182-P240 HydrophobicContact CD1-CB 4.07Å; L182-P240 HydrophobicContact CD1-CG 3.94Å; L182-P240 HydrophobicContact CG-CG 4.42Å; L182-M244 HydrophobicContact CD1-CE 3.62Å |
| 183 | S | 95.7 | Very high | 94.9 | Very high | 71 Ų | 71 | 54.2 Ų | 54.2 | 50% | 0.497 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -66 | -44.3 | 175.9 | 58 | 0 | 0 | 0 | 0 | 112.2 | E179 N180 A187 | E179-S183 VanDerWaalsContact O-CB 3.27Å; E179-S183 WeakPolarHBondContact O-CB 3.46Å; E179-S183 PolarHBondContact O-N 2.76Å; E179-S183 PolarHBondContact O-OG 3.08Å; N180-S183 PolarHBondContact O-OG 3.35Å; N180-S183 VanDerWaalsContact O-OG 3.06Å; S183-A187 PolarHBondContact O-N 3.02Å |
| 184 | F | 96.8 | Very high | 95.1 | Very high | 50 Ų | 50 | 55.5 Ų | 55.5 | 22% | 0.219 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -64.5 | -54.9 | -179.9 | -178 | -90.7 | 0 | 0 | 0 | 112.3 | N180 L181 G186 A187 Q188 V192 Y193 | N180-F184 VanDerWaalsContact O-CB 3.23Å; N180-F184 WeakPolarHBondContact O-CB 3.47Å; N180-F184 PolarHBondContact O-N 3.18Å; N180-F184 VanDerWaalsContact O-N 3.08Å; L181-F184 PolarHBondContact O-N 3.44Å; F184-G186 VanDerWaalsContact C-N 3.32Å; F184-G186 PolarHBondContact O-N 3.42Å; F184-A187 PolarHBondContact O-N 3.01Å; F184-Q188 PolarHBondContact O-N 3.3Å; F184-V192 WeakPolarHBondContact CZ-O 3.44Å; F184-Y193 HydrophobicContact CB-CD2 4Å; F184-Y193 HydrophobicContact CD1-CD2 4.11Å; F184-Y193 HydrophobicContact CD1-CG 4.32Å; F184-Y193 AromaticContact CD2-CD2 3.8Å; F184-Y193 HydrophobicContact CD2-CD2 3.8Å; F184-Y193 HydrophobicContact CE2-CD2 4.28Å; F184-Y193 AromaticContact CG-CD2 3.69Å; F184-Y193 HydrophobicContact CG-CD2 3.69Å; F184-Y193 HydrophobicContact CG-CG 4.35Å |
| 185 | F | 95.5 | Very high | 95.2 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -75.6 | -21 | -177.6 | -72.5 | -69.2 | 0 | 0 | 0 | 113.1 | L181 A187 P189 S191 L215 V230 N232 F238 | L181-F185 HydrophobicContact CB-CD2 4.41Å; L181-F185 HydrophobicContact CD2-CD2 4.39Å; L181-F185 HydrophobicContact CD2-CE2 3.93Å; L181-F185 WeakPolarHBondContact O-CB 3.36Å; L181-F185 WeakPolarHBondContact O-CD2 3.44Å; L181-F185 PolarHBondContact O-N 2.86Å; F185-A187 VanDerWaalsContact C-N 3.33Å; F185-P189 WeakPolarHBondContact O-CA 3.42Å; F185-P189 WeakPolarHBondContact O-CG 3.41Å; F185-S191 VanDerWaalsContact CE1-O 3.26Å; F185-S191 WeakPolarHBondContact CE1-O 3.38Å; F185-L215 HydrophobicContact CD2-CD1 3.83Å; F185-L215 HydrophobicContact CD2-CD2 4.21Å; F185-L215 HydrophobicContact CE2-CD1 3.71Å; F185-L215 HydrophobicContact CE2-CD2 4.15Å; F185-L215 HydrophobicContact CZ-CD2 4.35Å; F185-V230 HydrophobicContact CE2-CB 4.45Å; F185-V230 HydrophobicContact CE2-CG1 3.9Å; F185-V230 HydrophobicContact CZ-CB 4.42Å; F185-V230 HydrophobicContact CZ-CG1 4.05Å; F185-N232 HydrophobicContact CD1-CB 3.98Å; F185-N232 HydrophobicContact CE1-CB 3.91Å; F185-F238 HydrophobicContact CB-CB 3.91Å; F185-F238 HydrophobicContact CB-CD1 3.57Å; F185-F238 HydrophobicContact CB-CD2 3.89Å; F185-F238 HydrophobicContact CB-CE1 4.01Å; F185-F238 HydrophobicContact CB-CE2 4.31Å; F185-F238 HydrophobicContact CB-CG 3.5Å; F185-F238 VanDerWaalsContact CB-CG 3.5Å; F185-F238 HydrophobicContact CB-CZ 4.35Å; F185-F238 HydrophobicContact CG-CD2 4.47Å; F185-F238 HydrophobicContact CG-CG 4.5Å |
| 186 | G | 92 | Very high | 95.1 | Very high | 57 Ų | 57 | 57.8 Ų | 57.8 | 59% | 0.588 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -65.6 | -35.2 | 168.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | L182 F184 | L182-G186 WeakPolarHBondContact O-CA 3.45Å; L182-G186 PolarHBondContact O-N 3.11Å; F184-G186 VanDerWaalsContact C-N 3.32Å; F184-G186 PolarHBondContact O-N 3.42Å |
| 187 | A | 93.4 | Very high | 94.8 | Very high | 79 Ų | 79 | 55 Ų | 55 | 65% | 0.653 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -86.1 | -37.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | S183 F184 F185 | S183-A187 PolarHBondContact O-N 3.02Å; F184-A187 PolarHBondContact O-N 3.01Å; F185-A187 VanDerWaalsContact C-N 3.33Å |
| 188 | Q | 93.1 | Very high | 94.3 | Very high | 100 Ų | 100 | 58.3 Ų | 58.3 | 47% | 0.467 | 36% | 0.355 | S | S | . | . | trans | -137.5 | 78.6 | -172.5 | -63.7 | -176.6 | -16 | 0 | 0 | 111.6 | F184 H190 S191 | F184-Q188 PolarHBondContact O-N 3.3Å; Q188-H190 VanDerWaalsContact C-N 3.27Å; Q188-H190 PolarHBondContact O-N 3.41Å; Q188-H190 VanDerWaalsContact O-N 3.17Å; Q188-S191 PolarHBondContact O-N 3.2Å | ||
| 189 | P | 91.8 | Very high | 94.1 | Very high | 22 Ų | 22 | 60.3 Ų | 60.3 | 14% | 0.143 | 37% | 0.369 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.7 | -29.8 | -172.8 | -24.3 | 32.9 | 0 | 0 | 0 | 115 | F185 N232 L237 F238 | F185-P189 WeakPolarHBondContact O-CA 3.42Å; F185-P189 WeakPolarHBondContact O-CG 3.41Å; P189-N232 WeakPolarHBondContact O-CB 3.32Å; P189-N232 PolarHBondContact O-ND2 2.94Å; P189-L237 HydrophobicContact CG-CD2 4.41Å; P189-F238 HydrophobicContact CB-CB 4.31Å |
| 190 | H | 91.6 | Very high | 93.9 | Very high | 131 Ų | 131 | 58.8 Ų | 58.8 | 61% | 0.606 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.5 | 4.5 | -175.5 | -53.3 | 90.4 | 0 | 0 | 0 | 114 | Q188 E235 | Q188-H190 VanDerWaalsContact C-N 3.27Å; Q188-H190 PolarHBondContact O-N 3.41Å; Q188-H190 VanDerWaalsContact O-N 3.17Å; H190-E235 PolarHBondContact NE2-O 3.17Å |
| 191 | S | 93.9 | Very high | 93.7 | Very high | 46 Ų | 46 | 59.2 Ų | 59.2 | 32% | 0.322 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -86.2 | 162.3 | 179.2 | -66.2 | 0 | 0 | 0 | 0 | 111.6 | F185 Q188 | F185-S191 VanDerWaalsContact CE1-O 3.26Å; F185-S191 WeakPolarHBondContact CE1-O 3.38Å; Q188-S191 PolarHBondContact O-N 3.2Å |
| 192 | V | 96.6 | Very high | 93.6 | Very high | 84 Ų | 84 | 62.6 Ų | 62.6 | 51% | 0.509 | 39% | 0.387 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.8 | 121.8 | 176.1 | -179.2 | 0 | 0 | 0 | 0 | 108.9 | F184 D229 V230 | F184-V192 WeakPolarHBondContact CZ-O 3.44Å; V192-D229 HydrophobicContact CG1-CB 3.96Å; V192-V230 WeakPolarHBondContact CA-O 3.26Å |
| 193 | Y | 97 | Very high | 93.6 | Very high | 34 Ų | 34 | 61.3 Ų | 61.3 | 13% | 0.133 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.4 | 120 | 172 | 175.4 | -99.3 | 0 | 0 | 0 | 109.3 | L181 F184 T195 D229 V230 | L181-Y193 HydrophobicContact CD2-CD1 3.6Å; L181-Y193 HydrophobicContact CD2-CE1 3.91Å; L181-Y193 HydrophobicContact CD2-CG 4.04Å; F184-Y193 HydrophobicContact CB-CD2 4Å; F184-Y193 HydrophobicContact CD1-CD2 4.11Å; F184-Y193 HydrophobicContact CD1-CG 4.32Å; F184-Y193 AromaticContact CD2-CD2 3.8Å; F184-Y193 HydrophobicContact CD2-CD2 3.8Å; F184-Y193 HydrophobicContact CE2-CD2 4.28Å; F184-Y193 AromaticContact CG-CD2 3.69Å; F184-Y193 HydrophobicContact CG-CD2 3.69Å; F184-Y193 HydrophobicContact CG-CG 4.35Å; Y193-T195 HydrophobicContact CD1-CG2 4.41Å; Y193-T195 HydrophobicContact CE1-CG2 3.67Å; Y193-D229 CarbonylContact O-C 3.51Å; Y193-D229 WeakPolarHBondContact O-CA 3.33Å; Y193-V230 HydrophobicContact CD1-CB 4.19Å; Y193-V230 HydrophobicContact CD1-CG2 4.06Å; Y193-V230 PolarHBondContact N-O 3.36Å; Y193-V230 PolarHBondContact O-N 2.9Å |
| 194 | T | 96.4 | Very high | 93.5 | Very high | 69 Ų | 69 | 60.9 Ų | 60.9 | 42% | 0.423 | 37% | 0.369 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 128.3 | -178.9 | -69.7 | 0 | 0 | 0 | 0 | 110.2 | Q227 D229 | T194-Q227 HydrophobicContact CG2-CG 3.55Å; T194-D229 WeakPolarHBondContact CB-OD1 3.43Å; T194-D229 WeakPolarHBondContact CG2-OD1 3.33Å; T194-D229 PolarHBondContact OG1-OD1 2.94Å |
| 195 | T | 95.7 | Very high | 93.5 | Very high | 26 Ų | 26 | 58.6 Ų | 58.6 | 16% | 0.16 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.1 | 148.6 | 178.2 | -173.1 | 0 | 0 | 0 | 0 | 112.8 | Y193 L197 L206 T228 | Y193-T195 HydrophobicContact CD1-CG2 4.41Å; Y193-T195 HydrophobicContact CE1-CG2 3.67Å; T195-L197 HydrophobicContact CG2-CD1 4.34Å; T195-L197 HydrophobicContact CG2-CG 4.1Å; T195-L206 HydrophobicContact CG2-CD2 3.58Å; T195-T228 PolarHBondContact N-O 3.45Å; T195-T228 PolarHBondContact O-N 3.47Å |
| 196 | N | 94.1 | Very high | 93.5 | Very high | 97 Ų | 97 | 58.6 Ų | 58.6 | 52% | 0.519 | 36% | 0.359 | S | S | . | . | trans | -111.8 | 88 | 178 | -71.8 | -29.7 | 0 | 0 | 0 | 109.6 | Q227 | N196-Q227 VanDerWaalsContact OD1-CA 3.26Å; N196-Q227 WeakPolarHBondContact OD1-CA 3.4Å; N196-Q227 WeakPolarHBondContact OD1-CB 3.34Å; N196-Q227 WeakPolarHBondContact OD1-CG 3.17Å | ||
| 197 | L | 89.9 | Confident | 93.8 | Very high | 20 Ų | 20 | 57.8 Ų | 57.8 | 11% | 0.105 | 34% | 0.34 | C | S | . | . | trans | -83.7 | 120.1 | 178.5 | -65.2 | 174.8 | 0 | 0 | 0 | 110.4 | T195 S199 E202 R203 L206 | T195-L197 HydrophobicContact CG2-CD1 4.34Å; T195-L197 HydrophobicContact CG2-CG 4.1Å; L197-S199 VanDerWaalsContact C-N 3.33Å; L197-E202 HydrophobicContact CD1-CB 4.25Å; L197-E202 HydrophobicContact CD2-CB 4.39Å; L197-R203 HydrophobicContact CB-CB 4.38Å; L197-R203 HydrophobicContact CD1-CB 4.19Å; L197-R203 PolarHBondContact O-NH2 2.99Å; L197-L206 HydrophobicContact CD1-CB 3.94Å; L197-L206 HydrophobicContact CD1-CD2 3.65Å; L197-L206 HydrophobicContact CD1-CG 4.43Å | ||
| 198 | G | 86.5 | Confident | 93.9 | Very high | 80 Ų | 80 | 54.1 Ų | 54.1 | 83% | 0.825 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -70.3 | -30.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113 | ||
| 199 | S | 91.4 | Very high | 94.1 | Very high | 42 Ų | 42 | 49.3 Ų | 49.3 | 29% | 0.294 | 29% | 0.287 | S | S | . | . | trans | -89.9 | 127 | 178.9 | 178.4 | 0 | 0 | 0 | 0 | 111.6 | L197 F201 E202 R203 | L197-S199 VanDerWaalsContact C-N 3.33Å; S199-F201 PolarHBondContact O-N 2.71Å; S199-F201 PolarHBondContact OG-N 2.81Å; S199-E202 PolarHBondContact O-N 2.86Å; S199-E202 PolarHBondContact OG-N 3.23Å; S199-R203 PolarHBondContact O-N 2.78Å; S199-R203 VanDerWaalsContact O-N 3.08Å | ||
| 200 | S | 91.9 | Very high | 94.3 | Very high | 91 Ų | 91 | 48.3 Ų | 48.3 | 64% | 0.636 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -64.3 | -26.4 | 170.7 | 57.9 | 0 | 0 | 0 | 0 | 112.2 | L204 | S200-L204 WeakPolarHBondContact O-CB 3.48Å; S200-L204 PolarHBondContact O-N 2.88Å |
| 201 | F | 92.3 | Very high | 94.4 | Very high | 75 Ų | 75 | 44.1 Ų | 44.1 | 33% | 0.329 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -73.7 | -45.3 | 176.9 | -178.4 | -107.9 | 0 | 0 | 0 | 111.6 | T163 P170 S199 R203 L204 L205 | T163-F201 HydrophobicContact CG2-CE2 4.3Å; P170-F201 HydrophobicContact CG-CE1 4.02Å; S199-F201 PolarHBondContact O-N 2.71Å; S199-F201 PolarHBondContact OG-N 2.81Å; F201-R203 PolarHBondContact O-N 2.84Å; F201-L204 HydrophobicContact CD2-CD2 4.44Å; F201-L204 VanDerWaalsContact O-CB 3.27Å; F201-L204 WeakPolarHBondContact O-CB 3.47Å; F201-L204 PolarHBondContact O-N 3.46Å; F201-L204 VanDerWaalsContact O-N 3.11Å; F201-L205 HydrophobicContact CD1-CD1 4.19Å; F201-L205 HydrophobicContact CE1-CD1 3.7Å; F201-L205 HydrophobicContact CE1-CG 4.18Å; F201-L205 HydrophobicContact CE2-CD2 4.45Å; F201-L205 HydrophobicContact CZ-CD1 4.13Å; F201-L205 HydrophobicContact CZ-CD2 4.12Å; F201-L205 HydrophobicContact CZ-CG 4.25Å; F201-L205 WeakPolarHBondContact O-CG 3.34Å; F201-L205 PolarHBondContact O-N 3.32Å |
| 202 | E | 93.6 | Very high | 94.5 | Very high | 71 Ų | 71 | 42 Ų | 42 | 33% | 0.332 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.3 | -39.4 | 173.1 | -68.2 | 170.4 | 178 | 0 | 0 | 111.1 | T173 L197 S199 L204 L205 L206 | T173-E202 HydrophobicContact CG2-CG 3.99Å; L197-E202 HydrophobicContact CD1-CB 4.25Å; L197-E202 HydrophobicContact CD2-CB 4.39Å; S199-E202 PolarHBondContact O-N 2.86Å; S199-E202 PolarHBondContact OG-N 3.23Å; E202-L204 VanDerWaalsContact C-N 3.32Å; E202-L204 PolarHBondContact O-N 3.33Å; E202-L205 PolarHBondContact O-N 2.72Å; E202-L206 PolarHBondContact O-N 3.47Å |
| 203 | R | 95.4 | Very high | 94.3 | Very high | 42 Ų | 42 | 38.1 Ų | 38.1 | 16% | 0.158 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.1 | -39.7 | 175.2 | -161.5 | -178.7 | -54 | 129.9 | 10.1 | 112.5 | L197 S199 F201 L206 H207 S219 R226 T228 | L197-R203 HydrophobicContact CB-CB 4.38Å; L197-R203 HydrophobicContact CD1-CB 4.19Å; L197-R203 PolarHBondContact O-NH2 2.99Å; S199-R203 PolarHBondContact O-N 2.78Å; S199-R203 VanDerWaalsContact O-N 3.08Å; F201-R203 PolarHBondContact O-N 2.84Å; R203-L206 PolarHBondContact O-N 2.82Å; R203-H207 PolarHBondContact O-CD2 2.91Å; R203-H207 PolarHBondContact O-N 2.88Å; R203-S219 WeakPolarHBondContact CD-OG 3.19Å; R203-R226 VanDerWaalsContact CZ-CB 3.41Å; R203-R226 VanDerWaalsContact CZ-CG 3.42Å; R203-T228 WeakPolarHBondContact CD-OG1 3.26Å; R203-T228 WeakPolarHBondContact CG-OG1 3.38Å |
| 204 | L | 95 | Very high | 94.1 | Very high | 62 Ų | 62 | 37.9 Ų | 37.9 | 33% | 0.325 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.8 | -44.2 | 173.7 | -171.7 | 79.8 | 0 | 0 | 0 | 111.3 | L160 T163 S200 F201 E202 H207 A208 | L160-L204 HydrophobicContact CD2-CD1 3.27Å; L160-L204 HydrophobicContact CD2-CD2 4.3Å; L160-L204 HydrophobicContact CD2-CG 3.46Å; L160-L204 VanDerWaalsContact CD2-CG 3.46Å; T163-L204 HydrophobicContact CG2-CD2 3.91Å; S200-L204 WeakPolarHBondContact O-CB 3.48Å; S200-L204 PolarHBondContact O-N 2.88Å; F201-L204 HydrophobicContact CD2-CD2 4.44Å; F201-L204 VanDerWaalsContact O-CB 3.27Å; F201-L204 WeakPolarHBondContact O-CB 3.47Å; F201-L204 PolarHBondContact O-N 3.46Å; F201-L204 VanDerWaalsContact O-N 3.11Å; E202-L204 VanDerWaalsContact C-N 3.32Å; E202-L204 PolarHBondContact O-N 3.33Å; L204-H207 PolarHBondContact O-N 3.44Å; L204-A208 PolarHBondContact O-N 3.16Å; L204-A208 VanDerWaalsContact O-N 3.16Å |
| 205 | L | 95.2 | Very high | 94 | Very high | 2 Ų | 2 | 35 Ų | 35 | 1% | 0.01 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.9 | -44.1 | 177 | -64.7 | -177.1 | 0 | 0 | 0 | 111.2 | L164 I169 T173 L174 L177 F201 E202 H207 A208 V209 | L164-L205 HydrophobicContact CD2-CD2 3.96Å; I169-L205 HydrophobicContact CG2-CD2 4.39Å; T173-L205 HydrophobicContact CG2-CD1 4.16Å; L174-L205 HydrophobicContact CD1-CB 4.07Å; L174-L205 HydrophobicContact CD1-CD2 4.4Å; L177-L205 HydrophobicContact CD1-CB 3.86Å; F201-L205 HydrophobicContact CD1-CD1 4.19Å; F201-L205 HydrophobicContact CE1-CD1 3.7Å; F201-L205 HydrophobicContact CE1-CG 4.18Å; F201-L205 HydrophobicContact CE2-CD2 4.45Å; F201-L205 HydrophobicContact CZ-CD1 4.13Å; F201-L205 HydrophobicContact CZ-CD2 4.12Å; F201-L205 HydrophobicContact CZ-CG 4.25Å; F201-L205 WeakPolarHBondContact O-CG 3.34Å; F201-L205 PolarHBondContact O-N 3.32Å; E202-L205 PolarHBondContact O-N 2.72Å; L205-H207 VanDerWaalsContact C-N 3.31Å; L205-H207 PolarHBondContact O-N 3.32Å; L205-A208 WeakPolarHBondContact O-CA 3.48Å; L205-A208 WeakPolarHBondContact O-CB 3.35Å; L205-A208 PolarHBondContact O-N 2.75Å; L205-V209 WeakPolarHBondContact O-CG2 3.42Å; L205-V209 PolarHBondContact O-N 2.86Å |
| 206 | L | 96.8 | Very high | 94 | Very high | 1 Ų | 1 | 36.8 Ų | 36.8 | 1% | 0.005 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -56.5 | -46.2 | 175.9 | 177.2 | 62.6 | 0 | 0 | 0 | 111.1 | L177 L181 T195 L197 E202 R203 A208 V209 C210 T228 V230 | L177-L206 HydrophobicContact CD1-CB 4.24Å; L177-L206 HydrophobicContact CD2-CB 4.44Å; L177-L206 HydrophobicContact CD2-CD1 4.35Å; L181-L206 HydrophobicContact CD1-CD1 3.78Å; L181-L206 HydrophobicContact CD2-CD1 4.31Å; L181-L206 HydrophobicContact CG-CD1 4.27Å; T195-L206 HydrophobicContact CG2-CD2 3.58Å; L197-L206 HydrophobicContact CD1-CB 3.94Å; L197-L206 HydrophobicContact CD1-CD2 3.65Å; L197-L206 HydrophobicContact CD1-CG 4.43Å; E202-L206 PolarHBondContact O-N 3.47Å; R203-L206 PolarHBondContact O-N 2.82Å; L206-A208 VanDerWaalsContact C-N 3.27Å; L206-A208 PolarHBondContact O-N 3.25Å; L206-V209 PolarHBondContact O-N 2.8Å; L206-C210 WeakPolarHBondContact O-CB 3.32Å; L206-C210 PolarHBondContact O-N 3.32Å; L206-C210 PolarHBondContact O-SG 2.87Å; L206-T228 HydrophobicContact CD2-CG2 3.67Å; L206-V230 HydrophobicContact CD2-CG2 4.38Å |
| 207 | H | 97.4 | Very high | 94.1 | Very high | 40 Ų | 40 | 33.5 Ų | 33.5 | 19% | 0.185 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -59 | -38.5 | 175.6 | -74.8 | -58 | 0 | 0 | 0 | 112.6 | L160 R203 L204 L205 C210 Q211 S217 S219 | L160-H207 HydrophobicContact CD1-CB 4.39Å; R203-H207 PolarHBondContact O-CD2 2.91Å; R203-H207 PolarHBondContact O-N 2.88Å; L204-H207 PolarHBondContact O-N 3.44Å; L205-H207 VanDerWaalsContact C-N 3.31Å; L205-H207 PolarHBondContact O-N 3.32Å; H207-C210 PolarHBondContact O-N 2.83Å; H207-Q211 WeakPolarHBondContact O-CG 3.29Å; H207-Q211 PolarHBondContact O-N 3.24Å; H207-Q211 VanDerWaalsContact O-N 3.08Å; H207-S217 WeakPolarHBondContact ND1-CB 3.41Å; H207-S217 PolarHBondContact ND1-OG 3.05Å; H207-S219 PolarHBondContact CE1-OG 3.47Å; H207-S219 VanDerWaalsContact CE1-OG 3.32Å; H207-S219 PolarHBondContact NE2-OG 2.71Å |
| 208 | A | 96.1 | Very high | 94.5 | Very high | 1 Ų | 1 | 35.4 Ų | 35.4 | 1% | 0.008 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -68.6 | -42.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | I156 L160 L164 L204 L205 L206 C210 Q211 Y212 | I156-A208 HydrophobicContact CG2-CB 4.18Å; L160-A208 HydrophobicContact CB-CB 4.27Å; L160-A208 HydrophobicContact CD1-CB 4.17Å; L160-A208 HydrophobicContact CD2-CB 4.49Å; L164-A208 HydrophobicContact CD1-CB 3.96Å; L204-A208 PolarHBondContact O-N 3.16Å; L204-A208 VanDerWaalsContact O-N 3.16Å; L205-A208 WeakPolarHBondContact O-CA 3.48Å; L205-A208 WeakPolarHBondContact O-CB 3.35Å; L205-A208 PolarHBondContact O-N 2.75Å; L206-A208 VanDerWaalsContact C-N 3.27Å; L206-A208 PolarHBondContact O-N 3.25Å; A208-C210 VanDerWaalsContact C-N 3.35Å; A208-Q211 PolarHBondContact O-N 3.47Å; A208-Y212 PolarHBondContact O-N 2.83Å |
| 209 | V | 96.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -60.1 | -46.2 | 173.7 | 175.1 | 0 | 0 | 0 | 0 | 110.6 | L174 E178 L181 L205 L206 Q211 Y212 M213 L245 | L174-V209 HydrophobicContact CD1-CG2 3.36Å; L174-V209 HydrophobicContact CG-CG2 3.99Å; E178-V209 HydrophobicContact CB-CG1 4.49Å; E178-V209 HydrophobicContact CG-CB 4.44Å; E178-V209 HydrophobicContact CG-CG1 3.59Å; E178-V209 HydrophobicContact CG-CG2 3.91Å; L181-V209 HydrophobicContact CD1-CB 4.4Å; L181-V209 HydrophobicContact CD1-CG1 3.66Å; L205-V209 WeakPolarHBondContact O-CG2 3.42Å; L205-V209 PolarHBondContact O-N 2.86Å; L206-V209 PolarHBondContact O-N 2.8Å; V209-Q211 VanDerWaalsContact C-N 3.33Å; V209-Q211 PolarHBondContact O-N 2.77Å; V209-Y212 WeakPolarHBondContact O-CB 3.19Å; V209-Y212 PolarHBondContact O-N 2.92Å; V209-Y212 VanDerWaalsContact O-N 3.15Å; V209-M213 HydrophobicContact CG1-CE 3.92Å; V209-M213 HydrophobicContact CG1-CG 4.23Å; V209-M213 HydrophobicContact CG1-SD 3.81Å; V209-M213 WeakPolarHBondContact O-CB 3.21Å; V209-M213 WeakPolarHBondContact O-CG 3.46Å; V209-M213 PolarHBondContact O-N 2.87Å; V209-L245 HydrophobicContact CG2-CD2 4.27Å |
| 210 | C | 96.3 | Very high | 95 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -57.9 | -46.2 | 178.1 | -67.6 | 0 | 0 | 0 | 0 | 111.5 | L206 H207 A208 Y212 M213 D214 L215 V230 | L206-C210 WeakPolarHBondContact O-CB 3.32Å; L206-C210 PolarHBondContact O-N 3.32Å; L206-C210 PolarHBondContact O-SG 2.87Å; H207-C210 PolarHBondContact O-N 2.83Å; A208-C210 VanDerWaalsContact C-N 3.35Å; C210-Y212 VanDerWaalsContact C-N 3.32Å; C210-Y212 PolarHBondContact O-N 2.99Å; C210-M213 CarbonylContact O-C 3.55Å; C210-M213 PolarHBondContact O-N 2.95Å; C210-D214 PolarHBondContact O-N 2.88Å; C210-D214 VanDerWaalsContact O-N 3.1Å; C210-L215 CarbonylContact C-O 3.58Å; C210-L215 HydrophobicContact CB-CB 4.03Å; C210-L215 WeakPolarHBondContact O-CA 2.87Å; C210-L215 PolarHBondContact O-N 3.12Å; C210-V230 HydrophobicContact CB-CG1 4.47Å; C210-V230 WeakPolarHBondContact SG-CG1 3.22Å |
| 211 | Q | 95.3 | Very high | 95.1 | Very high | 44 Ų | 44 | 34.7 Ų | 34.7 | 21% | 0.206 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -64.3 | -36.4 | 178 | -70.8 | 175.4 | 2.8 | 0 | 0 | 112.7 | I156 D157 H207 A208 V209 D214 | I156-Q211 VanDerWaalsContact CA-OE1 3.25Å; I156-Q211 HydrophobicContact CG1-CB 4.23Å; D157-Q211 PolarHBondContact OD2-NE2 3.13Å; H207-Q211 WeakPolarHBondContact O-CG 3.29Å; H207-Q211 PolarHBondContact O-N 3.24Å; H207-Q211 VanDerWaalsContact O-N 3.08Å; A208-Q211 PolarHBondContact O-N 3.47Å; V209-Q211 VanDerWaalsContact C-N 3.33Å; V209-Q211 PolarHBondContact O-N 2.77Å; Q211-D214 PolarHBondContact O-N 2.99Å |
| 212 | Y | 94.8 | Very high | 94.8 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.7 | -45.6 | 174.8 | -170 | -103 | 0 | 0 | 0 | 111.9 | F153 I156 A208 V209 C210 D214 P241 P243 L245 | F153-Y212 HydrophobicContact CB-CE2 4.28Å; I156-Y212 HydrophobicContact CD1-CD2 3.99Å; I156-Y212 HydrophobicContact CD1-CG 4.44Å; I156-Y212 HydrophobicContact CG1-CD2 4.45Å; A208-Y212 PolarHBondContact O-N 2.83Å; V209-Y212 WeakPolarHBondContact O-CB 3.19Å; V209-Y212 PolarHBondContact O-N 2.92Å; V209-Y212 VanDerWaalsContact O-N 3.15Å; C210-Y212 VanDerWaalsContact C-N 3.32Å; C210-Y212 PolarHBondContact O-N 2.99Å; Y212-D214 PolarHBondContact O-N 3.36Å; Y212-P241 HydrophobicContact CD1-CB 4.17Å; Y212-P241 HydrophobicContact CD1-CG 3.89Å; Y212-P241 HydrophobicContact CE1-CB 3.63Å; Y212-P241 HydrophobicContact CE1-CG 3.89Å; Y212-P241 VanDerWaalsContact O-CG 3.32Å; Y212-P241 WeakPolarHBondContact O-CG 3.24Å; Y212-P243 WeakPolarHBondContact CE1-O 3.39Å; Y212-P243 PolarHBondContact OH-O 3.3Å; Y212-L245 HydrophobicContact CD1-CB 3.72Å; Y212-L245 HydrophobicContact CD2-CB 4.35Å; Y212-L245 HydrophobicContact CD2-CD1 3.72Å; Y212-L245 HydrophobicContact CD2-CG 4.48Å; Y212-L245 HydrophobicContact CE1-CB 3.99Å; Y212-L245 HydrophobicContact CE2-CD1 3.93Å; Y212-L245 HydrophobicContact CG-CB 3.91Å; Y212-L245 HydrophobicContact CG-CD1 4.08Å; Y212-L245 HydrophobicContact CG-CD2 4.44Å; Y212-L245 HydrophobicContact CG-CG 4.35Å |
| 213 | M | 93.4 | Very high | 94.3 | Very high | 3 Ų | 3 | 37.5 Ų | 37.5 | 2% | 0.015 | 22% | 0.215 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | 7.8 | 179.3 | -65.1 | -174.2 | 171.6 | 0 | 0 | 114.2 | E178 L181 V209 C210 L215 F238 M244 | E178-M213 HydrophobicContact CB-CE 3.8Å; E178-M213 HydrophobicContact CG-CE 3.75Å; L181-M213 HydrophobicContact CB-SD 4.2Å; L181-M213 HydrophobicContact CD1-SD 4.34Å; V209-M213 HydrophobicContact CG1-CE 3.92Å; V209-M213 HydrophobicContact CG1-CG 4.23Å; V209-M213 HydrophobicContact CG1-SD 3.81Å; V209-M213 WeakPolarHBondContact O-CB 3.21Å; V209-M213 WeakPolarHBondContact O-CG 3.46Å; V209-M213 PolarHBondContact O-N 2.87Å; C210-M213 CarbonylContact O-C 3.55Å; C210-M213 PolarHBondContact O-N 2.95Å; M213-L215 HydrophobicContact CB-CD1 4.04Å; M213-L215 HydrophobicContact CB-CG 4.05Å; M213-L215 PolarHBondContact O-N 3.38Å; M213-F238 HydrophobicContact SD-CZ 4.2Å; M213-M244 HydrophobicContact CE-CE 3.52Å |
| 214 | D | 92.5 | Very high | 93.8 | Very high | 30 Ų | 30 | 39.8 Ų | 39.8 | 16% | 0.16 | 25% | 0.252 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 62.5 | 24.5 | -178.8 | -155.1 | 48.1 | 0 | 0 | 0 | 114.7 | R155 C210 Q211 Y212 K233 Q234 | R155-D214 IonicContact NH1-OD1 2.75Å; R155-D214 PolarHBondContact NH1-OD1 2.95Å; C210-D214 PolarHBondContact O-N 2.88Å; C210-D214 VanDerWaalsContact O-N 3.1Å; Q211-D214 PolarHBondContact O-N 2.99Å; Y212-D214 PolarHBondContact O-N 3.36Å; D214-K233 VanDerWaalsContact CG-NZ 3.31Å; D214-K233 WeakPolarHBondContact O-CE 3.43Å; D214-K233 WeakPolarHBondContact OD1-CE 3.17Å; D214-K233 IonicContact OD1-NZ 2.79Å; D214-K233 PolarHBondContact OD1-NZ 3.1Å; D214-K233 WeakPolarHBondContact OD2-CE 3.49Å; D214-K233 IonicContact OD2-NZ 3.01Å; D214-Q234 PolarHBondContact OD2-NE2 3.32Å |
| 215 | L | 94.9 | Very high | 93.4 | Very high | 8 Ų | 8 | 39 Ų | 39 | 4% | 0.042 | 25% | 0.254 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.8 | 153.1 | 175.8 | -58.9 | 172.7 | 0 | 0 | 0 | 111.5 | L181 F185 C210 M213 V230 N232 F238 | L181-L215 HydrophobicContact CB-CD1 4.44Å; L181-L215 HydrophobicContact CD1-CD1 4.19Å; L181-L215 HydrophobicContact CD2-CD1 4.47Å; F185-L215 HydrophobicContact CD2-CD1 3.83Å; F185-L215 HydrophobicContact CD2-CD2 4.21Å; F185-L215 HydrophobicContact CE2-CD1 3.71Å; F185-L215 HydrophobicContact CE2-CD2 4.15Å; F185-L215 HydrophobicContact CZ-CD2 4.35Å; C210-L215 CarbonylContact C-O 3.58Å; C210-L215 HydrophobicContact CB-CB 4.03Å; C210-L215 WeakPolarHBondContact O-CA 2.87Å; C210-L215 PolarHBondContact O-N 3.12Å; M213-L215 HydrophobicContact CB-CD1 4.04Å; M213-L215 HydrophobicContact CB-CG 4.05Å; M213-L215 PolarHBondContact O-N 3.38Å; L215-V230 HydrophobicContact CB-CG1 3.85Å; L215-V230 HydrophobicContact CD1-CG1 3.96Å; L215-V230 HydrophobicContact CG-CG1 4.45Å; L215-N232 HydrophobicContact CD2-CB 3.85Å; L215-F238 HydrophobicContact CD1-CE2 4.21Å; L215-F238 HydrophobicContact CD2-CD2 4.11Å; L215-F238 HydrophobicContact CD2-CE2 3.85Å; L215-F238 HydrophobicContact CG-CE2 4.19Å |
| 216 | V | 95.2 | Very high | 93.2 | Very high | 63 Ų | 63 | 43.1 Ų | 43.1 | 38% | 0.382 | 27% | 0.269 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98 | 133.6 | 173.6 | 178.8 | 0 | 0 | 0 | 0 | 108.6 | V230 M231 K233 | V216-V230 CarbonylContact O-C 3.58Å; V216-V230 VanDerWaalsContact O-CA 3.29Å; V216-V230 WeakPolarHBondContact O-CA 3.2Å; V216-M231 HydrophobicContact CB-CG 3.75Å; V216-M231 HydrophobicContact CB-SD 4.45Å; V216-M231 HydrophobicContact CG1-CG 4.25Å; V216-M231 HydrophobicContact CG1-SD 4.44Å; V216-M231 PolarHBondContact N-O 2.87Å; V216-M231 PolarHBondContact O-N 3.05Å; V216-K233 HydrophobicContact CG2-CB 3.97Å; V216-K233 HydrophobicContact CG2-CD 3.93Å; V216-K233 HydrophobicContact CG2-CG 4.37Å |
| 217 | S | 96.8 | Very high | 93.2 | Very high | 28 Ų | 28 | 45 Ų | 45 | 20% | 0.196 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.8 | 138.5 | -179.7 | 54.2 | 0 | 0 | 0 | 0 | 111.5 | H207 D229 | H207-S217 WeakPolarHBondContact ND1-CB 3.41Å; H207-S217 PolarHBondContact ND1-OG 3.05Å; S217-D229 CarbonylContact C-O 3.28Å; S217-D229 VanDerWaalsContact CA-O 3.3Å; S217-D229 WeakPolarHBondContact CA-O 3.49Å |
| 218 | A | 96.8 | Very high | 93.2 | Very high | 60 Ų | 60 | 43.1 Ų | 43.1 | 50% | 0.496 | 27% | 0.269 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.9 | 135.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 110 | T228 D229 | A218-T228 CarbonylContact O-C 3.58Å; A218-T228 WeakPolarHBondContact O-CA 3.41Å; A218-D229 PolarHBondContact N-O 2.89Å; A218-D229 PolarHBondContact O-N 3.27Å |
| 219 | S | 95.6 | Very high | 93.2 | Very high | 28 Ų | 28 | 45.2 Ų | 45.2 | 20% | 0.196 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 128.6 | 178.7 | -68.2 | 0 | 0 | 0 | 0 | 110.6 | R203 H207 R226 Q227 T228 | R203-S219 WeakPolarHBondContact CD-OG 3.19Å; H207-S219 PolarHBondContact CE1-OG 3.47Å; H207-S219 VanDerWaalsContact CE1-OG 3.32Å; H207-S219 PolarHBondContact NE2-OG 2.71Å; S219-R226 PolarHBondContact O-NE 2.76Å; S219-R226 PolarHBondContact O-NH2 3.05Å; S219-Q227 CarbonylContact C-O 3.57Å; S219-Q227 WeakPolarHBondContact CA-O 3.41Å; S219-T228 WeakPolarHBondContact OG-CG2 3.33Å; S219-T228 PolarHBondContact OG-OG1 3.3Å |
| 220 | S | 94.4 | Very high | 93.3 | Very high | 51 Ų | 51 | 45.2 Ų | 45.2 | 36% | 0.357 | 28% | 0.281 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.9 | 156.1 | -178.4 | 64.2 | 0 | 0 | 0 | 0 | 111.2 | R226 Q227 | S220-R226 CarbonylContact O-C 3.5Å; S220-R226 WeakPolarHBondContact O-CA 3.26Å; S220-R226 VanDerWaalsContact O-CD 3.29Å; S220-R226 WeakPolarHBondContact O-CD 3.43Å; S220-Q227 PolarHBondContact N-O 3.48Å; S220-Q227 PolarHBondContact O-N 3.24Å |
| 221 | D | 93.1 | Very high | 93.3 | Very high | 120 Ų | 120 | 49.7 Ų | 49.7 | 64% | 0.642 | 30% | 0.303 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.6 | 118.9 | 171.9 | -64.9 | -41.3 | 0 | 0 | 0 | 108.7 | R226 | D221-R226 WeakPolarHBondContact OD1-CD 3.49Å; D221-R226 IonicContact OD1-CZ 2.8Å; D221-R226 IonicContact OD1-NE 2.77Å; D221-R226 IonicContact OD1-NH1 3.68Å; D221-R226 PolarHBondContact OD1-NH1 3.12Å; D221-R226 IonicContact OD2-NH1 3.31Å; D221-R226 PolarHBondContact OD2-NH1 3.23Å |
| 222 | C | 86.2 | Confident | 93.3 | Very high | 33 Ų | 33 | 48.4 Ų | 48.4 | 22% | 0.223 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 131.7 | 173.4 | 75.4 | 0 | 0 | 0 | 0 | 109.6 | G224 A225 Q227 | C222-G224 PolarHBondContact O-N 3.48Å; C222-A225 CarbonylContact C-O 3.6Å; C222-A225 PolarHBondContact N-O 3.16Å; C222-A225 CarbonylContact O-C 3.54Å; C222-A225 PolarHBondContact O-N 3.03Å; C222-Q227 WeakPolarHBondContact SG-CB 3.12Å; C222-Q227 PolarHBondContact SG-OE1 2.81Å |
| 223 | N | 83.6 | Confident | 92.9 | Very high | 172 Ų | 172 | 53.8 Ų | 53.8 | 92% | 0.92 | 32% | 0.32 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.8 | 31.5 | 176.6 | -57.3 | -29.8 | 0 | 0 | 0 | 115.1 | A225 | N223-A225 VanDerWaalsContact C-N 3.25Å; N223-A225 PolarHBondContact O-N 3.34Å |
| 224 | G | 83.8 | Confident | 92.5 | Very high | 89 Ų | 89 | 56.4 Ų | 56.4 | 92% | 0.918 | 33% | 0.333 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.9 | 2.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | C222 | C222-G224 PolarHBondContact O-N 3.48Š|
| 225 | A | 86.9 | Confident | 91.6 | Very high | 45 Ų | 45 | 63.2 Ų | 63.2 | 37% | 0.372 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.1 | 148.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | C222 N223 Q227 | C222-A225 CarbonylContact C-O 3.6Å; C222-A225 PolarHBondContact N-O 3.16Å; C222-A225 CarbonylContact O-C 3.54Å; C222-A225 PolarHBondContact O-N 3.03Å; N223-A225 VanDerWaalsContact C-N 3.25Å; N223-A225 PolarHBondContact O-N 3.34Å; A225-Q227 PolarHBondContact O-N 3.35Å |
| 226 | R | 91.9 | Very high | 90.8 | Very high | 89 Ų | 89 | 64.9 Ų | 64.9 | 34% | 0.336 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.9 | 117.4 | 173.1 | -165.7 | 83.7 | 176 | -174.8 | 4.2 | 109.2 | R203 S219 S220 D221 | R203-R226 VanDerWaalsContact CZ-CB 3.41Å; R203-R226 VanDerWaalsContact CZ-CG 3.42Å; S219-R226 PolarHBondContact O-NE 2.76Å; S219-R226 PolarHBondContact O-NH2 3.05Å; S220-R226 CarbonylContact O-C 3.5Å; S220-R226 WeakPolarHBondContact O-CA 3.26Å; S220-R226 VanDerWaalsContact O-CD 3.29Å; S220-R226 WeakPolarHBondContact O-CD 3.43Å; D221-R226 WeakPolarHBondContact OD1-CD 3.49Å; D221-R226 IonicContact OD1-CZ 2.8Å; D221-R226 IonicContact OD1-NE 2.77Å; D221-R226 IonicContact OD1-NH1 3.68Å; D221-R226 PolarHBondContact OD1-NH1 3.12Å; D221-R226 IonicContact OD2-NH1 3.31Å; D221-R226 PolarHBondContact OD2-NH1 3.23Å |
| 227 | Q | 95.6 | Very high | 90.3 | Very high | 41 Ų | 41 | 68.3 Ų | 68.3 | 19% | 0.192 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.6 | 146.8 | 173.5 | -176.6 | 175.2 | -59.7 | 0 | 0 | 110 | T194 N196 S219 S220 C222 A225 D229 | T194-Q227 HydrophobicContact CG2-CG 3.55Å; N196-Q227 VanDerWaalsContact OD1-CA 3.26Å; N196-Q227 WeakPolarHBondContact OD1-CA 3.4Å; N196-Q227 WeakPolarHBondContact OD1-CB 3.34Å; N196-Q227 WeakPolarHBondContact OD1-CG 3.17Å; S219-Q227 CarbonylContact C-O 3.57Å; S219-Q227 WeakPolarHBondContact CA-O 3.41Å; S220-Q227 PolarHBondContact N-O 3.48Å; S220-Q227 PolarHBondContact O-N 3.24Å; C222-Q227 WeakPolarHBondContact SG-CB 3.12Å; C222-Q227 PolarHBondContact SG-OE1 2.81Å; A225-Q227 PolarHBondContact O-N 3.35Å; Q227-D229 PolarHBondContact NE2-OD1 2.85Å; Q227-D229 PolarHBondContact NE2-OD2 3.24Å |
| 228 | T | 97.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 68 Ų | 68 | 0% | 0 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 121.7 | 172.7 | -56.7 | 0 | 0 | 0 | 0 | 109.1 | T195 R203 L206 A218 S219 V230 | T195-T228 PolarHBondContact N-O 3.45Å; T195-T228 PolarHBondContact O-N 3.47Å; R203-T228 WeakPolarHBondContact CD-OG1 3.26Å; R203-T228 WeakPolarHBondContact CG-OG1 3.38Å; L206-T228 HydrophobicContact CD2-CG2 3.67Å; A218-T228 CarbonylContact O-C 3.58Å; A218-T228 WeakPolarHBondContact O-CA 3.41Å; S219-T228 WeakPolarHBondContact OG-CG2 3.33Å; S219-T228 PolarHBondContact OG-OG1 3.3Å; T228-V230 HydrophobicContact CG2-CG2 4.4Å |
| 229 | D | 97.4 | Very high | 89.4 | Confident | 45 Ų | 45 | 70 Ų | 70 | 24% | 0.241 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 137.8 | 175.6 | -60.3 | -33.4 | 0 | 0 | 0 | 109 | V192 Y193 T194 S217 A218 Q227 | V192-D229 HydrophobicContact CG1-CB 3.96Å; Y193-D229 CarbonylContact O-C 3.51Å; Y193-D229 WeakPolarHBondContact O-CA 3.33Å; T194-D229 WeakPolarHBondContact CB-OD1 3.43Å; T194-D229 WeakPolarHBondContact CG2-OD1 3.33Å; T194-D229 PolarHBondContact OG1-OD1 2.94Å; S217-D229 CarbonylContact C-O 3.28Å; S217-D229 VanDerWaalsContact CA-O 3.3Å; S217-D229 WeakPolarHBondContact CA-O 3.49Å; A218-D229 PolarHBondContact N-O 2.89Å; A218-D229 PolarHBondContact O-N 3.27Å; Q227-D229 PolarHBondContact NE2-OD1 2.85Å; Q227-D229 PolarHBondContact NE2-OD2 3.24Å |
| 230 | V | 97.8 | Very high | 89 | Confident | 0 Ų | 0 | 71.3 Ų | 71.3 | 0% | 0 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.3 | 135.4 | 179.4 | -174.4 | 0 | 0 | 0 | 0 | 108.4 | L181 F185 V192 Y193 L206 C210 L215 V216 T228 | L181-V230 HydrophobicContact CD2-CB 4.3Å; L181-V230 HydrophobicContact CD2-CG1 4.09Å; L181-V230 HydrophobicContact CD2-CG2 4.34Å; F185-V230 HydrophobicContact CE2-CB 4.45Å; F185-V230 HydrophobicContact CE2-CG1 3.9Å; F185-V230 HydrophobicContact CZ-CB 4.42Å; F185-V230 HydrophobicContact CZ-CG1 4.05Å; V192-V230 WeakPolarHBondContact CA-O 3.26Å; Y193-V230 HydrophobicContact CD1-CB 4.19Å; Y193-V230 HydrophobicContact CD1-CG2 4.06Å; Y193-V230 PolarHBondContact N-O 3.36Å; Y193-V230 PolarHBondContact O-N 2.9Å; L206-V230 HydrophobicContact CD2-CG2 4.38Å; C210-V230 HydrophobicContact CB-CG1 4.47Å; C210-V230 WeakPolarHBondContact SG-CG1 3.22Å; L215-V230 HydrophobicContact CB-CG1 3.85Å; L215-V230 HydrophobicContact CD1-CG1 3.96Å; L215-V230 HydrophobicContact CG-CG1 4.45Å; V216-V230 CarbonylContact O-C 3.58Å; V216-V230 VanDerWaalsContact O-CA 3.29Å; V216-V230 WeakPolarHBondContact O-CA 3.2Å; T228-V230 HydrophobicContact CG2-CG2 4.4Å |
| 231 | M | 96.4 | Very high | 88.7 | Confident | 95 Ų | 95 | 69.3 Ų | 69.3 | 47% | 0.468 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.8 | 144.1 | -179.9 | 62.3 | -176.3 | -74.2 | 0 | 0 | 110.4 | V216 | V216-M231 HydrophobicContact CB-CG 3.75Å; V216-M231 HydrophobicContact CB-SD 4.45Å; V216-M231 HydrophobicContact CG1-CG 4.25Å; V216-M231 HydrophobicContact CG1-SD 4.44Å; V216-M231 PolarHBondContact N-O 2.87Å; V216-M231 PolarHBondContact O-N 3.05Å |
| 232 | N | 94.2 | Very high | 88.4 | Confident | 16 Ų | 16 | 68.9 Ų | 68.9 | 9% | 0.086 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.2 | 123.4 | 168.6 | -174 | 6.8 | 0 | 0 | 0 | 109.1 | F185 P189 L215 Q234 | F185-N232 HydrophobicContact CD1-CB 3.98Å; F185-N232 HydrophobicContact CE1-CB 3.91Å; P189-N232 WeakPolarHBondContact O-CB 3.32Å; P189-N232 PolarHBondContact O-ND2 2.94Å; L215-N232 HydrophobicContact CD2-CB 3.85Å; N232-Q234 VanDerWaalsContact C-N 3.33Å; N232-Q234 VanDerWaalsContact OD1-CB 3.29Å; N232-Q234 WeakPolarHBondContact OD1-CB 3.44Å; N232-Q234 WeakPolarHBondContact OD1-CG 3.32Å; N232-Q234 PolarHBondContact OD1-N 3.31Å |
| 233 | K | 88.1 | Confident | 88.7 | Confident | 113 Ų | 113 | 69.6 Ų | 69.6 | 49% | 0.491 | 40% | 0.397 | S | S | . | . | trans | -84.4 | -11.7 | 176.2 | 67.5 | -174.9 | -176.3 | -164.2 | 0 | 112.9 | D214 V216 | D214-K233 VanDerWaalsContact CG-NZ 3.31Å; D214-K233 WeakPolarHBondContact O-CE 3.43Å; D214-K233 WeakPolarHBondContact OD1-CE 3.17Å; D214-K233 IonicContact OD1-NZ 2.79Å; D214-K233 PolarHBondContact OD1-NZ 3.1Å; D214-K233 WeakPolarHBondContact OD2-CE 3.49Å; D214-K233 IonicContact OD2-NZ 3.01Å; V216-K233 HydrophobicContact CG2-CB 3.97Å; V216-K233 HydrophobicContact CG2-CD 3.93Å; V216-K233 HydrophobicContact CG2-CG 4.37Å | ||
| 234 | Q | 84.3 | Confident | 89.2 | Confident | 58 Ų | 58 | 63.9 Ų | 63.9 | 27% | 0.271 | 37% | 0.365 | S | S | . | . | trans | -79.8 | 132.1 | -179.8 | -56.9 | 179.1 | -5.8 | 0 | 0 | 109.1 | D214 N232 G236 | D214-Q234 PolarHBondContact OD2-NE2 3.32Å; N232-Q234 VanDerWaalsContact C-N 3.33Å; N232-Q234 VanDerWaalsContact OD1-CB 3.29Å; N232-Q234 WeakPolarHBondContact OD1-CB 3.44Å; N232-Q234 WeakPolarHBondContact OD1-CG 3.32Å; N232-Q234 PolarHBondContact OD1-N 3.31Å; Q234-G236 PolarHBondContact O-N 2.85Å | ||
| 235 | E | 74.4 | Confident | 89.6 | Confident | 174 Ų | 174 | 59.6 Ų | 59.6 | 81% | 0.813 | 32% | 0.321 | S | S | * | . | S | Bend | trans | -71.2 | -20.1 | 177.3 | -63 | -176 | 174.8 | 0 | 0 | 112.2 | H190 | H190-E235 PolarHBondContact NE2-O 3.17Š|
| 236 | G | 77.1 | Confident | 90 | Very high | 43 Ų | 43 | 57.9 Ų | 57.9 | 44% | 0.443 | 31% | 0.306 | S | S | . | . | S | Bend | trans | -89.3 | -166.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115 | Q234 | Q234-G236 PolarHBondContact O-N 2.85Š|
| 237 | L | 84.2 | Confident | 90 | Very high | 135 Ų | 135 | 55 Ų | 55 | 71% | 0.707 | 30% | 0.302 | S | S | * | . | trans | -62.2 | 143.1 | 172.4 | -69 | 166 | 0 | 0 | 0 | 110.4 | P189 Q239 | P189-L237 HydrophobicContact CG-CD2 4.41Å; L237-Q239 PolarHBondContact O-N 2.91Å | ||
| 238 | F | 88.7 | Confident | 89.9 | Confident | 21 Ų | 21 | 54.2 Ų | 54.2 | 9% | 0.092 | 30% | 0.297 | C | S | . | . | trans | -63.4 | 124.3 | 173.5 | 174.1 | -114 | 0 | 0 | 0 | 110.4 | F185 P189 M213 L215 P240 | F185-F238 HydrophobicContact CB-CB 3.91Å; F185-F238 HydrophobicContact CB-CD1 3.57Å; F185-F238 HydrophobicContact CB-CD2 3.89Å; F185-F238 HydrophobicContact CB-CE1 4.01Å; F185-F238 HydrophobicContact CB-CE2 4.31Å; F185-F238 HydrophobicContact CB-CG 3.5Å; F185-F238 VanDerWaalsContact CB-CG 3.5Å; F185-F238 HydrophobicContact CB-CZ 4.35Å; F185-F238 HydrophobicContact CG-CD2 4.47Å; F185-F238 HydrophobicContact CG-CG 4.5Å; P189-F238 HydrophobicContact CB-CB 4.31Å; M213-F238 HydrophobicContact SD-CZ 4.2Å; L215-F238 HydrophobicContact CD1-CE2 4.21Å; L215-F238 HydrophobicContact CD2-CD2 4.11Å; L215-F238 HydrophobicContact CD2-CE2 3.85Å; L215-F238 HydrophobicContact CG-CE2 4.19Å; F238-P240 HydrophobicContact CE1-CB 3.82Å; F238-P240 HydrophobicContact CE1-CG 3.99Å; F238-P240 HydrophobicContact CZ-CB 3.84Å; F238-P240 HydrophobicContact CZ-CG 4.49Å | ||
| 239 | Q | 86.7 | Confident | 89.6 | Confident | 102 Ų | 102 | 54.8 Ų | 54.8 | 48% | 0.477 | 30% | 0.3 | S | S | . | . | trans | -120.6 | 99.5 | 176.9 | -62.8 | -157.8 | -45.4 | 0 | 0 | 110 | L237 | L237-Q239 PolarHBondContact O-N 2.91Š| ||
| 240 | P | 86.6 | Confident | 89.1 | Confident | 55 Ų | 55 | 57.3 Ų | 57.3 | 36% | 0.357 | 31% | 0.31 | S | S | . | . | trans | -70.2 | 147.9 | 178.4 | 28 | -32.6 | 0 | 0 | 0 | 111.1 | L182 F238 | L182-P240 HydrophobicContact CD1-CB 4.07Å; L182-P240 HydrophobicContact CD1-CG 3.94Å; L182-P240 HydrophobicContact CG-CG 4.42Å; F238-P240 HydrophobicContact CE1-CB 3.82Å; F238-P240 HydrophobicContact CE1-CG 3.99Å; F238-P240 HydrophobicContact CZ-CB 3.84Å; F238-P240 HydrophobicContact CZ-CG 4.49Å | ||
| 241 | P | 88.9 | Confident | 88.5 | Confident | 10 Ų | 10 | 64.9 Ų | 64.9 | 7% | 0.065 | 35% | 0.346 | C | S | . | . | trans | -60.9 | 149.1 | 170.6 | -19.9 | 31.3 | 0 | 0 | 0 | 112.3 | Y152 Y212 P243 | Y152-P241 HydrophobicContact CD1-CB 4.06Å; Y152-P241 HydrophobicContact CD1-CG 3.81Å; Y152-P241 HydrophobicContact CD2-CB 3.92Å; Y152-P241 HydrophobicContact CE1-CB 4.13Å; Y152-P241 HydrophobicContact CE1-CG 3.99Å; Y152-P241 HydrophobicContact CE2-CB 3.99Å; Y152-P241 HydrophobicContact CG-CB 3.94Å; Y152-P241 HydrophobicContact CG-CG 4.12Å; Y212-P241 HydrophobicContact CD1-CB 4.17Å; Y212-P241 HydrophobicContact CD1-CG 3.89Å; Y212-P241 HydrophobicContact CE1-CB 3.63Å; Y212-P241 HydrophobicContact CE1-CG 3.89Å; Y212-P241 VanDerWaalsContact O-CG 3.32Å; Y212-P241 WeakPolarHBondContact O-CG 3.24Å; P241-P243 CarbonylContact C-O 3.6Å | ||
| 242 | S | 86.8 | Confident | 87.6 | Confident | 110 Ų | 110 | 64.4 Ų | 64.4 | 77% | 0.769 | 34% | 0.343 | S | S | * | . | S | Bend | trans | -129.9 | 117.4 | 169.8 | 173.3 | 0 | 0 | 0 | 0 | 108.3 | ||
| 243 | P | 91.4 | Very high | 86.1 | Confident | 49 Ų | 49 | 70.4 Ų | 70.4 | 32% | 0.318 | 39% | 0.387 | S | S | . | . | S | Bend | cis | -73 | 167.6 | 5.8 | 32.3 | -37.5 | 0 | 0 | 0 | 114.1 | A149 Y212 P241 A247 | A149-P243 HydrophobicContact CB-CG 3.63Å; Y212-P243 WeakPolarHBondContact CE1-O 3.39Å; Y212-P243 PolarHBondContact OH-O 3.3Å; P241-P243 CarbonylContact C-O 3.6Å; P243-A247 HydrophobicContact CB-CB 4.21Å |
| 244 | M | 94.1 | Very high | 86 | Confident | 51 Ų | 51 | 68.3 Ų | 68.3 | 25% | 0.251 | 38% | 0.381 | S | S | . | . | trans | -70.9 | 163.3 | 169.7 | -55.5 | -162.4 | 88.5 | 0 | 0 | 110.9 | E178 L182 M213 S246 A247 Y248 | E178-M244 HydrophobicContact CB-CE 3.62Å; E178-M244 HydrophobicContact CG-CE 4.3Å; L182-M244 HydrophobicContact CD1-CE 3.62Å; M213-M244 HydrophobicContact CE-CE 3.52Å; M244-S246 PolarHBondContact O-N 3.25Å; M244-A247 PolarHBondContact O-N 2.86Å; M244-Y248 WeakPolarHBondContact O-CB 3.11Å; M244-Y248 PolarHBondContact O-N 3.36Å | ||
| 245 | L | 93.9 | Very high | 86.1 | Confident | 0 Ų | 0 | 68.8 Ų | 68.8 | 0% | 0 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -64.9 | -40.3 | -178.6 | -177.4 | 60.2 | 0 | 0 | 0 | 111.5 | F153 I156 L164 L174 E178 V209 Y212 Y248 L249 | F153-L245 HydrophobicContact CD2-CD1 3.76Å; F153-L245 HydrophobicContact CE2-CD1 4.13Å; I156-L245 HydrophobicContact CD1-CD1 3.77Å; I156-L245 HydrophobicContact CD1-CD2 3.93Å; L164-L245 HydrophobicContact CD1-CD1 4.35Å; L164-L245 HydrophobicContact CD1-CD2 3.99Å; L174-L245 HydrophobicContact CD1-CD2 4.37Å; L174-L245 HydrophobicContact CD2-CB 4.31Å; L174-L245 HydrophobicContact CD2-CD2 4.06Å; L174-L245 HydrophobicContact CD2-CG 3.9Å; E178-L245 WeakPolarHBondContact OE1-CA 3.41Å; E178-L245 WeakPolarHBondContact OE1-CB 3.42Å; E178-L245 PolarHBondContact OE1-N 3.09Å; V209-L245 HydrophobicContact CG2-CD2 4.27Å; Y212-L245 HydrophobicContact CD1-CB 3.72Å; Y212-L245 HydrophobicContact CD2-CB 4.35Å; Y212-L245 HydrophobicContact CD2-CD1 3.72Å; Y212-L245 HydrophobicContact CD2-CG 4.48Å; Y212-L245 HydrophobicContact CE1-CB 3.99Å; Y212-L245 HydrophobicContact CE2-CD1 3.93Å; Y212-L245 HydrophobicContact CG-CB 3.91Å; Y212-L245 HydrophobicContact CG-CD1 4.08Å; Y212-L245 HydrophobicContact CG-CD2 4.44Å; Y212-L245 HydrophobicContact CG-CG 4.35Å; L245-Y248 HydrophobicContact CD1-CD1 4.37Å; L245-Y248 PolarHBondContact O-N 2.98Å; L245-L249 HydrophobicContact CD1-CD1 4.2Å; L245-L249 HydrophobicContact CD1-CG 4.14Å; L245-L249 HydrophobicContact CG-CD1 4.07Å; L245-L249 HydrophobicContact CG-CG 4.41Å; L245-L249 WeakPolarHBondContact O-CB 3.39Å; L245-L249 VanDerWaalsContact O-CG 3.26Å; L245-L249 WeakPolarHBondContact O-CG 3.48Å; L245-L249 PolarHBondContact O-N 3.36Å |
| 246 | S | 93.8 | Very high | 86.8 | Confident | 8 Ų | 8 | 63 Ų | 63 | 6% | 0.056 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -53.4 | -59.4 | 172.7 | 47.8 | 0 | 0 | 0 | 0 | 111.5 | E178 M244 Y248 L249 E250 | E178-S246 WeakPolarHBondContact OE2-CB 3.41Å; E178-S246 PolarHBondContact OE2-N 3.28Å; E178-S246 PolarHBondContact OE2-OG 3.3Å; M244-S246 PolarHBondContact O-N 3.25Å; S246-Y248 VanDerWaalsContact C-N 3.32Å; S246-Y248 PolarHBondContact O-N 2.94Å; S246-L249 PolarHBondContact O-N 2.89Å; S246-L249 VanDerWaalsContact O-N 3.12Å; S246-E250 PolarHBondContact O-N 3.44Å |
| 247 | A | 92.8 | Very high | 87.4 | Confident | 29 Ų | 29 | 64.2 Ų | 64.2 | 24% | 0.24 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -56.7 | -44.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | P243 M244 L249 E250 H251 | P243-A247 HydrophobicContact CB-CB 4.21Å; M244-A247 PolarHBondContact O-N 2.86Å; A247-L249 VanDerWaalsContact C-N 3.33Å; A247-L249 PolarHBondContact O-N 3.47Å; A247-E250 PolarHBondContact O-N 2.85Å; A247-H251 PolarHBondContact O-N 3.04Å; A247-H251 PolarHBondContact O-ND1 3.26Å |
| 248 | Y | 92.3 | Very high | 87.6 | Confident | 24 Ų | 24 | 59.8 Ų | 59.8 | 9% | 0.094 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60.5 | -41.4 | 178.1 | 173.4 | -101.1 | 0 | 0 | 0 | 112.4 | A149 Q150 F153 M244 L245 S246 H251 M252 | A149-Y248 HydrophobicContact CB-CD2 3.31Å; A149-Y248 HydrophobicContact CB-CE2 3.7Å; A149-Y248 HydrophobicContact CB-CG 4.15Å; Q150-Y248 PolarHBondContact OE1-OH 3.27Å; F153-Y248 HydrophobicContact CB-CD1 4.24Å; F153-Y248 HydrophobicContact CB-CE1 3.53Å; F153-Y248 AromaticContact CD1-CE1 3.97Å; F153-Y248 HydrophobicContact CD1-CE1 3.97Å; F153-Y248 AromaticContact CD2-CD1 3.9Å; F153-Y248 HydrophobicContact CD2-CD1 3.9Å; F153-Y248 AromaticContact CD2-CE1 3.46Å; F153-Y248 HydrophobicContact CD2-CE1 3.46Å; F153-Y248 VanDerWaalsContact CD2-CE1 3.46Å; F153-Y248 HydrophobicContact CE2-CE1 4.12Å; F153-Y248 HydrophobicContact CG-CD1 4.19Å; F153-Y248 AromaticContact CG-CE1 3.37Å; F153-Y248 HydrophobicContact CG-CE1 3.37Å; M244-Y248 WeakPolarHBondContact O-CB 3.11Å; M244-Y248 PolarHBondContact O-N 3.36Å; L245-Y248 HydrophobicContact CD1-CD1 4.37Å; L245-Y248 PolarHBondContact O-N 2.98Å; S246-Y248 VanDerWaalsContact C-N 3.32Å; S246-Y248 PolarHBondContact O-N 2.94Å; Y248-H251 PolarHBondContact O-N 2.89Å; Y248-M252 HydrophobicContact CD1-SD 4Å; Y248-M252 HydrophobicContact CE1-CG 4.22Å; Y248-M252 HydrophobicContact CE1-SD 3.21Å; Y248-M252 WeakPolarHBondContact CE1-SD 3.46Å; Y248-M252 HydrophobicContact CE2-SD 4.37Å; Y248-M252 WeakPolarHBondContact O-CG 3.38Å; Y248-M252 PolarHBondContact O-N 3.39Å; Y248-M252 PolarHBondContact OH-SD 2.77Å |
| 249 | L | 91 | Very high | 87.5 | Confident | 13 Ų | 13 | 62.3 Ų | 62.3 | 7% | 0.068 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -70 | -32.7 | 178.4 | -70.9 | 175.5 | 0 | 0 | 0 | 113.1 | F153 L164 L174 L245 S246 A247 H251 M252 S253 | F153-L249 HydrophobicContact CE2-CD2 3.83Å; F153-L249 HydrophobicContact CZ-CD2 4.34Å; L164-L249 HydrophobicContact CB-CD1 4.15Å; L164-L249 HydrophobicContact CB-CD2 4.2Å; L164-L249 HydrophobicContact CD1-CD1 4.42Å; L164-L249 HydrophobicContact CD2-CD1 3.95Å; L164-L249 HydrophobicContact CG-CD1 4.4Å; L174-L249 HydrophobicContact CD2-CD1 3.79Å; L245-L249 HydrophobicContact CD1-CD1 4.2Å; L245-L249 HydrophobicContact CD1-CG 4.14Å; L245-L249 HydrophobicContact CG-CD1 4.07Å; L245-L249 HydrophobicContact CG-CG 4.41Å; L245-L249 WeakPolarHBondContact O-CB 3.39Å; L245-L249 VanDerWaalsContact O-CG 3.26Å; L245-L249 WeakPolarHBondContact O-CG 3.48Å; L245-L249 PolarHBondContact O-N 3.36Å; S246-L249 PolarHBondContact O-N 2.89Å; S246-L249 VanDerWaalsContact O-N 3.12Å; A247-L249 VanDerWaalsContact C-N 3.33Å; A247-L249 PolarHBondContact O-N 3.47Å; L249-H251 VanDerWaalsContact C-N 3.28Å; L249-H251 PolarHBondContact O-N 3.22Å; L249-M252 HydrophobicContact CD2-SD 4.29Å; L249-M252 PolarHBondContact O-N 2.91Å; L249-M252 VanDerWaalsContact O-N 3.12Å; L249-S253 PolarHBondContact O-N 2.75Å |
| 250 | E | 88.6 | Confident | 87.5 | Confident | 97 Ų | 97 | 59.5 Ų | 59.5 | 45% | 0.453 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -61.1 | -37.5 | 173.5 | -72.3 | -173.7 | 152.9 | 0 | 0 | 112.3 | I171 S246 A247 M252 S253 | I171-E250 HydrophobicContact CD1-CG 3.89Å; I171-E250 HydrophobicContact CG1-CG 4.49Å; I171-E250 HydrophobicContact CG2-CG 4.2Å; S246-E250 PolarHBondContact O-N 3.44Å; A247-E250 PolarHBondContact O-N 2.85Å; E250-M252 PolarHBondContact O-N 3.37Å; E250-S253 PolarHBondContact O-N 2.84Å |
| 251 | H | 84.2 | Confident | 87.6 | Confident | 160 Ų | 160 | 59.8 Ų | 59.8 | 74% | 0.741 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -72.8 | -16.7 | 176.7 | -67.4 | 76.7 | 0 | 0 | 0 | 113.2 | A247 Y248 L249 | A247-H251 PolarHBondContact O-N 3.04Å; A247-H251 PolarHBondContact O-ND1 3.26Å; Y248-H251 PolarHBondContact O-N 2.89Å; L249-H251 VanDerWaalsContact C-N 3.28Å; L249-H251 PolarHBondContact O-N 3.22Å |
| 252 | M | 77.4 | Confident | 87.5 | Confident | 84 Ų | 84 | 64 Ų | 64 | 41% | 0.414 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -92.9 | -15 | 178.3 | -67.3 | -172.8 | 78.6 | 0 | 0 | 113.9 | Y248 L249 E250 | Y248-M252 HydrophobicContact CD1-SD 4Å; Y248-M252 HydrophobicContact CE1-CG 4.22Å; Y248-M252 HydrophobicContact CE1-SD 3.21Å; Y248-M252 WeakPolarHBondContact CE1-SD 3.46Å; Y248-M252 HydrophobicContact CE2-SD 4.37Å; Y248-M252 WeakPolarHBondContact O-CG 3.38Å; Y248-M252 PolarHBondContact O-N 3.39Å; Y248-M252 PolarHBondContact OH-SD 2.77Å; L249-M252 HydrophobicContact CD2-SD 4.29Å; L249-M252 PolarHBondContact O-N 2.91Å; L249-M252 VanDerWaalsContact O-N 3.12Å; E250-M252 PolarHBondContact O-N 3.37Å |
| 253 | S | 63.8 | Low | 87.6 | Confident | 143 Ų | 143 | 59.8 Ų | 59.8 | 100% | 1 | 33% | 0.33 | S | S | * | . | trans | -85.4 | 0 | -175.5 | -174.6 | 0 | 0 | 0 | 0 | 113.2 | L249 E250 | L249-S253 PolarHBondContact O-N 2.75Å; E250-S253 PolarHBondContact O-N 2.84Å |
Retrieved 253 of 253 residues in 904.9 ms
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