| 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 | 48.7 | Very low | 44.7 | Very low | 254 Ų | 254 | 168.5 Ų | 168.5 | 100% | 1.251 | 84% | 0.838 | S | S | * | * | 0 | 111.5 | 0 | -66.3 | -171.6 | -161.8 | 0 | 0 | 107.6 | |||||
| 2 | Q | 38.5 | Very low | 44.6 | Very low | 189 Ų | 189 | 165.4 Ų | 165.4 | 88% | 0.883 | 83% | 0.827 | S | S | * | * | trans | -126.4 | 128.6 | -169 | -105.4 | 173.8 | -14 | 0 | 0 | 108.8 | ||||
| 3 | K | 47 | Very low | 44 | Very low | 207 Ų | 207 | 165.2 Ų | 165.2 | 90% | 0.9 | 82% | 0.821 | S | S | * | * | trans | -149.1 | 89.4 | 158.5 | -79.1 | -170 | 175.8 | 179.7 | 0 | 106.3 | ||||
| 4 | Q | 49.2 | Very low | 43.7 | Very low | 153 Ų | 153 | 165.4 Ų | 165.4 | 72% | 0.715 | 83% | 0.826 | S | S | * | * | 66.5 | 100.7 | 91.9 | -80.5 | -170.3 | -11.9 | 0 | 0 | 114.4 | Y6 | Q4-Y6 HydrophobicContact CB-CE2 4.37Š| |||
| 5 | N | 44.7 | Very low | 43.1 | Very low | 163 Ų | 163 | 161.1 Ų | 161.1 | 87% | 0.872 | 83% | 0.826 | S | S | * | * | trans | -66.6 | 139 | 154.2 | -70.2 | -36.9 | 0 | 0 | 0 | 109.6 | ||||
| 6 | Y | 47.4 | Very low | 42.8 | Very low | 170 Ų | 170 | 159.3 Ų | 159.3 | 67% | 0.667 | 83% | 0.825 | S | S | * | * | trans | -131.4 | 103.5 | 158.2 | -87.4 | -81.9 | 0 | 0 | 0 | 108.9 | Q4 | Q4-Y6 HydrophobicContact CB-CE2 4.37Š| ||
| 7 | A | 41.4 | Very low | 42.7 | Very low | 97 Ų | 97 | 156.3 Ų | 156.3 | 80% | 0.802 | 82% | 0.818 | S | S | * | * | trans | -95.6 | 120.7 | 152.1 | 0 | 0 | 0 | 0 | 0 | 106 | ||||
| 8 | N | 47.3 | Very low | 42.4 | Very low | 125 Ų | 125 | 159.5 Ų | 159.5 | 67% | 0.668 | 82% | 0.824 | S | S | * | * | trans | -125.4 | 112.5 | 169.6 | -80.9 | -19.2 | 0 | 0 | 0 | 108.6 | ||||
| 9 | N | 41.6 | Very low | 42.1 | Very low | 152 Ų | 152 | 162.5 Ų | 162.5 | 81% | 0.813 | 83% | 0.826 | S | S | * | * | trans | -59.8 | 137.8 | 157.2 | -79.9 | -25.5 | 0 | 0 | 0 | 109.6 | ||||
| 10 | F | 42 | Very low | 41.8 | Very low | 199 Ų | 199 | 163.6 Ų | 163.6 | 87% | 0.873 | 83% | 0.827 | S | S | * | * | trans | -135.6 | 92.6 | 152.7 | -99 | -83.2 | 0 | 0 | 0 | 107.2 | ||||
| 11 | D | 43.7 | Very low | 41.6 | Very low | 145 Ų | 145 | 160.8 Ų | 160.8 | 78% | 0.775 | 82% | 0.823 | S | S | * | * | trans | -65.1 | 122.9 | 147.1 | -75.6 | -46.7 | 0 | 0 | 0 | 107 | ||||
| 12 | D | 43.6 | Very low | 41.1 | Very low | 131 Ų | 131 | 153.1 Ų | 153.1 | 70% | 0.701 | 80% | 0.8 | S | S | * | * | 173.6 | 133.3 | 119.2 | -116.7 | -8.7 | 0 | 0 | 0 | 112 | |||||
| 13 | Q | 36.6 | Very low | 41 | Very low | 162 Ų | 162 | 153.7 Ų | 153.7 | 76% | 0.757 | 79% | 0.794 | S | S | * | * | trans | 60.3 | 101.3 | 147.3 | -59.4 | 179 | 59.9 | 0 | 0 | 118.5 | ||||
| 14 | L | 40.2 | Very low | 40.6 | Very low | 169 Ų | 169 | 151.8 Ų | 151.8 | 89% | 0.885 | 79% | 0.793 | S | S | * | * | trans | -160.5 | 108.8 | 136 | -104.1 | 160.3 | 0 | 0 | 0 | 109.8 | T16 | L14-T16 PolarHBondContact O-N 2.96Š| ||
| 15 | A | 34.8 | Very low | 40 | Very low | 101 Ų | 101 | 151.8 Ų | 151.8 | 84% | 0.835 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -54 | 119.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 16 | T | 38.6 | Very low | 40 | Very low | 132 Ų | 132 | 148.8 Ų | 148.8 | 81% | 0.81 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -100 | 128.2 | 167.5 | 40.4 | 0 | 0 | 0 | 0 | 109.6 | L14 | L14-T16 PolarHBondContact O-N 2.96Š|
| 17 | P | 40.5 | Very low | 39.8 | Very low | 108 Ų | 108 | 146.3 Ų | 146.3 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 140.7 | 179.1 | 28 | -32 | 0 | 0 | 0 | 110.3 | Y19 | P17-Y19 PolarHBondContact O-N 2.98Š|
| 18 | K | 37.2 | Very low | 40.1 | Very low | 214 Ų | 214 | 149.7 Ų | 149.7 | 93% | 0.93 | 79% | 0.785 | S | S | * | * | trans | -58.4 | 101.5 | 171.7 | -71.7 | 179.1 | 176.5 | 179.6 | 0 | 109.6 | ||||
| 19 | Y | 36.5 | Very low | 39.9 | Very low | 217 Ų | 217 | 152.9 Ų | 152.9 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | trans | -91.3 | 100.2 | 161.6 | -115.9 | -93.6 | 0 | 0 | 0 | 107.5 | P17 S21 | P17-Y19 PolarHBondContact O-N 2.98Å; Y19-S21 PolarHBondContact O-N 2.89Å; Y19-S21 VanDerWaalsContact O-N 3.12Å | ||
| 20 | E | 36.8 | Very low | 40.1 | Very low | 184 Ų | 184 | 150.3 Ų | 150.3 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | trans | -63.7 | 109.7 | 163.1 | -89.2 | 178 | 161.9 | 0 | 0 | 107.9 | A22 | E20-A22 PolarHBondContact O-N 3.05Š| ||
| 21 | S | 38.4 | Very low | 40.5 | Very low | 105 Ų | 105 | 145.7 Ų | 145.7 | 73% | 0.734 | 78% | 0.776 | S | S | * | * | trans | -55 | 107.3 | 171.2 | -176.6 | 0 | 0 | 0 | 0 | 108.9 | Y19 R23 | Y19-S21 PolarHBondContact O-N 2.89Å; Y19-S21 VanDerWaalsContact O-N 3.12Å; S21-R23 PolarHBondContact O-N 2.89Å | ||
| 22 | A | 36.6 | Very low | 40.6 | Very low | 93 Ų | 93 | 140.7 Ų | 140.7 | 77% | 0.769 | 75% | 0.752 | S | S | * | * | trans | -59.6 | 86.6 | 163.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | E20 N24 | E20-A22 PolarHBondContact O-N 3.05Å; A22-N24 PolarHBondContact O-N 2.84Å; A22-N24 VanDerWaalsContact O-N 3.1Å | ||
| 23 | R | 37.5 | Very low | 41.2 | Very low | 201 Ų | 201 | 139.5 Ų | 139.5 | 76% | 0.758 | 75% | 0.752 | S | S | * | * | trans | -58.6 | 115.6 | 165 | -99.6 | -173.7 | -178.6 | -171.5 | 1.7 | 107 | S21 F25 | S21-R23 PolarHBondContact O-N 2.89Å; R23-F25 VanDerWaalsContact C-N 3.31Å; R23-F25 HydrophobicContact CB-CD2 4.23Å; R23-F25 HydrophobicContact CB-CE2 3.91Å; R23-F25 VanDerWaalsContact O-CD2 3.26Å; R23-F25 WeakPolarHBondContact O-CD2 3.32Å; R23-F25 PolarHBondContact O-N 2.86Å | ||
| 24 | N | 37.6 | Very low | 42.2 | Very low | 166 Ų | 166 | 136.1 Ų | 136.1 | 89% | 0.888 | 74% | 0.738 | S | S | * | * | trans | -46.5 | 90.9 | 164.1 | -71.6 | -38.5 | 0 | 0 | 0 | 110.7 | A22 | A22-N24 PolarHBondContact O-N 2.84Å; A22-N24 VanDerWaalsContact O-N 3.1Å | ||
| 25 | F | 36.5 | Very low | 43.1 | Very low | 154 Ų | 154 | 133 Ų | 133 | 68% | 0.675 | 72% | 0.722 | S | S | * | * | trans | -90.3 | 134.5 | 161.5 | -75.7 | -80.8 | 0 | 0 | 0 | 108 | R23 | R23-F25 VanDerWaalsContact C-N 3.31Å; R23-F25 HydrophobicContact CB-CD2 4.23Å; R23-F25 HydrophobicContact CB-CE2 3.91Å; R23-F25 VanDerWaalsContact O-CD2 3.26Å; R23-F25 WeakPolarHBondContact O-CD2 3.32Å; R23-F25 PolarHBondContact O-N 2.86Å | ||
| 26 | P | 44.7 | Very low | 44 | Very low | 100 Ų | 100 | 131.6 Ų | 131.6 | 65% | 0.649 | 70% | 0.7 | S | S | * | * | trans | -56.8 | 147.3 | 169.2 | 26.2 | -32.6 | 0 | 0 | 0 | 108.8 | Q28 | P26-Q28 PolarHBondContact O-N 3.17Š| ||
| 27 | P | 43.9 | Very low | 44.9 | Very low | 118 Ų | 118 | 128 Ų | 128 | 77% | 0.766 | 68% | 0.683 | S | S | * | * | trans | -53.4 | 111.3 | 179.1 | 21.7 | -31.5 | 0 | 0 | 0 | 108.4 | F29 | P27-F29 PolarHBondContact O-N 3.15Å; P27-F29 VanDerWaalsContact O-N 3.16Å | ||
| 28 | Q | 46.8 | Very low | 45.6 | Very low | 167 Ų | 167 | 126.7 Ų | 126.7 | 78% | 0.78 | 67% | 0.671 | S | S | * | * | trans | -68.2 | 113.4 | 168.1 | -71 | -175.5 | 9.3 | 0 | 0 | 104.7 | P26 A30 | P26-Q28 PolarHBondContact O-N 3.17Å; Q28-A30 PolarHBondContact O-N 3.1Å | ||
| 29 | F | 44.4 | Very low | 46.6 | Very low | 193 Ų | 193 | 125.8 Ų | 125.8 | 85% | 0.846 | 66% | 0.661 | S | S | * | * | trans | -49.4 | 114.5 | 166.4 | -71 | -88.2 | 0 | 0 | 0 | 106.6 | P27 I31 | P27-F29 PolarHBondContact O-N 3.15Å; P27-F29 VanDerWaalsContact O-N 3.16Å; F29-I31 VanDerWaalsContact C-N 3.26Å; F29-I31 PolarHBondContact O-N 3.49Å | ||
| 30 | A | 45.5 | Very low | 47.3 | Very low | 97 Ų | 97 | 120.9 Ų | 120.9 | 80% | 0.802 | 65% | 0.65 | S | S | * | * | trans | -58 | 101.1 | 168.1 | 0 | 0 | 0 | 0 | 0 | 105.6 | Q28 S32 | Q28-A30 PolarHBondContact O-N 3.1Å; A30-S32 PolarHBondContact O-N 3.47Å | ||
| 31 | I | 49.3 | Very low | 48 | Very low | 103 Ų | 103 | 116 Ų | 116 | 53% | 0.528 | 64% | 0.636 | S | S | . | * | trans | -60.8 | 110.9 | 168.1 | -61.1 | 172.3 | 0 | 0 | 0 | 103.3 | F29 L35 N36 | F29-I31 VanDerWaalsContact C-N 3.26Å; F29-I31 PolarHBondContact O-N 3.49Å; I31-L35 HydrophobicContact CG2-CB 3.84Å; I31-N36 WeakPolarHBondContact CG2-OD1 3.46Å | ||
| 32 | S | 47.5 | Very low | 48.4 | Very low | 39 Ų | 39 | 118.6 Ų | 118.6 | 27% | 0.273 | 63% | 0.634 | S | S | . | * | trans | -53.2 | 142.4 | -176.3 | 63.7 | 0 | 0 | 0 | 0 | 109.1 | A30 I34 L35 N36 | A30-S32 PolarHBondContact O-N 3.47Å; S32-I34 PolarHBondContact O-N 3.35Å; S32-L35 PolarHBondContact O-N 3.41Å; S32-L35 WeakPolarHBondContact OG-CG 3.39Å; S32-L35 PolarHBondContact OG-N 3.03Å; S32-N36 PolarHBondContact O-N 2.97Å | ||
| 33 | P | 55.6 | Low | 48.8 | Very low | 107 Ų | 107 | 118.6 Ų | 118.6 | 70% | 0.695 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -50.1 | -31.4 | 175.1 | -25.5 | 32.5 | 0 | 0 | 0 | 112 | N36 A37 | P33-N36 PolarHBondContact O-N 2.95Å; P33-A37 WeakPolarHBondContact O-CB 3.27Å; P33-A37 PolarHBondContact O-N 2.92Å |
| 34 | I | 56.6 | Low | 48.8 | Very low | 91 Ų | 91 | 116 Ų | 116 | 47% | 0.467 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -61.4 | -43.6 | 175.2 | -57.7 | 170.1 | 0 | 0 | 0 | 112 | S32 A37 L38 | S32-I34 PolarHBondContact O-N 3.35Å; I34-A37 PolarHBondContact O-N 2.91Å; I34-L38 HydrophobicContact CG2-CD1 3.94Å; I34-L38 WeakPolarHBondContact O-CB 3.45Å; I34-L38 WeakPolarHBondContact O-CG 3.22Å; I34-L38 PolarHBondContact O-N 3.37Å |
| 35 | L | 59.1 | Low | 48.8 | Very low | 102 Ų | 102 | 112.6 Ų | 112.6 | 53% | 0.534 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -70.7 | -32 | 178.3 | -74 | 173.9 | 0 | 0 | 0 | 112.5 | I31 S32 R39 | I31-L35 HydrophobicContact CG2-CB 3.84Å; S32-L35 PolarHBondContact O-N 3.41Å; S32-L35 WeakPolarHBondContact OG-CG 3.39Å; S32-L35 PolarHBondContact OG-N 3.03Å; L35-R39 WeakPolarHBondContact O-CB 3.5Å; L35-R39 PolarHBondContact O-N 2.89Å |
| 36 | N | 53.7 | Low | 48.7 | Very low | 73 Ų | 73 | 110.6 Ų | 110.6 | 39% | 0.39 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -71.1 | -42.5 | 171 | -76.1 | -24.7 | 0 | 0 | 0 | 111.3 | I31 S32 P33 L38 R39 D40 | I31-N36 WeakPolarHBondContact CG2-OD1 3.46Å; S32-N36 PolarHBondContact O-N 2.97Å; P33-N36 PolarHBondContact O-N 2.95Å; N36-L38 PolarHBondContact O-N 3.44Å; N36-R39 WeakPolarHBondContact O-CB 3.25Å; N36-R39 PolarHBondContact O-N 3.13Å; N36-R39 VanDerWaalsContact O-N 3.14Å; N36-D40 PolarHBondContact O-N 3.46Å |
| 37 | A | 58.8 | Low | 48 | Very low | 55 Ų | 55 | 114 Ų | 114 | 46% | 0.455 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -63 | -39.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | P33 I34 R39 D40 S41 | P33-A37 WeakPolarHBondContact O-CB 3.27Å; P33-A37 PolarHBondContact O-N 2.92Å; I34-A37 PolarHBondContact O-N 2.91Å; A37-R39 VanDerWaalsContact C-N 3.3Å; A37-R39 PolarHBondContact O-N 3.45Å; A37-D40 PolarHBondContact O-N 2.87Å; A37-S41 WeakPolarHBondContact O-CB 3.44Å; A37-S41 PolarHBondContact O-N 3.46Å; A37-S41 PolarHBondContact O-OG 3.45Å |
| 38 | L | 55.1 | Low | 47.5 | Very low | 82 Ų | 82 | 112.9 Ų | 112.9 | 43% | 0.429 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -70.8 | -24.4 | 175 | -76.3 | 168 | 0 | 0 | 0 | 113.3 | I34 N36 S41 | I34-L38 HydrophobicContact CG2-CD1 3.94Å; I34-L38 WeakPolarHBondContact O-CB 3.45Å; I34-L38 WeakPolarHBondContact O-CG 3.22Å; I34-L38 PolarHBondContact O-N 3.37Å; N36-L38 PolarHBondContact O-N 3.44Å; L38-S41 WeakPolarHBondContact CA-OG 3.41Å; L38-S41 PolarHBondContact O-OG 3.3Å |
| 39 | R | 57.6 | Low | 46.8 | Very low | 194 Ų | 194 | 110.4 Ų | 110.4 | 73% | 0.732 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -77 | -38.2 | 175.7 | -163.1 | 177.2 | -172.4 | -176.2 | 1.3 | 111.2 | L35 N36 A37 | L35-R39 WeakPolarHBondContact O-CB 3.5Å; L35-R39 PolarHBondContact O-N 2.89Å; N36-R39 WeakPolarHBondContact O-CB 3.25Å; N36-R39 PolarHBondContact O-N 3.13Å; N36-R39 VanDerWaalsContact O-N 3.14Å; A37-R39 VanDerWaalsContact C-N 3.3Å; A37-R39 PolarHBondContact O-N 3.45Å |
| 40 | D | 50.4 | Low | 46.5 | Very low | 115 Ų | 115 | 107.4 Ų | 107.4 | 62% | 0.615 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -77.1 | -27.1 | 178.5 | -65.7 | -22.2 | 0 | 0 | 0 | 112.2 | N36 A37 K42 S43 | N36-D40 PolarHBondContact O-N 3.46Å; A37-D40 PolarHBondContact O-N 2.87Å; D40-K42 VanDerWaalsContact C-N 3.29Å; D40-K42 PolarHBondContact O-N 2.96Å; D40-S43 PolarHBondContact O-N 3.31Å; D40-S43 PolarHBondContact O-OG 3.03Å |
| 41 | S | 52.1 | Low | 46.2 | Very low | 81 Ų | 81 | 108.7 Ų | 108.7 | 57% | 0.566 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | -9.3 | 179.6 | 71.1 | 0 | 0 | 0 | 0 | 115.3 | A37 L38 S43 | A37-S41 WeakPolarHBondContact O-CB 3.44Å; A37-S41 PolarHBondContact O-N 3.46Å; A37-S41 PolarHBondContact O-OG 3.45Å; L38-S41 WeakPolarHBondContact CA-OG 3.41Å; L38-S41 PolarHBondContact O-OG 3.3Å; S41-S43 VanDerWaalsContact C-N 3.33Å |
| 42 | K | 46.3 | Very low | 45.3 | Very low | 159 Ų | 159 | 111.1 Ų | 111.1 | 69% | 0.691 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | 3.9 | 176.2 | -75.6 | -175.8 | 179.4 | 178.1 | 0 | 113.9 | D40 E155 | D40-K42 VanDerWaalsContact C-N 3.29Å; D40-K42 PolarHBondContact O-N 2.96Å; K42-E155 IonicContact NZ-OE2 2.95Å |
| 43 | S | 46.7 | Very low | 45 | Very low | 94 Ų | 94 | 120.8 Ų | 120.8 | 66% | 0.657 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -105.1 | -0.8 | -172.6 | 69.3 | 0 | 0 | 0 | 0 | 116.5 | D40 S41 | D40-S43 PolarHBondContact O-N 3.31Å; D40-S43 PolarHBondContact O-OG 3.03Å; S41-S43 VanDerWaalsContact C-N 3.33Å |
| 44 | I | 36.8 | Very low | 43.9 | Very low | 145 Ų | 145 | 122 Ų | 122 | 74% | 0.744 | 69% | 0.688 | S | S | * | * | trans | -138.2 | 78.5 | -176 | -49.2 | 177.8 | 0 | 0 | 0 | 111.2 | ||||
| 45 | A | 37 | Very low | 43.2 | Very low | 95 Ų | 95 | 123 Ų | 123 | 79% | 0.785 | 70% | 0.703 | S | S | * | * | trans | -159.5 | 71.6 | 157.8 | 0 | 0 | 0 | 0 | 0 | 107 | ||||
| 46 | C | 35 | Very low | 42 | Very low | 113 Ų | 113 | 127.1 Ų | 127.1 | 76% | 0.764 | 72% | 0.719 | S | S | * | * | 38.9 | 86.7 | 90 | -85 | 0 | 0 | 0 | 0 | 113.9 | A48 | C46-A48 PolarHBondContact O-N 3.25Š| |||
| 47 | N | 30 | Very low | 41.4 | Very low | 170 Ų | 170 | 130.2 Ų | 130.2 | 91% | 0.909 | 74% | 0.741 | S | S | * | * | trans | 31.4 | 88.2 | 135.2 | -60.7 | -16.3 | 0 | 0 | 0 | 116.8 | ||||
| 48 | A | 33.9 | Very low | 40.1 | Very low | 96 Ų | 96 | 133.2 Ų | 133.2 | 79% | 0.793 | 76% | 0.755 | S | S | * | * | trans | -129.6 | 112.6 | 153.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | C46 | C46-A48 PolarHBondContact O-N 3.25Š| ||
| 49 | S | 32.1 | Very low | 39.2 | Very low | 115 Ų | 115 | 134.8 Ų | 134.8 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | -56.4 | 132.9 | 177.1 | 140 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 50 | T | 38.4 | Very low | 37.9 | Very low | 129 Ų | 129 | 130.6 Ų | 130.6 | 79% | 0.791 | 77% | 0.774 | S | S | * | * | trans | -149.5 | 101.4 | 148.3 | 28.6 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 51 | T | 37.3 | Very low | 36.9 | Very low | 124 Ų | 124 | 128.4 Ų | 128.4 | 76% | 0.761 | 78% | 0.778 | S | S | * | * | trans | 43.6 | 118.9 | 137.1 | 36.7 | 0 | 0 | 0 | 0 | 120.5 | R53 | T51-R53 PolarHBondContact O-N 3.48Š| ||
| 52 | D | 31.9 | Very low | 36.1 | Very low | 154 Ų | 154 | 130.6 Ų | 130.6 | 82% | 0.824 | 79% | 0.788 | S | S | * | * | trans | -32.7 | 122.5 | 155.3 | -87.4 | -41.5 | 0 | 0 | 0 | 114.1 | ||||
| 53 | R | 39.6 | Very low | 35.3 | Very low | 243 Ų | 243 | 128.8 Ų | 128.8 | 92% | 0.917 | 79% | 0.793 | S | S | * | * | trans | -135.8 | 95.4 | 147.4 | -80.6 | -164.5 | 171.2 | 170 | -1.4 | 109.2 | T51 S55 | T51-R53 PolarHBondContact O-N 3.48Å; R53-S55 PolarHBondContact O-N 2.88Å | ||
| 54 | T | 32.4 | Very low | 34.8 | Very low | 132 Ų | 132 | 130.8 Ų | 130.8 | 81% | 0.81 | 79% | 0.794 | S | S | * | * | trans | -60.4 | 116.5 | 159.9 | 46.4 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 55 | S | 43 | Very low | 34.6 | Very low | 113 Ų | 113 | 129.4 Ų | 129.4 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | -153.5 | 105.8 | 147.3 | 64.7 | 0 | 0 | 0 | 0 | 109.2 | R53 | R53-S55 PolarHBondContact O-N 2.88Š| ||
| 56 | E | 34.6 | Very low | 34.4 | Very low | 188 Ų | 188 | 135.3 Ų | 135.3 | 88% | 0.879 | 80% | 0.797 | S | S | * | * | trans | -55.2 | 131.2 | 166.2 | -65.1 | 168.9 | 129.7 | 0 | 0 | 111 | ||||
| 57 | V | 40 | Very low | 34.3 | Very low | 138 Ų | 138 | 133.8 Ų | 133.8 | 84% | 0.836 | 79% | 0.787 | S | S | * | * | trans | -151 | 113.2 | 134.2 | -177.2 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 58 | P | 31.8 | Very low | 34.8 | Very low | 117 Ų | 117 | 135.2 Ų | 135.2 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | trans | -95.6 | 128.2 | 167 | 33.5 | -24 | 0 | 0 | 0 | 109.2 | ||||
| 59 | S | 36.1 | Very low | 34.8 | Very low | 116 Ų | 116 | 140.6 Ų | 140.6 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | trans | -159.6 | 142.2 | 154.8 | -159 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 60 | S | 29.7 | Very low | 34.8 | Very low | 106 Ų | 106 | 139.7 Ų | 139.7 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | trans | -67.6 | 142.5 | -167.2 | 48.6 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 61 | G | 31.1 | Very low | 34.4 | Very low | 68 Ų | 68 | 139 Ų | 139 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | 57.7 | 109.5 | 127.2 | 0 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 62 | T | 33.7 | Very low | 34.2 | Very low | 127 Ų | 127 | 138.1 Ų | 138.1 | 78% | 0.779 | 78% | 0.78 | S | S | * | * | -174.1 | 154.8 | 128.7 | 19.3 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 63 | P | 29.9 | Very low | 34.3 | Very low | 122 Ų | 122 | 136.9 Ų | 136.9 | 79% | 0.792 | 78% | 0.778 | S | S | * | * | trans | -90.3 | 119 | -163.7 | 34.3 | -28.3 | 0 | 0 | 0 | 110.3 | ||||
| 64 | I | 35.8 | Very low | 34.4 | Very low | 135 Ų | 135 | 130.7 Ų | 130.7 | 69% | 0.692 | 76% | 0.762 | S | S | * | * | trans | -133 | 114.9 | -174.3 | -62.3 | -177.9 | 0 | 0 | 0 | 112.5 | ||||
| 65 | D | 32.5 | Very low | 34.6 | Very low | 117 Ų | 117 | 129 Ų | 129 | 63% | 0.626 | 75% | 0.753 | S | S | * | * | trans | 64.7 | 115.6 | 140.8 | -68.3 | -30.4 | 0 | 0 | 0 | 123.2 | S67 | D65-S67 VanDerWaalsContact C-N 3.26Å; D65-S67 PolarHBondContact O-N 3.02Å | ||
| 66 | K | 33.8 | Very low | 34.7 | Very low | 219 Ų | 219 | 131.5 Ų | 131.5 | 95% | 0.952 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -63 | 78.3 | 150.8 | -60.8 | 170.2 | -179.9 | 174.4 | 0 | 109.6 | ||
| 67 | S | 33.1 | Very low | 35.3 | Very low | 81 Ų | 81 | 128.5 Ų | 128.5 | 57% | 0.566 | 75% | 0.746 | S | S | * | * | trans | -147.5 | 16.9 | 172.6 | 63.6 | 0 | 0 | 0 | 0 | 115.6 | D65 F69 | D65-S67 VanDerWaalsContact C-N 3.26Å; D65-S67 PolarHBondContact O-N 3.02Å; S67-F69 PolarHBondContact O-N 3.33Å | ||
| 68 | F | 39.1 | Very low | 35.4 | Very low | 200 Ų | 200 | 124.1 Ų | 124.1 | 88% | 0.877 | 73% | 0.73 | S | S | * | * | trans | -77.7 | 29.1 | 178.8 | -76 | -81.3 | 0 | 0 | 0 | 115.7 | ||||
| 69 | F | 34.2 | Very low | 36.1 | Very low | 208 Ų | 208 | 122.1 Ų | 122.1 | 91% | 0.912 | 71% | 0.712 | S | S | * | * | trans | -98.1 | 64.5 | 158.2 | -89.4 | -84.8 | 0 | 0 | 0 | 109.1 | S67 S71 | S67-F69 PolarHBondContact O-N 3.33Å; F69-S71 PolarHBondContact O-N 3.3Å; F69-S71 VanDerWaalsContact O-N 3.16Å | ||
| 70 | S | 32.1 | Very low | 36.7 | Very low | 97 Ų | 97 | 119.8 Ų | 119.8 | 68% | 0.678 | 70% | 0.7 | S | S | * | * | trans | -76.8 | 96.3 | 158.5 | -95.4 | 0 | 0 | 0 | 0 | 108 | T72 | S70-T72 PolarHBondContact O-N 2.94Š| ||
| 71 | S | 30.3 | Very low | 37.5 | Very low | 113 Ų | 113 | 122.3 Ų | 122.3 | 79% | 0.79 | 70% | 0.697 | S | S | * | * | trans | -60.6 | 75.2 | 157.4 | 43.4 | 0 | 0 | 0 | 0 | 109.2 | F69 V73 | F69-S71 PolarHBondContact O-N 3.3Å; F69-S71 VanDerWaalsContact O-N 3.16Å; S71-V73 PolarHBondContact O-N 3.42Å | ||
| 72 | T | 32.8 | Very low | 38.2 | Very low | 106 Ų | 106 | 121.2 Ų | 121.2 | 65% | 0.65 | 68% | 0.681 | S | S | * | * | trans | -78.9 | 100.5 | 168.4 | -42.1 | 0 | 0 | 0 | 0 | 107.5 | S70 I74 | S70-T72 PolarHBondContact O-N 2.94Å; T72-I74 PolarHBondContact O-N 3.49Å; T72-I74 VanDerWaalsContact O-N 3.11Å | ||
| 73 | V | 34.6 | Very low | 39 | Very low | 128 Ų | 128 | 124 Ų | 124 | 78% | 0.776 | 68% | 0.678 | S | S | * | * | trans | -50.4 | 110.7 | 171 | 179.7 | 0 | 0 | 0 | 0 | 108.6 | S71 | S71-V73 PolarHBondContact O-N 3.42Š| ||
| 74 | I | 41.1 | Very low | 40 | Very low | 114 Ų | 114 | 126.3 Ų | 126.3 | 59% | 0.585 | 68% | 0.675 | S | S | * | * | trans | -65.9 | 128.8 | 165.3 | -60.1 | 172.9 | 0 | 0 | 0 | 105.6 | T72 E76 L79 | T72-I74 PolarHBondContact O-N 3.49Å; T72-I74 VanDerWaalsContact O-N 3.11Å; I74-E76 PolarHBondContact O-N 3.47Å; I74-L79 HydrophobicContact CG2-CD1 4.05Å | ||
| 75 | P | 37.1 | Very low | 40.6 | Very low | 95 Ų | 95 | 123.8 Ų | 123.8 | 62% | 0.617 | 66% | 0.663 | S | S | * | * | trans | -64.6 | 101 | 175 | 26.1 | -30.6 | 0 | 0 | 0 | 108.1 | V77 G78 | P75-V77 PolarHBondContact O-N 2.97Å; P75-G78 PolarHBondContact O-N 3.39Å; P75-G78 VanDerWaalsContact O-N 3.12Å | ||
| 76 | E | 45.7 | Very low | 41.3 | Very low | 167 Ų | 167 | 119.7 Ų | 119.7 | 78% | 0.78 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -55 | -18 | 178.7 | -141.9 | 179.4 | -179.3 | 0 | 0 | 112.2 | I74 G78 | I74-E76 PolarHBondContact O-N 3.47Å; E76-G78 VanDerWaalsContact C-N 3.32Å; E76-G78 PolarHBondContact O-N 3.28Å |
| 77 | V | 46.4 | Very low | 42.2 | Very low | 124 Ų | 124 | 113.1 Ų | 113.1 | 75% | 0.752 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -68.8 | -23.3 | -179.8 | -165.1 | 0 | 0 | 0 | 0 | 113.2 | P75 | P75-V77 PolarHBondContact O-N 2.97Å |
| 78 | G | 41.5 | Very low | 43 | Very low | 47 Ų | 47 | 116.7 Ų | 116.7 | 49% | 0.485 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -84.6 | -36.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | P75 E76 A82 | P75-G78 PolarHBondContact O-N 3.39Å; P75-G78 VanDerWaalsContact O-N 3.12Å; E76-G78 VanDerWaalsContact C-N 3.32Å; E76-G78 PolarHBondContact O-N 3.28Å; G78-A82 PolarHBondContact O-N 3.44Å |
| 79 | L | 48.1 | Very low | 43.5 | Very low | 75 Ų | 75 | 111.4 Ų | 111.4 | 39% | 0.393 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -76.6 | -32.1 | -174.5 | -94 | 150.6 | 0 | 0 | 0 | 113.3 | I74 R83 | I74-L79 HydrophobicContact CG2-CD1 4.05Å; L79-R83 WeakPolarHBondContact O-CG 3.31Å; L79-R83 PolarHBondContact O-N 3.4Å |
| 80 | A | 48.3 | Very low | 44.2 | Very low | 66 Ų | 66 | 111.2 Ų | 111.2 | 55% | 0.545 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -70.4 | -33.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | K84 | A80-K84 PolarHBondContact O-N 3.39Å |
| 81 | K | 46 | Very low | 45 | Very low | 159 Ų | 159 | 115.6 Ų | 115.6 | 69% | 0.691 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -75.4 | -37.7 | 180 | -146.5 | 172.9 | -175 | -178.8 | 0 | 111.8 | L85 | K81-L85 PolarHBondContact O-N 2.89Å |
| 82 | A | 46.2 | Very low | 45.9 | Very low | 45 Ų | 45 | 120.5 Ų | 120.5 | 37% | 0.372 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -67.4 | -41 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G78 K84 L85 G86 | G78-A82 PolarHBondContact O-N 3.44Å; A82-K84 PolarHBondContact O-N 3.46Å; A82-L85 PolarHBondContact O-N 3.02Å; A82-G86 PolarHBondContact O-N 3.21Å |
| 83 | R | 49.4 | Very low | 46.9 | Very low | 187 Ų | 187 | 121.8 Ų | 121.8 | 71% | 0.706 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -68.6 | -32.9 | 178.1 | -75.4 | 179.9 | -178.2 | 164.7 | 1.2 | 113.7 | L79 S87 | L79-R83 WeakPolarHBondContact O-CG 3.31Å; L79-R83 PolarHBondContact O-N 3.4Å; R83-S87 PolarHBondContact O-N 3.45Å |
| 84 | K | 51.2 | Low | 47.4 | Very low | 169 Ų | 169 | 123.7 Ų | 123.7 | 74% | 0.735 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -67.1 | -41.2 | 175.7 | -117.6 | 178.6 | 179.8 | 179.3 | 0 | 111.8 | A80 A82 S87 | A80-K84 PolarHBondContact O-N 3.39Å; A82-K84 PolarHBondContact O-N 3.46Å; K84-S87 PolarHBondContact O-OG 3.26Å; K84-S87 VanDerWaalsContact O-OG 3.07Å |
| 85 | L | 49.4 | Very low | 47.5 | Very low | 82 Ų | 82 | 125.4 Ų | 125.4 | 43% | 0.429 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -73.2 | -40.4 | 177.5 | -71.3 | 163.2 | 0 | 0 | 0 | 112 | K81 A82 S87 Q88 F89 | K81-L85 PolarHBondContact O-N 2.89Å; A82-L85 PolarHBondContact O-N 3.02Å; L85-S87 PolarHBondContact O-N 3.08Å; L85-S87 VanDerWaalsContact O-N 3.09Å; L85-Q88 PolarHBondContact O-N 2.85Å; L85-F89 HydrophobicContact CD2-CE2 4.2Å; L85-F89 WeakPolarHBondContact O-CD2 3.47Å |
| 86 | G | 46.5 | Very low | 47.9 | Very low | 31 Ų | 31 | 126.5 Ų | 126.5 | 32% | 0.32 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -64.3 | -15.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 115.6 | A82 R90 | A82-G86 PolarHBondContact O-N 3.21Å; G86-R90 PolarHBondContact O-NE 2.92Å |
| 87 | S | 52.1 | Low | 48 | Very low | 82 Ų | 82 | 127.2 Ų | 127.2 | 57% | 0.573 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -88.3 | -30.5 | 177 | 73.7 | 0 | 0 | 0 | 0 | 114 | R83 K84 L85 | R83-S87 PolarHBondContact O-N 3.45Å; K84-S87 PolarHBondContact O-OG 3.26Å; K84-S87 VanDerWaalsContact O-OG 3.07Å; L85-S87 PolarHBondContact O-N 3.08Å; L85-S87 VanDerWaalsContact O-N 3.09Å |
| 88 | Q | 50.7 | Low | 47.9 | Very low | 155 Ų | 155 | 125.4 Ų | 125.4 | 72% | 0.724 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -81.3 | -25.3 | 179.2 | -89.2 | -166.4 | -6.7 | 0 | 0 | 113.8 | L85 | L85-Q88 PolarHBondContact O-N 2.85Å |
| 89 | F | 50.2 | Low | 48.4 | Very low | 89 Ų | 89 | 127.8 Ų | 127.8 | 39% | 0.39 | 64% | 0.637 | S | S | . | * | G | 310 helix | trans | -93.7 | -2 | -171.8 | -79.1 | -84.2 | 0 | 0 | 0 | 115.3 | L85 H91 | L85-F89 HydrophobicContact CD2-CE2 4.2Å; L85-F89 WeakPolarHBondContact O-CD2 3.47Å; F89-H91 VanDerWaalsContact C-N 3.27Å; F89-H91 PolarHBondContact O-N 3.3Å |
| 90 | R | 49.6 | Very low | 48.4 | Very low | 204 Ų | 204 | 133.8 Ų | 133.8 | 77% | 0.77 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -78.2 | -2.2 | -179.9 | -84.1 | -169.9 | -100.7 | -148.5 | 1 | 115 | G86 | G86-R90 PolarHBondContact O-NE 2.92Š|
| 91 | H | 47.5 | Very low | 48.3 | Very low | 189 Ų | 189 | 135.6 Ų | 135.6 | 88% | 0.875 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -114.7 | 7.2 | -177.6 | -100.7 | 48.4 | 0 | 0 | 0 | 115.4 | F89 | F89-H91 VanDerWaalsContact C-N 3.27Å; F89-H91 PolarHBondContact O-N 3.3Å |
| 92 | R | 49 | Very low | 48.1 | Very low | 217 Ų | 217 | 134.5 Ų | 134.5 | 82% | 0.819 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -123.9 | 10.1 | -175.8 | -77.7 | -169.7 | 171.5 | -164.6 | -2.2 | 116.5 | ||
| 93 | Q | 53.4 | Low | 48.1 | Very low | 133 Ų | 133 | 140.6 Ų | 140.6 | 62% | 0.621 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.3 | 17.1 | -169 | -75.3 | -174.9 | 36 | 0 | 0 | 117.2 | ||
| 94 | I | 47 | Very low | 47.6 | Very low | 168 Ų | 168 | 136.9 Ų | 136.9 | 86% | 0.862 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107 | 1 | -178.9 | -62.3 | 178.5 | 0 | 0 | 0 | 113.5 | ||
| 95 | L | 42.4 | Very low | 47.3 | Very low | 149 Ų | 149 | 134.6 Ų | 134.6 | 78% | 0.78 | 70% | 0.703 | S | S | * | * | trans | -124.9 | 56.2 | -169.1 | -148.8 | 84.4 | 0 | 0 | 0 | 114.5 | ||||
| 96 | L | 45.4 | Very low | 47.3 | Very low | 118 Ų | 118 | 134.6 Ų | 134.6 | 62% | 0.618 | 71% | 0.71 | S | S | * | * | trans | -134.8 | 5.1 | 173.8 | -107.6 | 125.8 | 0 | 0 | 0 | 115.7 | ||||
| 97 | I | 47.9 | Very low | 47.8 | Very low | 182 Ų | 182 | 139.2 Ų | 139.2 | 93% | 0.933 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -90.2 | -0.3 | 178.3 | -63.6 | 173.4 | 0 | 0 | 0 | 112.3 | ||
| 98 | A | 43.5 | Very low | 48 | Very low | 86 Ų | 86 | 142 Ų | 142 | 71% | 0.711 | 74% | 0.743 | S | S | * | * | trans | -108.2 | 7.7 | -172 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 99 | I | 52.5 | Low | 48.3 | Very low | 98 Ų | 98 | 138.5 Ų | 138.5 | 50% | 0.503 | 74% | 0.735 | S | S | . | * | S | Bend | trans | -96.3 | 10.8 | -169.1 | -50.7 | 179.1 | 0 | 0 | 0 | 114.1 | ||
| 100 | F | 48.5 | Very low | 48.8 | Very low | 200 Ų | 200 | 140 Ų | 140 | 88% | 0.877 | 75% | 0.754 | S | S | * | * | trans | -119.3 | 91.2 | 165.9 | -73 | -79.1 | 0 | 0 | 0 | 110.8 | P102 | F100-P102 WeakPolarHBondContact O-CD 3.47Š| ||
| 101 | P | 46.9 | Very low | 49.6 | Very low | 105 Ų | 105 | 136.8 Ų | 136.8 | 68% | 0.682 | 75% | 0.75 | S | S | * | * | trans | -70.2 | 119.8 | 158.6 | 27.7 | -28.6 | 0 | 0 | 0 | 108.2 | K103 | P101-K103 PolarHBondContact O-N 3.49Š| ||
| 102 | P | 40.2 | Very low | 51.1 | Low | 135 Ų | 135 | 131.3 Ų | 131.3 | 88% | 0.877 | 73% | 0.728 | S | S | * | * | trans | -77.4 | 77.4 | 165.8 | 33.5 | -29.1 | 0 | 0 | 0 | 106.5 | F100 | F100-P102 WeakPolarHBondContact O-CD 3.47Š| ||
| 103 | K | 46.1 | Very low | 52.8 | Low | 174 Ų | 174 | 127.5 Ų | 127.5 | 76% | 0.757 | 72% | 0.719 | S | S | * | * | trans | -137.4 | 103.4 | 170.9 | -140.3 | 170.1 | -173.3 | 175.8 | 0 | 109.6 | P101 T105 | P101-K103 PolarHBondContact O-N 3.49Å; K103-T105 PolarHBondContact O-N 3.33Å | ||
| 104 | A | 39 | Very low | 54.3 | Low | 109 Ų | 109 | 126.3 Ų | 126.3 | 90% | 0.901 | 72% | 0.717 | S | S | * | * | trans | -46.4 | 101.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 105 | T | 44.8 | Very low | 56.2 | Low | 120 Ų | 120 | 125.5 Ų | 125.5 | 74% | 0.736 | 70% | 0.703 | S | S | * | * | trans | -121.7 | 108.6 | 166.1 | 47.6 | 0 | 0 | 0 | 0 | 107.1 | K103 | K103-T105 PolarHBondContact O-N 3.33Š| ||
| 106 | S | 50.5 | Low | 58.5 | Low | 82 Ų | 82 | 121.6 Ų | 121.6 | 57% | 0.573 | 69% | 0.685 | S | S | * | * | trans | 33.6 | 119.5 | 158.8 | -169.5 | 0 | 0 | 0 | 0 | 118.5 | D108 | S106-D108 PolarHBondContact O-N 2.95Š| ||
| 107 | P | 56.8 | Low | 60.6 | Low | 129 Ų | 129 | 121.9 Ų | 121.9 | 84% | 0.838 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | -1.7 | 177.5 | 27.3 | -33 | 0 | 0 | 0 | 115.5 | ||
| 108 | D | 57.1 | Low | 62.7 | Low | 140 Ų | 140 | 118.9 Ų | 118.9 | 75% | 0.749 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.8 | 10.8 | -171.8 | -67.6 | -33.8 | 0 | 0 | 0 | 115.3 | S106 | S106-D108 PolarHBondContact O-N 2.95Š|
| 109 | S | 56.4 | Low | 64.9 | Low | 82 Ų | 82 | 119.6 Ų | 119.6 | 57% | 0.573 | 66% | 0.655 | S | S | * | * | S | Bend | trans | -74.8 | 123.6 | 169.5 | 75 | 0 | 0 | 0 | 0 | 109.1 | I111 | S109-I111 PolarHBondContact O-N 3.43Š|
| 110 | P | 60.7 | Low | 66.8 | Low | 120 Ų | 120 | 117.7 Ų | 117.7 | 78% | 0.779 | 65% | 0.647 | S | S | * | * | trans | -54 | 123.3 | 174 | 23 | -31.6 | 0 | 0 | 0 | 107.4 | D112 | P110-D112 PolarHBondContact O-N 3.02Š| ||
| 111 | I | 65.5 | Low | 69 | Low | 136 Ų | 136 | 110.8 Ų | 110.8 | 70% | 0.697 | 62% | 0.624 | S | S | * | * | trans | -50.1 | 112.4 | 173.9 | -67.6 | 169.8 | 0 | 0 | 0 | 105.6 | S109 E113 V116 | S109-I111 PolarHBondContact O-N 3.43Å; I111-E113 PolarHBondContact O-N 3.4Å; I111-V116 HydrophobicContact CG2-CG2 3.28Å | ||
| 112 | D | 79.5 | Confident | 71.2 | Confident | 74 Ų | 74 | 109.7 Ų | 109.7 | 40% | 0.396 | 61% | 0.61 | S | S | . | * | trans | -60.3 | 103.9 | -179.3 | -178.5 | -1.3 | 0 | 0 | 0 | 107.2 | P110 N114 R115 V116 | P110-D112 PolarHBondContact O-N 3.02Å; D112-N114 PolarHBondContact O-N 2.94Å; D112-N114 VanDerWaalsContact OD1-CB 3.27Å; D112-N114 WeakPolarHBondContact OD1-CB 3.26Å; D112-N114 PolarHBondContact OD1-N 2.86Å; D112-N114 VanDerWaalsContact OD1-N 3.1Å; D112-N114 PolarHBondContact OD1-ND2 3.45Å; D112-N114 VanDerWaalsContact OD1-ND2 3.17Å; D112-R115 HydrophobicContact CB-CB 4.14Å; D112-R115 HydrophobicContact CB-CG 3.89Å; D112-R115 WeakPolarHBondContact O-CA 3.4Å; D112-R115 WeakPolarHBondContact O-CB 3.33Å; D112-R115 PolarHBondContact O-N 2.83Å; D112-V116 PolarHBondContact O-N 2.97Å; D112-V116 VanDerWaalsContact O-N 3.15Å | ||
| 113 | E | 84.2 | Confident | 73.7 | Confident | 138 Ų | 138 | 107.6 Ų | 107.6 | 65% | 0.645 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -54.4 | -27.5 | -178.4 | -68.2 | -174.4 | 177.8 | 0 | 0 | 111.1 | I111 V116 K117 | I111-E113 PolarHBondContact O-N 3.4Å; E113-V116 PolarHBondContact O-N 3.25Å; E113-K117 WeakPolarHBondContact O-CB 3.49Å; E113-K117 VanDerWaalsContact O-CG 3.25Å; E113-K117 WeakPolarHBondContact O-CG 3.42Å; E113-K117 PolarHBondContact O-N 3.42Å; E113-K117 IonicContact OE2-NZ 3.98Å |
| 114 | N | 86.2 | Confident | 76 | Confident | 107 Ų | 107 | 104.7 Ų | 104.7 | 57% | 0.572 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -69.1 | -40.5 | 175.7 | -57 | -48.5 | 0 | 0 | 0 | 111.5 | D112 V116 K117 E118 | D112-N114 PolarHBondContact O-N 2.94Å; D112-N114 VanDerWaalsContact OD1-CB 3.27Å; D112-N114 WeakPolarHBondContact OD1-CB 3.26Å; D112-N114 PolarHBondContact OD1-N 2.86Å; D112-N114 VanDerWaalsContact OD1-N 3.1Å; D112-N114 PolarHBondContact OD1-ND2 3.45Å; D112-N114 VanDerWaalsContact OD1-ND2 3.17Å; N114-V116 VanDerWaalsContact C-N 3.34Å; N114-V116 PolarHBondContact O-N 3.48Å; N114-K117 PolarHBondContact O-N 3.37Å; N114-E118 WeakPolarHBondContact O-CB 3.36Å; N114-E118 PolarHBondContact O-N 3.38Å |
| 115 | R | 87.1 | Confident | 78.7 | Confident | 151 Ų | 151 | 104.8 Ų | 104.8 | 57% | 0.57 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -63.8 | -40 | 174.2 | -70.1 | 179.6 | 68.9 | -162.5 | -0.1 | 111.5 | D112 E118 I119 | D112-R115 HydrophobicContact CB-CB 4.14Å; D112-R115 HydrophobicContact CB-CG 3.89Å; D112-R115 WeakPolarHBondContact O-CA 3.4Å; D112-R115 WeakPolarHBondContact O-CB 3.33Å; D112-R115 PolarHBondContact O-N 2.83Å; R115-E118 PolarHBondContact O-N 2.75Å; R115-I119 WeakPolarHBondContact O-CB 3.44Å; R115-I119 WeakPolarHBondContact O-CD1 3.4Å; R115-I119 VanDerWaalsContact O-CG1 3.22Å; R115-I119 WeakPolarHBondContact O-CG1 3.38Å; R115-I119 PolarHBondContact O-N 2.95Å |
| 116 | V | 88.8 | Confident | 81 | Confident | 67 Ų | 67 | 103.8 Ų | 103.8 | 41% | 0.406 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -65.1 | -44.1 | 175.8 | 178.3 | 0 | 0 | 0 | 0 | 110.8 | I111 D112 E113 N114 E118 I119 V120 | I111-V116 HydrophobicContact CG2-CG2 3.28Å; D112-V116 PolarHBondContact O-N 2.97Å; D112-V116 VanDerWaalsContact O-N 3.15Å; E113-V116 PolarHBondContact O-N 3.25Å; N114-V116 VanDerWaalsContact C-N 3.34Å; N114-V116 PolarHBondContact O-N 3.48Å; V116-E118 VanDerWaalsContact C-N 3.33Å; V116-E118 PolarHBondContact O-N 2.88Å; V116-I119 PolarHBondContact O-N 3.49Å; V116-V120 HydrophobicContact CG1-CG2 4.38Å; V116-V120 WeakPolarHBondContact O-CB 3.49Å; V116-V120 VanDerWaalsContact O-CG2 3.26Å; V116-V120 WeakPolarHBondContact O-CG2 3.33Å; V116-V120 PolarHBondContact O-N 3.34Å |
| 117 | K | 89.9 | Confident | 83.2 | Confident | 125 Ų | 125 | 106 Ų | 106 | 54% | 0.543 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.2 | -40.5 | 175.8 | -74.7 | 168.7 | -173.8 | 164.5 | 0 | 112.3 | E113 N114 V120 S121 | E113-K117 WeakPolarHBondContact O-CB 3.49Å; E113-K117 VanDerWaalsContact O-CG 3.25Å; E113-K117 WeakPolarHBondContact O-CG 3.42Å; E113-K117 PolarHBondContact O-N 3.42Å; E113-K117 IonicContact OE2-NZ 3.98Å; N114-K117 PolarHBondContact O-N 3.37Å; K117-V120 PolarHBondContact O-N 3.19Å; K117-S121 WeakPolarHBondContact O-CB 3.38Å; K117-S121 PolarHBondContact O-N 2.86Å |
| 118 | E | 91.7 | Very high | 85 | Confident | 119 Ų | 119 | 105 Ų | 105 | 56% | 0.556 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -62.9 | -49.5 | 175.8 | -173.4 | 172.8 | -159.2 | 0 | 0 | 111.2 | N114 R115 V116 V120 S121 E122 | N114-E118 WeakPolarHBondContact O-CB 3.36Å; N114-E118 PolarHBondContact O-N 3.38Å; R115-E118 PolarHBondContact O-N 2.75Å; V116-E118 VanDerWaalsContact C-N 3.33Å; V116-E118 PolarHBondContact O-N 2.88Å; E118-V120 VanDerWaalsContact C-N 3.32Å; E118-V120 PolarHBondContact O-N 2.96Å; E118-S121 PolarHBondContact O-N 3.31Å; E118-S121 VanDerWaalsContact O-N 3.13Å; E118-E122 WeakPolarHBondContact O-CG 3.45Å; E118-E122 PolarHBondContact O-N 2.98Å |
| 119 | I | 90.7 | Very high | 86.8 | Confident | 101 Ų | 101 | 101.3 Ų | 101.3 | 52% | 0.518 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.3 | -41.9 | 176.7 | -68.2 | 164.8 | 0 | 0 | 0 | 111.4 | R115 V116 E122 M123 | R115-I119 WeakPolarHBondContact O-CB 3.44Å; R115-I119 WeakPolarHBondContact O-CD1 3.4Å; R115-I119 VanDerWaalsContact O-CG1 3.22Å; R115-I119 WeakPolarHBondContact O-CG1 3.38Å; R115-I119 PolarHBondContact O-N 2.95Å; V116-I119 PolarHBondContact O-N 3.49Å; I119-E122 PolarHBondContact O-N 3.34Å; I119-M123 VanDerWaalsContact O-CB 3.31Å; I119-M123 WeakPolarHBondContact O-CB 3.47Å; I119-M123 PolarHBondContact O-N 3.44Å |
| 120 | V | 92.9 | Very high | 88.6 | Confident | 58 Ų | 58 | 103.5 Ų | 103.5 | 35% | 0.352 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.7 | -43.5 | 177 | 170.8 | 0 | 0 | 0 | 0 | 110.7 | V116 K117 E118 M123 E124 | V116-V120 HydrophobicContact CG1-CG2 4.38Å; V116-V120 WeakPolarHBondContact O-CB 3.49Å; V116-V120 VanDerWaalsContact O-CG2 3.26Å; V116-V120 WeakPolarHBondContact O-CG2 3.33Å; V116-V120 PolarHBondContact O-N 3.34Å; K117-V120 PolarHBondContact O-N 3.19Å; E118-V120 VanDerWaalsContact C-N 3.32Å; E118-V120 PolarHBondContact O-N 2.96Å; V120-M123 PolarHBondContact O-N 3.17Å; V120-E124 WeakPolarHBondContact O-CG 3.4Å; V120-E124 PolarHBondContact O-N 3.45Å |
| 121 | S | 93.5 | Very high | 90.3 | Very high | 55 Ų | 55 | 103.2 Ų | 103.2 | 39% | 0.385 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.5 | -43.3 | 177.2 | -169 | 0 | 0 | 0 | 0 | 112.3 | K117 E118 M123 E124 Q125 | K117-S121 WeakPolarHBondContact O-CB 3.38Å; K117-S121 PolarHBondContact O-N 2.86Å; E118-S121 PolarHBondContact O-N 3.31Å; E118-S121 VanDerWaalsContact O-N 3.13Å; S121-M123 VanDerWaalsContact C-N 3.35Å; S121-E124 PolarHBondContact O-N 3.43Å; S121-Q125 WeakPolarHBondContact O-CG 3.42Å; S121-Q125 PolarHBondContact O-N 3Å |
| 122 | E | 94 | Very high | 91.7 | Very high | 81 Ų | 81 | 99.9 Ų | 99.9 | 38% | 0.379 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.8 | -40.2 | 175.2 | -71.2 | -171.8 | 164.2 | 0 | 0 | 112 | E118 I119 E124 Q125 L126 | E118-E122 WeakPolarHBondContact O-CG 3.45Å; E118-E122 PolarHBondContact O-N 2.98Å; I119-E122 PolarHBondContact O-N 3.34Å; E122-E124 VanDerWaalsContact C-N 3.34Å; E122-E124 PolarHBondContact O-N 3.43Å; E122-Q125 PolarHBondContact O-N 2.98Å; E122-L126 WeakPolarHBondContact O-CG 3.35Å; E122-L126 PolarHBondContact O-N 3.41Å |
| 123 | M | 93.3 | Very high | 92.5 | Very high | 91 Ų | 91 | 100.3 Ų | 100.3 | 45% | 0.448 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.7 | -39.2 | 176.2 | -177.2 | 169.8 | 57.1 | 0 | 0 | 111.9 | I119 V120 S121 L126 K127 | I119-M123 VanDerWaalsContact O-CB 3.31Å; I119-M123 WeakPolarHBondContact O-CB 3.47Å; I119-M123 PolarHBondContact O-N 3.44Å; V120-M123 PolarHBondContact O-N 3.17Å; S121-M123 VanDerWaalsContact C-N 3.35Å; M123-L126 PolarHBondContact O-N 2.89Å; M123-K127 WeakPolarHBondContact O-CG 3.34Å; M123-K127 PolarHBondContact O-N 3.41Å |
| 124 | E | 94.4 | Very high | 93.1 | Very high | 113 Ų | 113 | 96.9 Ų | 96.9 | 53% | 0.528 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.6 | -41.8 | 173.3 | -73.7 | 177.9 | 173.8 | 0 | 0 | 112 | V120 S121 E122 L126 K127 L128 | V120-E124 WeakPolarHBondContact O-CG 3.4Å; V120-E124 PolarHBondContact O-N 3.45Å; S121-E124 PolarHBondContact O-N 3.43Å; E122-E124 VanDerWaalsContact C-N 3.34Å; E122-E124 PolarHBondContact O-N 3.43Å; E124-L126 PolarHBondContact O-N 3.45Å; E124-K127 PolarHBondContact O-N 3.34Å; E124-L128 WeakPolarHBondContact O-CG 3.3Å; E124-L128 PolarHBondContact O-N 3.02Å |
| 125 | Q | 94 | Very high | 93.5 | Very high | 112 Ų | 112 | 96.7 Ų | 96.7 | 52% | 0.523 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.7 | -41.6 | 174.5 | -70.6 | 180 | 26.8 | 0 | 0 | 112.1 | S121 E122 L128 K129 | S121-Q125 WeakPolarHBondContact O-CG 3.42Å; S121-Q125 PolarHBondContact O-N 3Å; E122-Q125 PolarHBondContact O-N 2.98Å; Q125-L128 PolarHBondContact O-N 3.49Å; Q125-K129 WeakPolarHBondContact O-CB 3.33Å; Q125-K129 PolarHBondContact O-N 2.98Å |
| 126 | L | 94.3 | Very high | 93.9 | Very high | 99 Ų | 99 | 94.7 Ų | 94.7 | 52% | 0.518 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.6 | -38.4 | 176 | -75.6 | 172.6 | 0 | 0 | 0 | 112.1 | E122 M123 E124 K129 H130 | E122-L126 WeakPolarHBondContact O-CG 3.35Å; E122-L126 PolarHBondContact O-N 3.41Å; M123-L126 PolarHBondContact O-N 2.89Å; E124-L126 PolarHBondContact O-N 3.45Å; L126-K129 PolarHBondContact O-N 3.27Å; L126-H130 WeakPolarHBondContact O-CB 3.39Å; L126-H130 PolarHBondContact O-N 3.41Å |
| 127 | K | 96 | Very high | 94.2 | Very high | 129 Ų | 129 | 95.9 Ų | 95.9 | 56% | 0.561 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -60.8 | -47.6 | 173.5 | -77.5 | 175.5 | -179.4 | 178.6 | 0 | 111.6 | M123 E124 K129 H130 E131 | M123-K127 WeakPolarHBondContact O-CG 3.34Å; M123-K127 PolarHBondContact O-N 3.41Å; E124-K127 PolarHBondContact O-N 3.34Å; K127-K129 VanDerWaalsContact C-N 3.32Å; K127-K129 PolarHBondContact O-N 3.47Å; K127-H130 PolarHBondContact O-N 2.96Å; K127-E131 PolarHBondContact O-N 3.49Å |
| 128 | L | 94.4 | Very high | 94.5 | Very high | 107 Ų | 107 | 93.6 Ų | 93.6 | 56% | 0.56 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -61.4 | -40.6 | 176.3 | -71.9 | 171.5 | 0 | 0 | 0 | 111.9 | E124 Q125 E131 C132 | E124-L128 WeakPolarHBondContact O-CG 3.3Å; E124-L128 PolarHBondContact O-N 3.02Å; Q125-L128 PolarHBondContact O-N 3.49Å; L128-E131 PolarHBondContact O-N 3.2Å; L128-C132 PolarHBondContact O-N 3Å; L128-C132 PolarHBondContact O-SG 3.27Å |
| 129 | K | 94.8 | Very high | 94.7 | Very high | 62 Ų | 62 | 91.3 Ų | 91.3 | 27% | 0.27 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64.4 | -44.3 | 175.8 | -174 | -175.9 | 178.6 | -170 | 0 | 111.7 | Q125 L126 K127 E131 C132 M133 | Q125-K129 WeakPolarHBondContact O-CB 3.33Å; Q125-K129 PolarHBondContact O-N 2.98Å; L126-K129 PolarHBondContact O-N 3.27Å; K127-K129 VanDerWaalsContact C-N 3.32Å; K127-K129 PolarHBondContact O-N 3.47Å; K129-E131 VanDerWaalsContact C-N 3.33Å; K129-E131 PolarHBondContact O-N 2.72Å; K129-C132 PolarHBondContact O-N 2.83Å; K129-M133 HydrophobicContact CG-CE 4.46Å; K129-M133 HydrophobicContact CG-SD 4.5Å; K129-M133 WeakPolarHBondContact O-CG 3.4Å; K129-M133 PolarHBondContact O-N 2.87Å |
| 130 | H | 95.7 | Very high | 95 | Very high | 128 Ų | 128 | 90.3 Ų | 90.3 | 59% | 0.593 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -60.5 | -43.6 | 176.5 | 177.6 | -89.4 | 0 | 0 | 0 | 111.3 | L126 K127 M133 S134 | L126-H130 WeakPolarHBondContact O-CB 3.39Å; L126-H130 PolarHBondContact O-N 3.41Å; K127-H130 PolarHBondContact O-N 2.96Å; H130-M133 PolarHBondContact O-N 3.07Å; H130-S134 WeakPolarHBondContact O-CB 3.43Å; H130-S134 PolarHBondContact O-N 3.04Å |
| 131 | E | 95.9 | Very high | 95.2 | Very high | 115 Ų | 115 | 96.5 Ų | 96.5 | 54% | 0.537 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.3 | -45.5 | 175 | -171.2 | 177.4 | -174.7 | 0 | 0 | 112 | K127 L128 K129 M133 S134 I135 | K127-E131 PolarHBondContact O-N 3.49Å; L128-E131 PolarHBondContact O-N 3.2Å; K129-E131 VanDerWaalsContact C-N 3.33Å; K129-E131 PolarHBondContact O-N 2.72Å; E131-M133 PolarHBondContact O-N 2.95Å; E131-S134 WeakPolarHBondContact O-CB 3.35Å; E131-S134 PolarHBondContact O-N 3.43Å; E131-I135 HydrophobicContact CG-CD1 4.4Å; E131-I135 WeakPolarHBondContact O-CG1 3.33Å; E131-I135 PolarHBondContact O-N 3.05Å |
| 132 | C | 94.5 | Very high | 95.4 | Very high | 65 Ų | 65 | 100.6 Ų | 100.6 | 44% | 0.439 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.2 | -45.4 | 175.3 | -69.3 | 0 | 0 | 0 | 0 | 112.3 | L128 K129 S134 I135 E136 | L128-C132 PolarHBondContact O-N 3Å; L128-C132 PolarHBondContact O-SG 3.27Å; K129-C132 PolarHBondContact O-N 2.83Å; C132-S134 VanDerWaalsContact C-N 3.33Å; C132-S134 PolarHBondContact O-N 3.4Å; C132-I135 PolarHBondContact O-N 3.05Å; C132-E136 PolarHBondContact O-N 3.09Å |
| 133 | M | 96 | Very high | 95.5 | Very high | 83 Ų | 83 | 100.2 Ų | 100.2 | 41% | 0.409 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.9 | -35.4 | 177.1 | -69.9 | -173.2 | -51 | 0 | 0 | 112.1 | K129 H130 E131 E136 N137 | K129-M133 HydrophobicContact CG-CE 4.46Å; K129-M133 HydrophobicContact CG-SD 4.5Å; K129-M133 WeakPolarHBondContact O-CG 3.4Å; K129-M133 PolarHBondContact O-N 2.87Å; H130-M133 PolarHBondContact O-N 3.07Å; E131-M133 PolarHBondContact O-N 2.95Å; M133-E136 PolarHBondContact O-N 3.5Å; M133-N137 WeakPolarHBondContact O-CB 3.45Å; M133-N137 PolarHBondContact O-N 3.46Å; M133-N137 PolarHBondContact O-ND2 3.34Å |
| 134 | S | 96.3 | Very high | 95.7 | Very high | 67 Ų | 67 | 100.3 Ų | 100.3 | 47% | 0.469 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.2 | -44.2 | 175 | -177.5 | 0 | 0 | 0 | 0 | 111.3 | H130 E131 C132 N137 S138 | H130-S134 WeakPolarHBondContact O-CB 3.43Å; H130-S134 PolarHBondContact O-N 3.04Å; E131-S134 WeakPolarHBondContact O-CB 3.35Å; E131-S134 PolarHBondContact O-N 3.43Å; C132-S134 VanDerWaalsContact C-N 3.33Å; C132-S134 PolarHBondContact O-N 3.4Å; S134-N137 PolarHBondContact O-N 3.42Å; S134-S138 PolarHBondContact O-N 3.24Å |
| 135 | I | 95.4 | Very high | 95.8 | Very high | 102 Ų | 102 | 96.7 Ų | 96.7 | 52% | 0.523 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.3 | -47 | 175.5 | -65.4 | 166.3 | 0 | 0 | 0 | 110.7 | E131 C132 N137 S138 V139 | E131-I135 HydrophobicContact CG-CD1 4.4Å; E131-I135 WeakPolarHBondContact O-CG1 3.33Å; E131-I135 PolarHBondContact O-N 3.05Å; C132-I135 PolarHBondContact O-N 3.05Å; I135-N137 PolarHBondContact O-N 3.18Å; I135-S138 WeakPolarHBondContact O-CB 3.36Å; I135-S138 PolarHBondContact O-N 3.43Å; I135-V139 WeakPolarHBondContact O-CG2 3.39Å; I135-V139 PolarHBondContact O-N 3.5Å |
| 136 | E | 95.1 | Very high | 95.9 | Very high | 110 Ų | 110 | 97 Ų | 97 | 51% | 0.514 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.2 | -44.3 | 178.2 | -174.8 | 171.1 | -167.8 | 0 | 0 | 111.9 | C132 M133 S138 V139 L140 | C132-E136 PolarHBondContact O-N 3.09Å; M133-E136 PolarHBondContact O-N 3.5Å; E136-S138 VanDerWaalsContact C-N 3.32Å; E136-S138 PolarHBondContact O-N 2.9Å; E136-V139 PolarHBondContact O-N 2.89Å; E136-L140 HydrophobicContact CG-CD1 4.26Å; E136-L140 WeakPolarHBondContact O-CG 3.29Å; E136-L140 PolarHBondContact O-N 3.23Å |
| 137 | N | 96.1 | Very high | 96.1 | Very high | 91 Ų | 91 | 99 Ų | 99 | 49% | 0.487 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.1 | -39.1 | 174.8 | -83.7 | -32.5 | 0 | 0 | 0 | 112.5 | M133 S134 I135 L140 R141 | M133-N137 WeakPolarHBondContact O-CB 3.45Å; M133-N137 PolarHBondContact O-N 3.46Å; M133-N137 PolarHBondContact O-ND2 3.34Å; S134-N137 PolarHBondContact O-N 3.42Å; I135-N137 PolarHBondContact O-N 3.18Å; N137-L140 PolarHBondContact O-N 3.48Å; N137-R141 VanDerWaalsContact O-CG 3.3Å; N137-R141 WeakPolarHBondContact O-CG 3.36Å; N137-R141 PolarHBondContact O-N 3.47Å |
| 138 | S | 96.3 | Very high | 96.1 | Very high | 77 Ų | 77 | 98.1 Ų | 98.1 | 54% | 0.538 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.7 | -44.9 | 175.1 | -176.4 | 0 | 0 | 0 | 0 | 111.7 | S134 I135 E136 L140 R141 H142 | S134-S138 PolarHBondContact O-N 3.24Å; I135-S138 WeakPolarHBondContact O-CB 3.36Å; I135-S138 PolarHBondContact O-N 3.43Å; E136-S138 VanDerWaalsContact C-N 3.32Å; E136-S138 PolarHBondContact O-N 2.9Å; S138-L140 PolarHBondContact O-N 2.99Å; S138-R141 PolarHBondContact O-N 3.28Å; S138-H142 PolarHBondContact O-N 2.87Å; S138-H142 VanDerWaalsContact O-N 3.1Å |
| 139 | V | 96.1 | Very high | 96.2 | Very high | 71 Ų | 71 | 99.3 Ų | 99.3 | 43% | 0.43 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.6 | -43.8 | 176.1 | 173.5 | 0 | 0 | 0 | 0 | 111.2 | I135 E136 R141 H142 I143 | I135-V139 WeakPolarHBondContact O-CG2 3.39Å; I135-V139 PolarHBondContact O-N 3.5Å; E136-V139 PolarHBondContact O-N 2.89Å; V139-R141 PolarHBondContact O-N 3.44Å; V139-H142 PolarHBondContact O-N 2.95Å; V139-I143 HydrophobicContact CG1-CD1 3.87Å; V139-I143 HydrophobicContact CG1-CG1 4.45Å; V139-I143 WeakPolarHBondContact O-CG1 3.39Å; V139-I143 PolarHBondContact O-N 3.21Å |
| 140 | L | 96.7 | Very high | 96.3 | Very high | 81 Ų | 81 | 99.9 Ų | 99.9 | 42% | 0.424 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.1 | -41.7 | 177.8 | -73.1 | 170.5 | 0 | 0 | 0 | 112 | E136 N137 S138 H142 I143 I144 | E136-L140 HydrophobicContact CG-CD1 4.26Å; E136-L140 WeakPolarHBondContact O-CG 3.29Å; E136-L140 PolarHBondContact O-N 3.23Å; N137-L140 PolarHBondContact O-N 3.48Å; S138-L140 PolarHBondContact O-N 2.99Å; L140-H142 VanDerWaalsContact C-N 3.31Å; L140-H142 PolarHBondContact O-N 2.99Å; L140-I143 PolarHBondContact O-N 3.44Å; L140-I144 VanDerWaalsContact O-CG1 3.29Å; L140-I144 WeakPolarHBondContact O-CG1 3.4Å; L140-I144 PolarHBondContact O-N 3.1Å |
| 141 | R | 97.1 | Very high | 96.4 | Very high | 188 Ų | 188 | 98 Ų | 98 | 71% | 0.709 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.5 | -42 | 174.3 | -73.5 | 173.6 | -172.6 | -98 | 2 | 111.8 | N137 S138 V139 I144 A145 | N137-R141 VanDerWaalsContact O-CG 3.3Å; N137-R141 WeakPolarHBondContact O-CG 3.36Å; N137-R141 PolarHBondContact O-N 3.47Å; S138-R141 PolarHBondContact O-N 3.28Å; V139-R141 PolarHBondContact O-N 3.44Å; R141-I144 PolarHBondContact O-N 3Å; R141-A145 PolarHBondContact O-N 3.38Å |
| 142 | H | 96.6 | Very high | 96.4 | Very high | 140 Ų | 140 | 95.2 Ų | 95.2 | 65% | 0.648 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.5 | -39.8 | 176.7 | -171 | 56 | 0 | 0 | 0 | 112.6 | S138 V139 L140 A145 K146 | S138-H142 PolarHBondContact O-N 2.87Å; S138-H142 VanDerWaalsContact O-N 3.1Å; V139-H142 PolarHBondContact O-N 2.95Å; L140-H142 VanDerWaalsContact C-N 3.31Å; L140-H142 PolarHBondContact O-N 2.99Å; H142-A145 PolarHBondContact O-N 3.35Å; H142-K146 WeakPolarHBondContact O-CB 3.3Å; H142-K146 PolarHBondContact O-N 2.99Å |
| 143 | I | 96.2 | Very high | 96.5 | Very high | 73 Ų | 73 | 94.6 Ų | 94.6 | 37% | 0.374 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63 | -42.5 | 174.8 | -68.4 | 167.7 | 0 | 0 | 0 | 111 | V139 L140 K146 K147 | V139-I143 HydrophobicContact CG1-CD1 3.87Å; V139-I143 HydrophobicContact CG1-CG1 4.45Å; V139-I143 WeakPolarHBondContact O-CG1 3.39Å; V139-I143 PolarHBondContact O-N 3.21Å; L140-I143 PolarHBondContact O-N 3.44Å; I143-K146 PolarHBondContact O-N 3.45Å; I143-K147 HydrophobicContact CG2-CD 4.41Å; I143-K147 WeakPolarHBondContact O-CG 3.48Å; I143-K147 PolarHBondContact O-N 3.04Å |
| 144 | I | 97.5 | Very high | 96.6 | Very high | 93 Ų | 93 | 95.8 Ų | 95.8 | 48% | 0.477 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.7 | -50.2 | 177.1 | -70 | 165.8 | 0 | 0 | 0 | 110 | L140 R141 K146 K147 E148 | L140-I144 VanDerWaalsContact O-CG1 3.29Å; L140-I144 WeakPolarHBondContact O-CG1 3.4Å; L140-I144 PolarHBondContact O-N 3.1Å; R141-I144 PolarHBondContact O-N 3Å; I144-K146 VanDerWaalsContact C-N 3.32Å; I144-K146 PolarHBondContact O-N 3.23Å; I144-K147 WeakPolarHBondContact O-CA 3.4Å; I144-K147 WeakPolarHBondContact O-CB 3.45Å; I144-K147 PolarHBondContact O-N 3.02Å; I144-E148 HydrophobicContact CG2-CG 4.38Å; I144-E148 WeakPolarHBondContact O-CG 3.44Å; I144-E148 PolarHBondContact O-N 2.85Å |
| 145 | A | 97 | Very high | 96.6 | Very high | 37 Ų | 37 | 96.3 Ų | 96.3 | 31% | 0.306 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -56.3 | -45.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | R141 H142 K147 E148 E149 | R141-A145 PolarHBondContact O-N 3.38Å; H142-A145 PolarHBondContact O-N 3.35Å; A145-K147 VanDerWaalsContact C-N 3.32Å; A145-K147 PolarHBondContact O-N 3.17Å; A145-E148 PolarHBondContact O-N 3.44Å; A145-E149 WeakPolarHBondContact O-CG 3.5Å; A145-E149 PolarHBondContact O-N 2.85Å |
| 146 | K | 96.8 | Very high | 96.7 | Very high | 118 Ų | 118 | 99.4 Ų | 99.4 | 51% | 0.513 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.7 | -37.3 | 176.3 | -174 | 174 | -177.8 | 173.2 | 0 | 112.6 | H142 I143 I144 S150 | H142-K146 WeakPolarHBondContact O-CB 3.3Å; H142-K146 PolarHBondContact O-N 2.99Å; I143-K146 PolarHBondContact O-N 3.45Å; I144-K146 VanDerWaalsContact C-N 3.32Å; I144-K146 PolarHBondContact O-N 3.23Å; K146-S150 PolarHBondContact O-N 3.03Å |
| 147 | K | 97.1 | Very high | 96.8 | Very high | 141 Ų | 141 | 100.7 Ų | 100.7 | 61% | 0.613 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -67.5 | -42.2 | 175.1 | -77.3 | -175.3 | 176.7 | -172.7 | 0 | 111.4 | I143 I144 A145 S150 Q151 | I143-K147 HydrophobicContact CG2-CD 4.41Å; I143-K147 WeakPolarHBondContact O-CG 3.48Å; I143-K147 PolarHBondContact O-N 3.04Å; I144-K147 WeakPolarHBondContact O-CA 3.4Å; I144-K147 WeakPolarHBondContact O-CB 3.45Å; I144-K147 PolarHBondContact O-N 3.02Å; A145-K147 VanDerWaalsContact C-N 3.32Å; A145-K147 PolarHBondContact O-N 3.17Å; K147-S150 PolarHBondContact O-N 3.26Å; K147-S150 PolarHBondContact O-OG 3.14Å; K147-Q151 WeakPolarHBondContact O-CB 3.39Å; K147-Q151 PolarHBondContact O-N 3.21Å |
| 148 | E | 97.3 | Very high | 96.9 | Very high | 112 Ų | 112 | 99.8 Ų | 99.8 | 52% | 0.523 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 175.5 | -70.4 | 174.5 | 167.1 | 0 | 0 | 111.7 | I144 A145 S150 Q151 T152 | I144-E148 HydrophobicContact CG2-CG 4.38Å; I144-E148 WeakPolarHBondContact O-CG 3.44Å; I144-E148 PolarHBondContact O-N 2.85Å; A145-E148 PolarHBondContact O-N 3.44Å; E148-S150 PolarHBondContact O-N 2.89Å; E148-Q151 PolarHBondContact O-N 3.34Å; E148-T152 WeakPolarHBondContact O-CG2 3.38Å; E148-T152 PolarHBondContact O-N 3.02Å; E148-T152 PolarHBondContact O-OG1 2.72Å |
| 149 | E | 96.5 | Very high | 97 | Very high | 132 Ų | 132 | 102.8 Ų | 102.8 | 62% | 0.617 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -59.2 | -46.4 | 172.2 | -73.7 | 174.9 | -174.4 | 0 | 0 | 111.8 | A145 Q151 T152 A153 | A145-E149 WeakPolarHBondContact O-CG 3.5Å; A145-E149 PolarHBondContact O-N 2.85Å; E149-Q151 VanDerWaalsContact C-N 3.32Å; E149-Q151 PolarHBondContact O-N 3.33Å; E149-T152 PolarHBondContact O-N 2.89Å; E149-T152 PolarHBondContact O-OG1 3.22Å; E149-A153 WeakPolarHBondContact O-CB 3.42Å; E149-A153 PolarHBondContact O-N 3.38Å |
| 150 | S | 95.6 | Very high | 97.1 | Very high | 74 Ų | 74 | 104.1 Ų | 104.1 | 52% | 0.517 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65 | -36.2 | 177.7 | 74.4 | 0 | 0 | 0 | 0 | 112.7 | K146 K147 E148 L154 | K146-S150 PolarHBondContact O-N 3.03Å; K147-S150 PolarHBondContact O-N 3.26Å; K147-S150 PolarHBondContact O-OG 3.14Å; E148-S150 PolarHBondContact O-N 2.89Å; S150-L154 WeakPolarHBondContact O-CB 3.49Å; S150-L154 PolarHBondContact O-N 3.44Å |
| 151 | Q | 97.7 | Very high | 97.1 | Very high | 87 Ų | 87 | 104.1 Ų | 104.1 | 41% | 0.407 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66.5 | -48.7 | 176.4 | 179.5 | 179.3 | -16.6 | 0 | 0 | 110.5 | K147 E148 E149 A153 L154 E155 | K147-Q151 WeakPolarHBondContact O-CB 3.39Å; K147-Q151 PolarHBondContact O-N 3.21Å; E148-Q151 PolarHBondContact O-N 3.34Å; E149-Q151 VanDerWaalsContact C-N 3.32Å; E149-Q151 PolarHBondContact O-N 3.33Å; Q151-A153 VanDerWaalsContact C-N 3.29Å; Q151-A153 PolarHBondContact O-N 2.98Å; Q151-L154 PolarHBondContact O-N 3.39Å; Q151-L154 VanDerWaalsContact O-N 3.11Å; Q151-E155 HydrophobicContact CG-CG 4.46Å; Q151-E155 PolarHBondContact NE2-OE1 2.87Å; Q151-E155 WeakPolarHBondContact O-CG 3.41Å; Q151-E155 PolarHBondContact O-N 3.12Å |
| 152 | T | 96.7 | Very high | 97.1 | Very high | 58 Ų | 58 | 100.4 Ų | 100.4 | 36% | 0.356 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.8 | -36.2 | 178.1 | 57.4 | 0 | 0 | 0 | 0 | 112 | E148 E149 R156 | E148-T152 WeakPolarHBondContact O-CG2 3.38Å; E148-T152 PolarHBondContact O-N 3.02Å; E148-T152 PolarHBondContact O-OG1 2.72Å; E149-T152 PolarHBondContact O-N 2.89Å; E149-T152 PolarHBondContact O-OG1 3.22Å; T152-R156 WeakPolarHBondContact O-CG 3.34Å; T152-R156 PolarHBondContact O-N 3.19Å; T152-R156 VanDerWaalsContact O-N 3.13Å |
| 153 | A | 96.8 | Very high | 97.2 | Very high | 51 Ų | 51 | 100.1 Ų | 100.1 | 42% | 0.421 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.4 | -40.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | E149 Q151 K157 | E149-A153 WeakPolarHBondContact O-CB 3.42Å; E149-A153 PolarHBondContact O-N 3.38Å; Q151-A153 VanDerWaalsContact C-N 3.29Å; Q151-A153 PolarHBondContact O-N 2.98Å; A153-K157 PolarHBondContact O-N 3.39Å; A153-K157 VanDerWaalsContact O-N 3.15Å |
| 154 | L | 96.8 | Very high | 97.2 | Very high | 109 Ų | 109 | 101 Ų | 101 | 57% | 0.571 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -67.3 | -42.3 | 176.5 | -173.3 | 63.9 | 0 | 0 | 0 | 111.7 | S150 Q151 R156 K157 V158 | S150-L154 WeakPolarHBondContact O-CB 3.49Å; S150-L154 PolarHBondContact O-N 3.44Å; Q151-L154 PolarHBondContact O-N 3.39Å; Q151-L154 VanDerWaalsContact O-N 3.11Å; L154-R156 PolarHBondContact O-N 3.23Å; L154-K157 WeakPolarHBondContact O-CB 3.45Å; L154-K157 PolarHBondContact O-N 3.01Å; L154-K157 VanDerWaalsContact O-N 3.12Å; L154-V158 WeakPolarHBondContact O-CG2 3.35Å; L154-V158 PolarHBondContact O-N 3.41Å |
| 155 | E | 97.6 | Very high | 97.2 | Very high | 78 Ų | 78 | 100.1 Ų | 100.1 | 36% | 0.364 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -57.2 | -46.3 | 175.8 | -74.3 | 179.3 | -172.1 | 0 | 0 | 111.2 | K42 Q151 K157 V158 E159 | K42-E155 IonicContact NZ-OE2 2.95Å; Q151-E155 HydrophobicContact CG-CG 4.46Å; Q151-E155 PolarHBondContact NE2-OE1 2.87Å; Q151-E155 WeakPolarHBondContact O-CG 3.41Å; Q151-E155 PolarHBondContact O-N 3.12Å; E155-K157 VanDerWaalsContact C-N 3.33Å; E155-K157 PolarHBondContact O-N 2.94Å; E155-V158 PolarHBondContact O-N 3.28Å; E155-E159 PolarHBondContact O-N 3.48Å |
| 156 | R | 97.2 | Very high | 97.3 | Very high | 166 Ų | 166 | 102.8 Ų | 102.8 | 63% | 0.626 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -60.7 | -39.5 | 174.7 | -68.8 | -179.6 | -153.7 | 128 | 5.4 | 112.7 | T152 L154 E159 L160 | T152-R156 WeakPolarHBondContact O-CG 3.34Å; T152-R156 PolarHBondContact O-N 3.19Å; T152-R156 VanDerWaalsContact O-N 3.13Å; L154-R156 PolarHBondContact O-N 3.23Å; R156-E159 PolarHBondContact O-N 3.02Å; R156-L160 PolarHBondContact O-N 3.29Å |
| 157 | K | 97.8 | Very high | 97.3 | Very high | 137 Ų | 137 | 102.1 Ų | 102.1 | 60% | 0.596 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -66.9 | -40.1 | 177.9 | -172 | 176 | -178.6 | 179.6 | 0 | 111.6 | A153 L154 E155 L160 L161 | A153-K157 PolarHBondContact O-N 3.39Å; A153-K157 VanDerWaalsContact O-N 3.15Å; L154-K157 WeakPolarHBondContact O-CB 3.45Å; L154-K157 PolarHBondContact O-N 3.01Å; L154-K157 VanDerWaalsContact O-N 3.12Å; E155-K157 VanDerWaalsContact C-N 3.33Å; E155-K157 PolarHBondContact O-N 2.94Å; K157-L160 PolarHBondContact O-N 3.24Å; K157-L161 HydrophobicContact CG-CD1 4.4Å; K157-L161 WeakPolarHBondContact O-CG 3.45Å; K157-L161 PolarHBondContact O-N 2.85Å |
| 158 | V | 97.5 | Very high | 97.3 | Very high | 72 Ų | 72 | 101 Ų | 101 | 44% | 0.436 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63 | -45.5 | 175.1 | 170.8 | 0 | 0 | 0 | 0 | 110.5 | L154 E155 L160 L161 L162 | L154-V158 WeakPolarHBondContact O-CG2 3.35Å; L154-V158 PolarHBondContact O-N 3.41Å; E155-V158 PolarHBondContact O-N 3.28Å; V158-L160 PolarHBondContact O-N 3.47Å; V158-L161 PolarHBondContact O-N 3.02Å; V158-L162 HydrophobicContact CG1-CD1 4.08Å; V158-L162 HydrophobicContact CG1-CG 4.41Å; V158-L162 WeakPolarHBondContact O-CG 3.49Å; V158-L162 PolarHBondContact O-N 3.49Å |
| 159 | E | 97.9 | Very high | 97.2 | Very high | 141 Ų | 141 | 102.5 Ų | 102.5 | 66% | 0.659 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.9 | -43.8 | 177.1 | -171.9 | 175.9 | -170.7 | 0 | 0 | 112.3 | E155 R156 L161 L162 K163 | E155-E159 PolarHBondContact O-N 3.48Å; R156-E159 PolarHBondContact O-N 3.02Å; E159-L161 PolarHBondContact O-N 3.24Å; E159-L162 PolarHBondContact O-N 3.02Å; E159-K163 PolarHBondContact O-N 3Å |
| 160 | L | 97.6 | Very high | 97.2 | Very high | 98 Ų | 98 | 99 Ų | 99 | 51% | 0.513 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.2 | -45.3 | 175.1 | -177.9 | 66.5 | 0 | 0 | 0 | 112.1 | R156 K157 V158 L162 K163 Q164 | R156-L160 PolarHBondContact O-N 3.29Å; K157-L160 PolarHBondContact O-N 3.24Å; V158-L160 PolarHBondContact O-N 3.47Å; L160-L162 VanDerWaalsContact C-N 3.33Å; L160-L162 PolarHBondContact O-N 2.88Å; L160-K163 PolarHBondContact O-N 3.3Å; L160-Q164 WeakPolarHBondContact O-CG 3.45Å; L160-Q164 PolarHBondContact O-N 2.81Å |
| 161 | L | 97.3 | Very high | 97.2 | Very high | 82 Ų | 82 | 97.5 Ų | 97.5 | 43% | 0.429 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.2 | -34.4 | 178.3 | -73.6 | 172 | 0 | 0 | 0 | 112.3 | K157 V158 E159 N165 | K157-L161 HydrophobicContact CG-CD1 4.4Å; K157-L161 WeakPolarHBondContact O-CG 3.45Å; K157-L161 PolarHBondContact O-N 2.85Å; V158-L161 PolarHBondContact O-N 3.02Å; E159-L161 PolarHBondContact O-N 3.24Å; L161-N165 WeakPolarHBondContact O-CB 3.41Å; L161-N165 PolarHBondContact O-N 3.13Å; L161-N165 PolarHBondContact O-ND2 2.85Å |
| 162 | L | 97.7 | Very high | 97.1 | Very high | 110 Ų | 110 | 101.5 Ų | 101.5 | 58% | 0.576 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -65.3 | -42.9 | 173.6 | -73.1 | 173.5 | 0 | 0 | 0 | 111.1 | V158 E159 L160 N165 E166 | V158-L162 HydrophobicContact CG1-CD1 4.08Å; V158-L162 HydrophobicContact CG1-CG 4.41Å; V158-L162 WeakPolarHBondContact O-CG 3.49Å; V158-L162 PolarHBondContact O-N 3.49Å; E159-L162 PolarHBondContact O-N 3.02Å; L160-L162 VanDerWaalsContact C-N 3.33Å; L160-L162 PolarHBondContact O-N 2.88Å; L162-N165 PolarHBondContact O-N 3.28Å; L162-E166 PolarHBondContact O-N 2.85Å |
| 163 | K | 98 | Very high | 96.9 | Very high | 134 Ų | 134 | 102 Ų | 102 | 58% | 0.583 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.2 | -47.6 | 174.8 | -174.2 | -179.4 | 176.6 | -177.1 | 0 | 111.9 | E159 L160 N165 E166 E167 | E159-K163 PolarHBondContact O-N 3Å; L160-K163 PolarHBondContact O-N 3.3Å; K163-N165 VanDerWaalsContact C-N 3.34Å; K163-N165 PolarHBondContact O-N 3.26Å; K163-E166 PolarHBondContact O-N 3.11Å; K163-E166 VanDerWaalsContact O-N 3.15Å; K163-E167 WeakPolarHBondContact CE-OE1 3.41Å; K163-E167 WeakPolarHBondContact O-CG 3.45Å; K163-E167 PolarHBondContact O-N 3.44Å |
| 164 | Q | 97.6 | Very high | 96.7 | Very high | 90 Ų | 90 | 107.5 Ų | 107.5 | 42% | 0.421 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.5 | -40.2 | 176.6 | -73 | 178.5 | -19.9 | 0 | 0 | 112.4 | L160 E166 E167 L168 | L160-Q164 WeakPolarHBondContact O-CG 3.45Å; L160-Q164 PolarHBondContact O-N 2.81Å; Q164-E166 VanDerWaalsContact C-N 3.3Å; Q164-E166 PolarHBondContact O-N 3Å; Q164-E167 PolarHBondContact O-N 2.94Å; Q164-L168 WeakPolarHBondContact O-CG 3.45Å; Q164-L168 PolarHBondContact O-N 3.44Å |
| 165 | N | 97.2 | Very high | 96.5 | Very high | 75 Ų | 75 | 106 Ų | 106 | 40% | 0.401 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.3 | -37.9 | 174.9 | -88.9 | -52.7 | 0 | 0 | 0 | 112.2 | L161 L162 K163 L168 R169 | L161-N165 WeakPolarHBondContact O-CB 3.41Å; L161-N165 PolarHBondContact O-N 3.13Å; L161-N165 PolarHBondContact O-ND2 2.85Å; L162-N165 PolarHBondContact O-N 3.28Å; K163-N165 VanDerWaalsContact C-N 3.34Å; K163-N165 PolarHBondContact O-N 3.26Å; N165-L168 PolarHBondContact O-N 3.39Å; N165-R169 WeakPolarHBondContact O-CG 3.36Å; N165-R169 PolarHBondContact O-N 2.97Å |
| 166 | E | 97.8 | Very high | 96.3 | Very high | 94 Ų | 94 | 108.2 Ų | 108.2 | 44% | 0.439 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -69.9 | -40.1 | 177 | -165.3 | 53.5 | -144.6 | 0 | 0 | 112.2 | L162 K163 Q164 L168 R169 T170 | L162-E166 PolarHBondContact O-N 2.85Å; K163-E166 PolarHBondContact O-N 3.11Å; K163-E166 VanDerWaalsContact O-N 3.15Å; Q164-E166 VanDerWaalsContact C-N 3.3Å; Q164-E166 PolarHBondContact O-N 3Å; E166-L168 VanDerWaalsContact C-N 3.31Å; E166-L168 PolarHBondContact O-N 3.37Å; E166-R169 PolarHBondContact O-N 2.99Å; E166-R169 IonicContact OE2-CZ 3.98Å; E166-R169 IonicContact OE2-NH1 3.58Å; E166-R169 PolarHBondContact OE2-NH1 2.9Å; E166-T170 WeakPolarHBondContact O-CG2 3.34Å; E166-T170 PolarHBondContact O-N 3.11Å; E166-T170 PolarHBondContact O-OG1 3.41Å |
| 167 | E | 97 | Very high | 96.1 | Very high | 104 Ų | 104 | 106.6 Ų | 106.6 | 49% | 0.486 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -58.5 | -42.1 | 170.8 | -70.8 | 171.3 | -171.6 | 0 | 0 | 111.6 | K163 Q164 T170 A171 | K163-E167 WeakPolarHBondContact CE-OE1 3.41Å; K163-E167 WeakPolarHBondContact O-CG 3.45Å; K163-E167 PolarHBondContact O-N 3.44Å; Q164-E167 PolarHBondContact O-N 2.94Å; E167-T170 WeakPolarHBondContact CA-OG1 3.4Å; E167-T170 PolarHBondContact O-N 2.93Å; E167-T170 PolarHBondContact O-OG1 3.38Å; E167-A171 VanDerWaalsContact O-CB 3.3Å; E167-A171 WeakPolarHBondContact O-CB 3.45Å; E167-A171 PolarHBondContact O-N 3.44Å |
| 168 | L | 96.7 | Very high | 95.7 | Very high | 117 Ų | 117 | 103.7 Ų | 103.7 | 61% | 0.613 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -66.6 | -37.7 | 175.1 | -72.7 | 173.2 | 0 | 0 | 0 | 112.8 | Q164 N165 E166 R172 | Q164-L168 WeakPolarHBondContact O-CG 3.45Å; Q164-L168 PolarHBondContact O-N 3.44Å; N165-L168 PolarHBondContact O-N 3.39Å; E166-L168 VanDerWaalsContact C-N 3.31Å; E166-L168 PolarHBondContact O-N 3.37Å; L168-R172 WeakPolarHBondContact O-CB 3.44Å; L168-R172 PolarHBondContact O-N 3.39Å |
| 169 | R | 96.1 | Very high | 95.3 | Very high | 143 Ų | 143 | 109.4 Ų | 109.4 | 54% | 0.54 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.8 | -45.6 | 175.5 | -76 | -179 | -168.5 | 130.3 | 1.1 | 111.7 | N165 E166 R172 C173 | N165-R169 WeakPolarHBondContact O-CG 3.36Å; N165-R169 PolarHBondContact O-N 2.97Å; E166-R169 PolarHBondContact O-N 2.99Å; E166-R169 IonicContact OE2-CZ 3.98Å; E166-R169 IonicContact OE2-NH1 3.58Å; E166-R169 PolarHBondContact OE2-NH1 2.9Å; R169-R172 PolarHBondContact O-N 3.06Å; R169-C173 PolarHBondContact O-N 2.94Å; R169-C173 PolarHBondContact O-SG 3.35Å |
| 170 | T | 96.6 | Very high | 95 | Very high | 58 Ų | 58 | 109.3 Ų | 109.3 | 36% | 0.356 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.5 | -42.7 | 177.2 | 57.4 | 0 | 0 | 0 | 0 | 111.2 | E166 E167 R172 C173 R174 | E166-T170 WeakPolarHBondContact O-CG2 3.34Å; E166-T170 PolarHBondContact O-N 3.11Å; E166-T170 PolarHBondContact O-OG1 3.41Å; E167-T170 WeakPolarHBondContact CA-OG1 3.4Å; E167-T170 PolarHBondContact O-N 2.93Å; E167-T170 PolarHBondContact O-OG1 3.38Å; T170-R172 PolarHBondContact O-N 2.72Å; T170-C173 PolarHBondContact O-N 2.82Å; T170-R174 WeakPolarHBondContact O-CG 3.39Å; T170-R174 PolarHBondContact O-N 3.28Å |
| 171 | A | 95.4 | Very high | 94.7 | Very high | 44 Ų | 44 | 107.4 Ų | 107.4 | 36% | 0.364 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.5 | -42.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | E167 C173 R174 C175 | E167-A171 VanDerWaalsContact O-CB 3.3Å; E167-A171 WeakPolarHBondContact O-CB 3.45Å; E167-A171 PolarHBondContact O-N 3.44Å; A171-C173 VanDerWaalsContact C-N 3.34Å; A171-C173 PolarHBondContact O-N 2.96Å; A171-R174 PolarHBondContact O-N 2.91Å; A171-C175 WeakPolarHBondContact O-CB 3.42Å; A171-C175 PolarHBondContact O-N 3.48Å; A171-C175 PolarHBondContact O-SG 3.24Å; A171-C175 VanDerWaalsContact O-SG 3.41Å |
| 172 | R | 95.2 | Very high | 94.4 | Very high | 171 Ų | 171 | 110.8 Ų | 110.8 | 65% | 0.645 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.9 | -40.4 | 175.7 | -175.1 | -178.2 | -176.6 | -170.1 | 2 | 112 | L168 R169 T170 C175 K176 | L168-R172 WeakPolarHBondContact O-CB 3.44Å; L168-R172 PolarHBondContact O-N 3.39Å; R169-R172 PolarHBondContact O-N 3.06Å; T170-R172 PolarHBondContact O-N 2.72Å; R172-C175 PolarHBondContact O-N 2.99Å; R172-K176 WeakPolarHBondContact O-CG 3.4Å; R172-K176 PolarHBondContact O-N 3.04Å |
| 173 | C | 93.4 | Very high | 94 | Very high | 67 Ų | 67 | 109.1 Ų | 109.1 | 45% | 0.453 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.2 | -48.8 | 176.5 | -65.3 | 0 | 0 | 0 | 0 | 110.9 | R169 T170 A171 C175 K176 E177 | R169-C173 PolarHBondContact O-N 2.94Å; R169-C173 PolarHBondContact O-SG 3.35Å; T170-C173 PolarHBondContact O-N 2.82Å; A171-C173 VanDerWaalsContact C-N 3.34Å; A171-C173 PolarHBondContact O-N 2.96Å; C173-C175 VanDerWaalsContact C-N 3.31Å; C173-C175 PolarHBondContact O-N 3.28Å; C173-K176 WeakPolarHBondContact O-CB 3.39Å; C173-K176 PolarHBondContact O-N 3Å; C173-E177 WeakPolarHBondContact O-CG 3.35Å; C173-E177 PolarHBondContact O-N 3.04Å |
| 174 | R | 92.6 | Very high | 93.6 | Very high | 168 Ų | 168 | 105.9 Ų | 105.9 | 63% | 0.634 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -56.6 | -43.2 | 174.3 | -67.6 | 177.1 | -173.2 | 170.1 | 3.4 | 112.2 | T170 A171 K176 E177 C178 | T170-R174 WeakPolarHBondContact O-CG 3.39Å; T170-R174 PolarHBondContact O-N 3.28Å; A171-R174 PolarHBondContact O-N 2.91Å; R174-K176 VanDerWaalsContact C-N 3.34Å; R174-K176 PolarHBondContact O-N 3.44Å; R174-E177 PolarHBondContact O-N 3.45Å; R174-C178 WeakPolarHBondContact O-CB 3.49Å; R174-C178 PolarHBondContact O-N 3.15Å; R174-C178 PolarHBondContact O-SG 3.2Å |
| 175 | C | 92.1 | Very high | 93.1 | Very high | 77 Ų | 77 | 103.8 Ų | 103.8 | 52% | 0.52 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.7 | -37.5 | 176.3 | -77.4 | 0 | 0 | 0 | 0 | 113.1 | A171 R172 C173 R179 | A171-C175 WeakPolarHBondContact O-CB 3.42Å; A171-C175 PolarHBondContact O-N 3.48Å; A171-C175 PolarHBondContact O-SG 3.24Å; A171-C175 VanDerWaalsContact O-SG 3.41Å; R172-C175 PolarHBondContact O-N 2.99Å; C173-C175 VanDerWaalsContact C-N 3.31Å; C173-C175 PolarHBondContact O-N 3.28Å; C175-R179 WeakPolarHBondContact O-CG 3.44Å; C175-R179 PolarHBondContact O-N 3.48Å |
| 176 | K | 93.2 | Very high | 92.5 | Very high | 125 Ų | 125 | 105.4 Ų | 105.4 | 54% | 0.543 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.6 | -43.2 | 174.6 | -74.6 | 179.6 | 177.8 | -176.3 | 0 | 111.4 | R172 C173 R174 R179 K180 | R172-K176 WeakPolarHBondContact O-CG 3.4Å; R172-K176 PolarHBondContact O-N 3.04Å; C173-K176 WeakPolarHBondContact O-CB 3.39Å; C173-K176 PolarHBondContact O-N 3Å; R174-K176 VanDerWaalsContact C-N 3.34Å; R174-K176 PolarHBondContact O-N 3.44Å; K176-R179 PolarHBondContact O-N 3.44Å; K176-K180 PolarHBondContact O-N 2.91Å |
| 177 | E | 92.5 | Very high | 91.9 | Very high | 132 Ų | 132 | 105.2 Ų | 105.2 | 62% | 0.617 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.2 | -45.8 | 175.9 | -70 | 168.7 | 179.5 | 0 | 0 | 111.4 | C173 R174 R179 K180 A181 | C173-E177 WeakPolarHBondContact O-CG 3.35Å; C173-E177 PolarHBondContact O-N 3.04Å; R174-E177 PolarHBondContact O-N 3.45Å; E177-R179 VanDerWaalsContact C-N 3.31Å; E177-R179 PolarHBondContact O-N 3.03Å; E177-K180 PolarHBondContact O-N 2.84Å; E177-A181 WeakPolarHBondContact O-CB 3.35Å; E177-A181 PolarHBondContact O-N 3.12Å |
| 178 | C | 90.5 | Very high | 91.4 | Very high | 76 Ų | 76 | 109.5 Ų | 109.5 | 51% | 0.514 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -60.2 | -38.4 | 174.4 | -71.7 | 0 | 0 | 0 | 0 | 112.5 | R174 K182 | R174-C178 WeakPolarHBondContact O-CB 3.49Å; R174-C178 PolarHBondContact O-N 3.15Å; R174-C178 PolarHBondContact O-SG 3.2Å; C178-K182 WeakPolarHBondContact O-CB 3.47Å; C178-K182 WeakPolarHBondContact O-CG 3.47Å; C178-K182 PolarHBondContact O-N 3.4Å |
| 179 | R | 89.2 | Confident | 90.7 | Very high | 191 Ų | 191 | 110.7 Ų | 110.7 | 72% | 0.721 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.2 | -44.9 | 174.4 | -80.7 | -175.4 | -167.9 | 178.8 | 3.2 | 111.6 | C175 K176 E177 K182 T183 | C175-R179 WeakPolarHBondContact O-CG 3.44Å; C175-R179 PolarHBondContact O-N 3.48Å; K176-R179 PolarHBondContact O-N 3.44Å; E177-R179 VanDerWaalsContact C-N 3.31Å; E177-R179 PolarHBondContact O-N 3.03Å; R179-K182 PolarHBondContact O-N 3.16Å; R179-T183 PolarHBondContact O-N 2.99Å; R179-T183 PolarHBondContact O-OG1 2.97Å |
| 180 | K | 92.4 | Very high | 90 | Very high | 139 Ų | 139 | 106.8 Ų | 106.8 | 60% | 0.604 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62 | -45.2 | 177.2 | -170.9 | -178 | 176.4 | -174.7 | 0 | 111.4 | K176 E177 K182 T183 D184 | K176-K180 PolarHBondContact O-N 2.91Å; E177-K180 PolarHBondContact O-N 2.84Å; K180-K182 VanDerWaalsContact C-N 3.28Å; K180-K182 PolarHBondContact O-N 2.97Å; K180-T183 WeakPolarHBondContact CA-OG1 3.43Å; K180-T183 PolarHBondContact O-N 3.43Å; K180-T183 PolarHBondContact O-OG1 3.27Å; K180-D184 WeakPolarHBondContact O-CB 3.49Å; K180-D184 PolarHBondContact O-N 3.45Å |
| 181 | A | 90.8 | Very high | 89.3 | Confident | 59 Ų | 59 | 105.5 Ų | 105.5 | 49% | 0.488 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.9 | -38.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | E177 S185 | E177-A181 WeakPolarHBondContact O-CB 3.35Å; E177-A181 PolarHBondContact O-N 3.12Å; A181-S185 VanDerWaalsContact O-CB 3.26Å; A181-S185 WeakPolarHBondContact O-CB 3.42Å; A181-S185 PolarHBondContact O-N 2.93Å; A181-S185 PolarHBondContact O-OG 2.78Å |
| 182 | K | 90.4 | Very high | 88.7 | Confident | 153 Ų | 153 | 109.9 Ų | 109.9 | 67% | 0.665 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.8 | -45.4 | 174.6 | -76.9 | 179.7 | 179.9 | -172.3 | 0 | 112.4 | C178 R179 K180 S185 F186 | C178-K182 WeakPolarHBondContact O-CB 3.47Å; C178-K182 WeakPolarHBondContact O-CG 3.47Å; C178-K182 PolarHBondContact O-N 3.4Å; R179-K182 PolarHBondContact O-N 3.16Å; K180-K182 VanDerWaalsContact C-N 3.28Å; K180-K182 PolarHBondContact O-N 2.97Å; K182-S185 PolarHBondContact O-N 2.71Å; K182-S185 PolarHBondContact O-OG 3.16Å; K182-F186 WeakPolarHBondContact O-CB 3.4Å; K182-F186 PolarHBondContact O-N 2.88Å |
| 183 | T | 90.1 | Very high | 88.1 | Confident | 74 Ų | 74 | 104.9 Ų | 104.9 | 45% | 0.454 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.6 | -46 | 176.6 | 51.7 | 0 | 0 | 0 | 0 | 111 | R179 K180 S185 F186 D187 | R179-T183 PolarHBondContact O-N 2.99Å; R179-T183 PolarHBondContact O-OG1 2.97Å; K180-T183 WeakPolarHBondContact CA-OG1 3.43Å; K180-T183 PolarHBondContact O-N 3.43Å; K180-T183 PolarHBondContact O-OG1 3.27Å; T183-S185 VanDerWaalsContact C-N 3.27Å; T183-S185 PolarHBondContact O-N 3.47Å; T183-F186 WeakPolarHBondContact O-CA 3.38Å; T183-F186 WeakPolarHBondContact O-CB 3.26Å; T183-F186 PolarHBondContact O-N 2.87Å; T183-D187 VanDerWaalsContact O-CG 3.27Å; T183-D187 PolarHBondContact O-N 3.02Å |
| 184 | D | 89.3 | Confident | 87.3 | Confident | 67 Ų | 67 | 106.5 Ų | 106.5 | 36% | 0.358 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62 | -36.5 | 177.8 | -62.6 | -5.2 | 0 | 0 | 0 | 111.2 | K180 R188 | K180-D184 WeakPolarHBondContact O-CB 3.49Å; K180-D184 PolarHBondContact O-N 3.45Å; D184-R188 WeakPolarHBondContact O-CB 3.37Å; D184-R188 VanDerWaalsContact O-CG 3.26Å; D184-R188 WeakPolarHBondContact O-CG 3.37Å; D184-R188 PolarHBondContact O-N 3.47Å |
| 185 | S | 86.6 | Confident | 86.5 | Confident | 46 Ų | 46 | 103.6 Ų | 103.6 | 32% | 0.322 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -69 | -33.2 | 174.6 | 81.4 | 0 | 0 | 0 | 0 | 113.2 | A181 K182 T183 R189 | A181-S185 VanDerWaalsContact O-CB 3.26Å; A181-S185 WeakPolarHBondContact O-CB 3.42Å; A181-S185 PolarHBondContact O-N 2.93Å; A181-S185 PolarHBondContact O-OG 2.78Å; K182-S185 PolarHBondContact O-N 2.71Å; K182-S185 PolarHBondContact O-OG 3.16Å; T183-S185 VanDerWaalsContact C-N 3.27Å; T183-S185 PolarHBondContact O-N 3.47Å; S185-R189 PolarHBondContact O-N 3.2Å |
| 186 | F | 85 | Confident | 85.9 | Confident | 108 Ų | 108 | 105.6 Ų | 105.6 | 47% | 0.474 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -73 | -48.1 | 177.5 | -178.1 | -91.7 | 0 | 0 | 0 | 109.9 | K182 T183 R188 R189 E190 | K182-F186 WeakPolarHBondContact O-CB 3.4Å; K182-F186 PolarHBondContact O-N 2.88Å; T183-F186 WeakPolarHBondContact O-CA 3.38Å; T183-F186 WeakPolarHBondContact O-CB 3.26Å; T183-F186 PolarHBondContact O-N 2.87Å; F186-R188 VanDerWaalsContact C-N 3.31Å; F186-R188 PolarHBondContact O-N 3.19Å; F186-R189 CarbonylContact O-C 3.59Å; F186-R189 PolarHBondContact O-N 3.16Å; F186-E190 WeakPolarHBondContact CE1-OE2 3.38Å; F186-E190 WeakPolarHBondContact O-CB 3.35Å; F186-E190 PolarHBondContact O-N 2.95Å |
| 187 | D | 85.1 | Confident | 85 | Confident | 91 Ų | 91 | 103.5 Ų | 103.5 | 49% | 0.487 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.8 | -38.4 | 177.6 | -63 | -18.1 | 0 | 0 | 0 | 111.5 | T183 G191 | T183-D187 VanDerWaalsContact O-CG 3.27Å; T183-D187 PolarHBondContact O-N 3.02Å; D187-G191 PolarHBondContact O-N 2.93Å |
| 188 | R | 85.5 | Confident | 84.2 | Confident | 194 Ų | 194 | 101.8 Ų | 101.8 | 73% | 0.732 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.5 | -39.6 | 172 | -79.2 | 179.8 | -172.9 | -166.3 | 3.1 | 112.8 | D184 F186 K192 | D184-R188 WeakPolarHBondContact O-CB 3.37Å; D184-R188 VanDerWaalsContact O-CG 3.26Å; D184-R188 WeakPolarHBondContact O-CG 3.37Å; D184-R188 PolarHBondContact O-N 3.47Å; F186-R188 VanDerWaalsContact C-N 3.31Å; F186-R188 PolarHBondContact O-N 3.19Å; R188-K192 WeakPolarHBondContact O-CG 3.37Å; R188-K192 PolarHBondContact O-N 3.41Å |
| 189 | R | 83 | Confident | 83.3 | Confident | 141 Ų | 141 | 103.6 Ų | 103.6 | 53% | 0.532 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.6 | -44.6 | 176.9 | -84.8 | -172.3 | -80.2 | -179.6 | -6.5 | 111.2 | S185 F186 G191 K192 V193 | S185-R189 PolarHBondContact O-N 3.2Å; F186-R189 CarbonylContact O-C 3.59Å; F186-R189 PolarHBondContact O-N 3.16Å; R189-G191 VanDerWaalsContact C-N 3.33Å; R189-G191 PolarHBondContact O-N 3.39Å; R189-K192 PolarHBondContact O-N 3.43Å; R189-V193 WeakPolarHBondContact O-CG2 3.49Å; R189-V193 PolarHBondContact O-N 2.94Å |
| 190 | E | 80.9 | Confident | 82.4 | Confident | 62 Ų | 62 | 99.6 Ų | 99.6 | 29% | 0.29 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.5 | -46.4 | 175.4 | -174.8 | 170.7 | -167.8 | 0 | 0 | 110.3 | F186 K192 V193 F194 | F186-E190 WeakPolarHBondContact CE1-OE2 3.38Å; F186-E190 WeakPolarHBondContact O-CB 3.35Å; F186-E190 PolarHBondContact O-N 2.95Å; E190-K192 PolarHBondContact O-N 3.43Å; E190-V193 PolarHBondContact O-N 3.15Å; E190-F194 HydrophobicContact CG-CD2 3.66Å; E190-F194 HydrophobicContact CG-CE2 3.47Å; E190-F194 VanDerWaalsContact CG-CE2 3.47Å; E190-F194 WeakPolarHBondContact O-CB 3.49Å; E190-F194 WeakPolarHBondContact O-CD2 3.44Å; E190-F194 PolarHBondContact O-N 2.95Å |
| 191 | G | 82.1 | Confident | 81.2 | Confident | 31 Ų | 31 | 96.5 Ų | 96.5 | 32% | 0.32 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.3 | -39.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 114 | D187 R189 N195 | D187-G191 PolarHBondContact O-N 2.93Å; R189-G191 VanDerWaalsContact C-N 3.33Å; R189-G191 PolarHBondContact O-N 3.39Å; G191-N195 WeakPolarHBondContact O-CB 3.47Å; G191-N195 PolarHBondContact O-N 2.86Å; G191-N195 PolarHBondContact O-ND2 2.95Å |
| 192 | K | 83.7 | Confident | 80 | Confident | 136 Ų | 136 | 98.6 Ų | 98.6 | 59% | 0.591 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.6 | -47.9 | 174 | -78.1 | -178.3 | 178.7 | -167.3 | 0 | 112.1 | R188 R189 E190 F194 N195 E196 | R188-K192 WeakPolarHBondContact O-CG 3.37Å; R188-K192 PolarHBondContact O-N 3.41Å; R189-K192 PolarHBondContact O-N 3.43Å; E190-K192 PolarHBondContact O-N 3.43Å; K192-F194 VanDerWaalsContact C-N 3.32Å; K192-F194 PolarHBondContact O-N 3.36Å; K192-N195 PolarHBondContact O-N 2.98Å; K192-N195 VanDerWaalsContact O-N 3.15Å; K192-E196 WeakPolarHBondContact O-CG 3.41Å; K192-E196 PolarHBondContact O-N 2.93Å |
| 193 | V | 81.4 | Confident | 78.8 | Confident | 66 Ų | 66 | 94.8 Ų | 94.8 | 40% | 0.4 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -62.6 | -40.1 | 178.8 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | R189 E190 E196 L197 | R189-V193 WeakPolarHBondContact O-CG2 3.49Å; R189-V193 PolarHBondContact O-N 2.94Å; E190-V193 PolarHBondContact O-N 3.15Å; V193-E196 PolarHBondContact O-N 2.95Å; V193-L197 HydrophobicContact CG1-CD1 3.87Å; V193-L197 HydrophobicContact CG1-CG 4.4Å; V193-L197 WeakPolarHBondContact O-CB 3.32Å; V193-L197 VanDerWaalsContact O-CG 3.32Å; V193-L197 WeakPolarHBondContact O-CG 3.37Å; V193-L197 PolarHBondContact O-N 3.29Å |
| 194 | F | 76.5 | Confident | 77.4 | Confident | 101 Ų | 101 | 96.2 Ų | 96.2 | 44% | 0.443 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.7 | -40.7 | 173.8 | -86.6 | -64.2 | 0 | 0 | 0 | 112.5 | E190 K192 N198 | E190-F194 HydrophobicContact CG-CD2 3.66Å; E190-F194 HydrophobicContact CG-CE2 3.47Å; E190-F194 VanDerWaalsContact CG-CE2 3.47Å; E190-F194 WeakPolarHBondContact O-CB 3.49Å; E190-F194 WeakPolarHBondContact O-CD2 3.44Å; E190-F194 PolarHBondContact O-N 2.95Å; K192-F194 VanDerWaalsContact C-N 3.32Å; K192-F194 PolarHBondContact O-N 3.36Å; F194-N198 WeakPolarHBondContact O-CB 3.45Å; F194-N198 PolarHBondContact O-N 3.02Å |
| 195 | N | 76.8 | Confident | 76.2 | Confident | 107 Ų | 107 | 96.1 Ų | 96.1 | 57% | 0.572 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -68 | -42.3 | 177.3 | -71.7 | -15.2 | 0 | 0 | 0 | 112.1 | G191 K192 N198 I199 | G191-N195 WeakPolarHBondContact O-CB 3.47Å; G191-N195 PolarHBondContact O-N 2.86Å; G191-N195 PolarHBondContact O-ND2 2.95Å; K192-N195 PolarHBondContact O-N 2.98Å; K192-N195 VanDerWaalsContact O-N 3.15Å; N195-N198 PolarHBondContact O-N 2.98Å; N195-I199 VanDerWaalsContact O-CG1 3.28Å; N195-I199 WeakPolarHBondContact O-CG1 3.36Å; N195-I199 PolarHBondContact O-N 3.07Å |
| 196 | E | 79.4 | Confident | 75.1 | Confident | 118 Ų | 118 | 100 Ų | 100 | 55% | 0.551 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.2 | -48.8 | 176.3 | -73.7 | 168.4 | -168.5 | 0 | 0 | 111 | K192 V193 N198 I199 D200 | K192-E196 WeakPolarHBondContact O-CG 3.41Å; K192-E196 PolarHBondContact O-N 2.93Å; V193-E196 PolarHBondContact O-N 2.95Å; E196-N198 VanDerWaalsContact C-N 3.29Å; E196-N198 PolarHBondContact O-N 3.49Å; E196-I199 PolarHBondContact O-N 3.4Å; E196-D200 PolarHBondContact O-N 2.98Å |
| 197 | L | 73.8 | Confident | 74 | Confident | 81 Ų | 81 | 100.6 Ų | 100.6 | 42% | 0.424 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.2 | -35.3 | 175.2 | -73.6 | 170.5 | 0 | 0 | 0 | 112.5 | V193 D200 V201 | V193-L197 HydrophobicContact CG1-CD1 3.87Å; V193-L197 HydrophobicContact CG1-CG 4.4Å; V193-L197 WeakPolarHBondContact O-CB 3.32Å; V193-L197 VanDerWaalsContact O-CG 3.32Å; V193-L197 WeakPolarHBondContact O-CG 3.37Å; V193-L197 PolarHBondContact O-N 3.29Å; L197-D200 PolarHBondContact O-N 2.96Å; L197-V201 VanDerWaalsContact O-CB 3.27Å; L197-V201 WeakPolarHBondContact O-CB 3.22Å; L197-V201 WeakPolarHBondContact O-CG2 3.46Å; L197-V201 PolarHBondContact O-N 3.12Å |
| 198 | N | 74.8 | Confident | 72.9 | Confident | 97 Ų | 97 | 99.8 Ų | 99.8 | 52% | 0.519 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -70.1 | -34.9 | 178.5 | -164.6 | 66.8 | 0 | 0 | 0 | 112.1 | F194 N195 E196 Q202 | F194-N198 WeakPolarHBondContact O-CB 3.45Å; F194-N198 PolarHBondContact O-N 3.02Å; N195-N198 PolarHBondContact O-N 2.98Å; E196-N198 VanDerWaalsContact C-N 3.29Å; E196-N198 PolarHBondContact O-N 3.49Å; N198-Q202 WeakPolarHBondContact O-CB 3.3Å; N198-Q202 PolarHBondContact O-N 3.49Å; N198-Q202 VanDerWaalsContact O-N 3.12Å |
| 199 | I | 72.9 | Confident | 71.6 | Confident | 113 Ų | 113 | 95.3 Ų | 95.3 | 58% | 0.579 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -69.6 | -39.4 | 174.8 | -67.7 | 164 | 0 | 0 | 0 | 111 | N195 E196 P203 | N195-I199 VanDerWaalsContact O-CG1 3.28Å; N195-I199 WeakPolarHBondContact O-CG1 3.36Å; N195-I199 PolarHBondContact O-N 3.07Å; E196-I199 PolarHBondContact O-N 3.4Å; I199-P203 WeakPolarHBondContact O-CD 3.46Å; I199-P203 WeakPolarHBondContact O-CG 3.43Å |
| 200 | D | 69.7 | Low | 70.6 | Confident | 108 Ų | 108 | 91 Ų | 91 | 58% | 0.578 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -75.8 | -31.6 | -179.2 | -71.2 | -18.3 | 0 | 0 | 0 | 112.8 | E196 L197 | E196-D200 PolarHBondContact O-N 2.98Å; L197-D200 PolarHBondContact O-N 2.96Å |
| 201 | V | 67.1 | Low | 69.5 | Low | 73 Ų | 73 | 93.6 Ų | 93.6 | 44% | 0.442 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -83 | -33.3 | -179 | 174.3 | 0 | 0 | 0 | 0 | 112.1 | L197 Q204 V205 | L197-V201 VanDerWaalsContact O-CB 3.27Å; L197-V201 WeakPolarHBondContact O-CB 3.22Å; L197-V201 WeakPolarHBondContact O-CG2 3.46Å; L197-V201 PolarHBondContact O-N 3.12Å; V201-Q204 PolarHBondContact O-N 3.02Å; V201-Q204 VanDerWaalsContact O-N 3.16Å; V201-V205 HydrophobicContact CG1-CG2 3.71Å; V201-V205 WeakPolarHBondContact O-CG2 3.46Å; V201-V205 PolarHBondContact O-N 2.81Å |
| 202 | Q | 66.2 | Low | 68.5 | Low | 104 Ų | 104 | 96 Ų | 96 | 49% | 0.486 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -55 | -49.3 | -178.6 | -107.8 | -167.8 | -45.8 | 0 | 0 | 113.9 | N198 Q204 V205 E206 | N198-Q202 WeakPolarHBondContact O-CB 3.3Å; N198-Q202 PolarHBondContact O-N 3.49Å; N198-Q202 VanDerWaalsContact O-N 3.12Å; Q202-Q204 VanDerWaalsContact C-N 3.3Å; Q202-Q204 PolarHBondContact O-N 3.1Å; Q202-V205 PolarHBondContact O-N 2.98Å; Q202-E206 WeakPolarHBondContact O-CG 3.43Å; Q202-E206 PolarHBondContact O-N 3.06Å |
| 203 | P | 64.9 | Low | 67.5 | Low | 72 Ų | 72 | 92.9 Ų | 92.9 | 47% | 0.468 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.7 | -36.3 | 178.4 | -22 | 31.8 | 0 | 0 | 0 | 112.5 | I199 E206 E207 | I199-P203 WeakPolarHBondContact O-CD 3.46Å; I199-P203 WeakPolarHBondContact O-CG 3.43Å; P203-E206 PolarHBondContact O-N 3.33Å; P203-E207 VanDerWaalsContact O-CB 3.31Å; P203-E207 WeakPolarHBondContact O-CB 3.38Å; P203-E207 PolarHBondContact O-N 3.21Å |
| 204 | Q | 61 | Low | 66.4 | Low | 104 Ų | 104 | 95.4 Ų | 95.4 | 49% | 0.486 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -71.2 | -34.2 | 179 | -64.5 | -169.3 | 14.8 | 0 | 0 | 112.2 | V201 Q202 T208 | V201-Q204 PolarHBondContact O-N 3.02Å; V201-Q204 VanDerWaalsContact O-N 3.16Å; Q202-Q204 VanDerWaalsContact C-N 3.3Å; Q202-Q204 PolarHBondContact O-N 3.1Å; Q204-T208 WeakPolarHBondContact O-CB 3.48Å; Q204-T208 WeakPolarHBondContact O-CG2 3.47Å; Q204-T208 PolarHBondContact O-N 3.45Å; Q204-T208 PolarHBondContact O-OG1 3.46Å |
| 205 | V | 63.4 | Low | 65.5 | Low | 66 Ų | 66 | 93 Ų | 93 | 40% | 0.4 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -69.5 | -43.4 | 173.8 | 176.2 | 0 | 0 | 0 | 0 | 110.3 | V201 Q202 E207 T208 D209 | V201-V205 HydrophobicContact CG1-CG2 3.71Å; V201-V205 WeakPolarHBondContact O-CG2 3.46Å; V201-V205 PolarHBondContact O-N 2.81Å; Q202-V205 PolarHBondContact O-N 2.98Å; V205-E207 PolarHBondContact O-N 3Å; V205-T208 WeakPolarHBondContact CA-OG1 3.26Å; V205-T208 PolarHBondContact O-N 3.24Å; V205-T208 PolarHBondContact O-OG1 3.03Å; V205-T208 VanDerWaalsContact O-OG1 3.05Å; V205-D209 WeakPolarHBondContact O-CB 3.35Å; V205-D209 PolarHBondContact O-N 3.35Å |
| 206 | E | 63.6 | Low | 64.4 | Low | 126 Ų | 126 | 94.2 Ų | 94.2 | 59% | 0.589 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65 | -37.5 | 176.8 | -71.9 | 177.1 | -174.2 | 0 | 0 | 112.5 | Q202 P203 A210 | Q202-E206 WeakPolarHBondContact O-CG 3.43Å; Q202-E206 PolarHBondContact O-N 3.06Å; P203-E206 PolarHBondContact O-N 3.33Å; E206-A210 WeakPolarHBondContact O-CB 3.48Å; E206-A210 PolarHBondContact O-N 2.92Å; E206-A210 VanDerWaalsContact O-N 3.1Å |
| 207 | E | 62.8 | Low | 63.4 | Low | 121 Ų | 121 | 92.6 Ų | 92.6 | 57% | 0.565 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -70.5 | -36.6 | 175.9 | -168.7 | 173.4 | -172 | 0 | 0 | 112.3 | P203 V205 A210 Q211 | P203-E207 VanDerWaalsContact O-CB 3.31Å; P203-E207 WeakPolarHBondContact O-CB 3.38Å; P203-E207 PolarHBondContact O-N 3.21Å; V205-E207 PolarHBondContact O-N 3Å; E207-A210 PolarHBondContact O-N 3.16Å; E207-Q211 WeakPolarHBondContact O-CG 3.26Å; E207-Q211 PolarHBondContact O-N 3.49Å |
| 208 | T | 60.9 | Low | 62.4 | Low | 74 Ų | 74 | 95.4 Ų | 95.4 | 45% | 0.454 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -72.7 | -37.3 | 175.9 | 46 | 0 | 0 | 0 | 0 | 112.6 | Q204 V205 A210 Q211 V212 | Q204-T208 WeakPolarHBondContact O-CB 3.48Å; Q204-T208 WeakPolarHBondContact O-CG2 3.47Å; Q204-T208 PolarHBondContact O-N 3.45Å; Q204-T208 PolarHBondContact O-OG1 3.46Å; V205-T208 WeakPolarHBondContact CA-OG1 3.26Å; V205-T208 PolarHBondContact O-N 3.24Å; V205-T208 PolarHBondContact O-OG1 3.03Å; V205-T208 VanDerWaalsContact O-OG1 3.05Å; T208-A210 VanDerWaalsContact C-N 3.31Å; T208-A210 PolarHBondContact O-N 3.3Å; T208-Q211 PolarHBondContact O-N 2.88Å; T208-V212 WeakPolarHBondContact O-CB 3.44Å; T208-V212 VanDerWaalsContact O-CG2 3.26Å; T208-V212 WeakPolarHBondContact O-CG2 3.39Å; T208-V212 PolarHBondContact O-N 3.09Å |
| 209 | D | 58.3 | Low | 61.4 | Low | 100 Ų | 100 | 95.2 Ų | 95.2 | 54% | 0.535 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.3 | -34.3 | 173.5 | -77.1 | -20.7 | 0 | 0 | 0 | 111.9 | V205 S213 | V205-D209 WeakPolarHBondContact O-CB 3.35Å; V205-D209 PolarHBondContact O-N 3.35Å; D209-S213 WeakPolarHBondContact O-CB 3.49Å; D209-S213 PolarHBondContact O-N 3.19Å; D209-S213 VanDerWaalsContact O-N 3.08Å; D209-S213 PolarHBondContact O-OG 3.26Å |
| 210 | A | 61.8 | Low | 60.6 | Low | 51 Ų | 51 | 94.1 Ų | 94.1 | 42% | 0.421 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.8 | -45.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112 | E206 E207 T208 V212 S213 D214 | E206-A210 WeakPolarHBondContact O-CB 3.48Å; E206-A210 PolarHBondContact O-N 2.92Å; E206-A210 VanDerWaalsContact O-N 3.1Å; E207-A210 PolarHBondContact O-N 3.16Å; T208-A210 VanDerWaalsContact C-N 3.31Å; T208-A210 PolarHBondContact O-N 3.3Å; A210-V212 PolarHBondContact O-N 3.32Å; A210-S213 WeakPolarHBondContact O-CB 3.43Å; A210-S213 PolarHBondContact O-N 3.28Å; A210-D214 PolarHBondContact O-N 2.96Å |
| 211 | Q | 58.2 | Low | 60 | Low | 117 Ų | 117 | 97.1 Ų | 97.1 | 55% | 0.547 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66.7 | -35.7 | 178 | -74.1 | -175.8 | 9.2 | 0 | 0 | 113.2 | E207 T208 S213 D214 S215 | E207-Q211 WeakPolarHBondContact O-CG 3.26Å; E207-Q211 PolarHBondContact O-N 3.49Å; T208-Q211 PolarHBondContact O-N 2.88Å; Q211-S213 VanDerWaalsContact C-N 3.34Å; Q211-D214 PolarHBondContact O-N 3.01Å; Q211-S215 WeakPolarHBondContact O-CB 3.45Å; Q211-S215 PolarHBondContact O-N 3.42Å; Q211-S215 PolarHBondContact O-OG 2.85Å |
| 212 | V | 60.5 | Low | 59.4 | Low | 82 Ų | 82 | 98.4 Ų | 98.4 | 50% | 0.497 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -66.2 | -39.6 | 174 | 172.8 | 0 | 0 | 0 | 0 | 110.4 | T208 A210 S215 E216 | T208-V212 WeakPolarHBondContact O-CB 3.44Å; T208-V212 VanDerWaalsContact O-CG2 3.26Å; T208-V212 WeakPolarHBondContact O-CG2 3.39Å; T208-V212 PolarHBondContact O-N 3.09Å; A210-V212 PolarHBondContact O-N 3.32Å; V212-S215 WeakPolarHBondContact CA-OG 3.32Å; V212-S215 PolarHBondContact O-N 3.41Å; V212-S215 PolarHBondContact O-OG 3.28Å; V212-E216 VanDerWaalsContact O-CB 3.3Å; V212-E216 WeakPolarHBondContact O-CB 3.37Å; V212-E216 PolarHBondContact O-N 2.86Å |
| 213 | S | 62.5 | Low | 58.7 | Low | 69 Ų | 69 | 101.8 Ų | 101.8 | 48% | 0.483 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.8 | -41.9 | 175.9 | -60.8 | 0 | 0 | 0 | 0 | 112.3 | D209 A210 Q211 V217 | D209-S213 WeakPolarHBondContact O-CB 3.49Å; D209-S213 PolarHBondContact O-N 3.19Å; D209-S213 VanDerWaalsContact O-N 3.08Å; D209-S213 PolarHBondContact O-OG 3.26Å; A210-S213 WeakPolarHBondContact O-CB 3.43Å; A210-S213 PolarHBondContact O-N 3.28Å; Q211-S213 VanDerWaalsContact C-N 3.34Å; S213-V217 VanDerWaalsContact O-CG2 3.31Å; S213-V217 WeakPolarHBondContact O-CG2 3.48Å; S213-V217 PolarHBondContact O-N 3.32Å |
| 214 | D | 59 | Low | 57.8 | Low | 119 Ų | 119 | 102.1 Ų | 102.1 | 64% | 0.636 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -69.3 | -38.6 | 178.3 | -75.8 | -19.5 | 0 | 0 | 0 | 112.4 | A210 Q211 V217 E218 | A210-D214 PolarHBondContact O-N 2.96Å; Q211-D214 PolarHBondContact O-N 3.01Å; D214-V217 PolarHBondContact O-N 3.24Å; D214-E218 PolarHBondContact O-N 3.04Å |
| 215 | S | 57.5 | Low | 57.2 | Low | 52 Ų | 52 | 101.7 Ų | 101.7 | 36% | 0.364 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -74.4 | -30.7 | 177.8 | 47.3 | 0 | 0 | 0 | 0 | 113.1 | Q211 V212 V217 E218 I219 | Q211-S215 WeakPolarHBondContact O-CB 3.45Å; Q211-S215 PolarHBondContact O-N 3.42Å; Q211-S215 PolarHBondContact O-OG 2.85Å; V212-S215 WeakPolarHBondContact CA-OG 3.32Å; V212-S215 PolarHBondContact O-N 3.41Å; V212-S215 PolarHBondContact O-OG 3.28Å; S215-V217 VanDerWaalsContact C-N 3.32Å; S215-V217 PolarHBondContact O-N 3.48Å; S215-E218 PolarHBondContact O-N 2.84Å; S215-I219 WeakPolarHBondContact O-CD1 3.36Å; S215-I219 WeakPolarHBondContact O-CG1 3.35Å; S215-I219 PolarHBondContact O-N 3.32Å |
| 216 | E | 54.6 | Low | 56.3 | Low | 131 Ų | 131 | 110.2 Ų | 110.2 | 61% | 0.612 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -69.9 | -29.6 | 173.9 | -156.8 | 168.9 | -156 | 0 | 0 | 112.3 | V212 S220 | V212-E216 VanDerWaalsContact O-CB 3.3Å; V212-E216 WeakPolarHBondContact O-CB 3.37Å; V212-E216 PolarHBondContact O-N 2.86Å; E216-S220 PolarHBondContact O-N 3.41Å; E216-S220 PolarHBondContact O-OG 2.91Å |
| 217 | V | 57.2 | Low | 55.4 | Low | 84 Ų | 84 | 111.9 Ų | 111.9 | 51% | 0.509 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -71.3 | -33 | 171.4 | 173.7 | 0 | 0 | 0 | 0 | 112 | S213 D214 S215 | S213-V217 VanDerWaalsContact O-CG2 3.31Å; S213-V217 WeakPolarHBondContact O-CG2 3.48Å; S213-V217 PolarHBondContact O-N 3.32Å; D214-V217 PolarHBondContact O-N 3.24Å; S215-V217 VanDerWaalsContact C-N 3.32Å; S215-V217 PolarHBondContact O-N 3.48Å |
| 218 | E | 53.5 | Low | 54.6 | Low | 141 Ų | 141 | 115.4 Ų | 115.4 | 66% | 0.659 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -77.2 | -37.7 | 177.7 | -114.7 | -174.1 | 169.4 | 0 | 0 | 113.6 | D214 S215 S220 K221 T222 | D214-E218 PolarHBondContact O-N 3.04Å; S215-E218 PolarHBondContact O-N 2.84Å; E218-S220 PolarHBondContact O-N 3.22Å; E218-K221 PolarHBondContact O-N 2.92Å; E218-K221 VanDerWaalsContact O-N 3.12Å; E218-T222 PolarHBondContact O-N 3.33Å; E218-T222 PolarHBondContact O-OG1 2.83Å |
| 219 | I | 53.7 | Low | 53.9 | Low | 93 Ų | 93 | 120.6 Ų | 120.6 | 48% | 0.477 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -67.5 | -24.1 | 176.8 | -61.1 | 160.1 | 0 | 0 | 0 | 111.1 | S215 | S215-I219 WeakPolarHBondContact O-CD1 3.36Å; S215-I219 WeakPolarHBondContact O-CG1 3.35Å; S215-I219 PolarHBondContact O-N 3.32Å |
| 220 | S | 55.4 | Low | 53.1 | Low | 89 Ų | 89 | 121 Ų | 121 | 62% | 0.622 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -77.8 | -20.6 | 175.4 | -58.8 | 0 | 0 | 0 | 0 | 113.4 | E216 E218 | E216-S220 PolarHBondContact O-N 3.41Å; E216-S220 PolarHBondContact O-OG 2.91Å; E218-S220 PolarHBondContact O-N 3.22Å |
| 221 | K | 57.6 | Low | 52 | Low | 171 Ų | 171 | 123.7 Ų | 123.7 | 74% | 0.743 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -90.3 | -15.5 | 178.2 | -73.6 | 177.4 | -179.6 | 171.3 | 0 | 114.1 | E218 | E218-K221 PolarHBondContact O-N 2.92Å; E218-K221 VanDerWaalsContact O-N 3.12Å |
| 222 | T | 54.4 | Low | 51.3 | Low | 100 Ų | 100 | 125.2 Ų | 125.2 | 61% | 0.613 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -104.5 | -0.3 | -175.3 | 46.7 | 0 | 0 | 0 | 0 | 114.7 | E218 G224 | E218-T222 PolarHBondContact O-N 3.33Å; E218-T222 PolarHBondContact O-OG1 2.83Å; T222-G224 PolarHBondContact O-N 3.19Å |
| 223 | K | 50.8 | Low | 50.4 | Low | 176 Ų | 176 | 129.7 Ų | 129.7 | 77% | 0.765 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | 20.4 | -179.7 | -91.3 | 177.7 | 177.2 | 171.2 | 0 | 116.3 | ||
| 224 | G | 46.7 | Very low | 49.3 | Very low | 79 Ų | 79 | 131.6 Ų | 131.6 | 81% | 0.814 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | -3.9 | -177 | 0 | 0 | 0 | 0 | 0 | 117.3 | T222 | T222-G224 PolarHBondContact O-N 3.19Š|
| 225 | S | 48.2 | Very low | 48.2 | Very low | 94 Ų | 94 | 133.4 Ų | 133.4 | 66% | 0.657 | 73% | 0.725 | S | S | * | * | S | Bend | trans | -155.2 | 40.2 | -162.9 | -175.9 | 0 | 0 | 0 | 0 | 116.6 | ||
| 226 | W | 44.8 | Very low | 47.1 | Very low | 246 Ų | 246 | 134.7 Ų | 134.7 | 93% | 0.932 | 74% | 0.739 | S | S | * | * | trans | -140.4 | 70.1 | 171.8 | -65.3 | 79.6 | 0 | 0 | 0 | 111.1 | ||||
| 227 | N | 44.8 | Very low | 46.1 | Very low | 161 Ų | 161 | 133.3 Ų | 133.3 | 86% | 0.861 | 74% | 0.743 | S | S | * | * | trans | -93.2 | 132.7 | 160.1 | -91.3 | -25 | 0 | 0 | 0 | 108.4 | ||||
| 228 | K | 46.9 | Very low | 45 | Very low | 194 Ų | 194 | 141.5 Ų | 141.5 | 84% | 0.843 | 77% | 0.765 | S | S | * | * | S | Bend | trans | 72.8 | 94.7 | 172.8 | -59.9 | 174.9 | 175 | 177.3 | 0 | 115 | ||
| 229 | E | 45 | Very low | 44.1 | Very low | 184 Ų | 184 | 141.1 Ų | 141.1 | 86% | 0.86 | 77% | 0.766 | S | S | * | * | 165.9 | 151.6 | 114.8 | -93.2 | 169.4 | 170.3 | 0 | 0 | 110.6 | |||||
| 230 | S | 41.9 | Very low | 43 | Very low | 108 Ų | 108 | 141.3 Ų | 141.3 | 76% | 0.755 | 78% | 0.782 | S | S | * | * | trans | 76.1 | 76.7 | 166.2 | 70.4 | 0 | 0 | 0 | 0 | 117.6 | N232 | S230-N232 PolarHBondContact O-N 3.22Š| ||
| 231 | S | 39.1 | Very low | 41.8 | Very low | 107 Ų | 107 | 142 Ų | 142 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | -41.3 | 111 | 127.6 | 48.4 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 232 | N | 43.8 | Very low | 40.4 | Very low | 149 Ų | 149 | 136.5 Ų | 136.5 | 80% | 0.797 | 77% | 0.774 | S | S | * | * | trans | 155.8 | 92.7 | 151.5 | -80.9 | -23.9 | 0 | 0 | 0 | 109.8 | S230 | S230-N232 PolarHBondContact O-N 3.22Š| ||
| 233 | L | 41.3 | Very low | 39.3 | Very low | 176 Ų | 176 | 139.7 Ų | 139.7 | 92% | 0.921 | 78% | 0.78 | S | S | * | * | trans | -158.3 | 144.2 | 149.2 | -97.8 | 134.5 | 0 | 0 | 0 | 110.1 | ||||
| 234 | P | 38.3 | Very low | 38.2 | Very low | 109 Ų | 109 | 141.6 Ų | 141.6 | 71% | 0.708 | 78% | 0.784 | S | S | * | * | trans | -83.8 | 149.1 | -156.2 | 1.2 | 15.7 | 0 | 0 | 0 | 113.5 | A236 | P234-A236 VanDerWaalsContact C-N 3.33Å; P234-A236 PolarHBondContact O-N 3.38Å | ||
| 235 | V | 37 | Very low | 37.5 | Very low | 158 Ų | 158 | 143.2 Ų | 143.2 | 96% | 0.958 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -62.3 | 87.4 | 163.8 | -179.8 | 0 | 0 | 0 | 0 | 109.3 | ||
| 236 | A | 33.3 | Very low | 36.5 | Very low | 79 Ų | 79 | 146.9 Ų | 146.9 | 65% | 0.653 | 79% | 0.785 | S | S | * | * | trans | -158.3 | 145.5 | 166.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | P234 | P234-A236 VanDerWaalsContact C-N 3.33Å; P234-A236 PolarHBondContact O-N 3.38Å | ||
| 237 | S | 34.6 | Very low | 36 | Very low | 102 Ų | 102 | 139.2 Ų | 139.2 | 71% | 0.713 | 77% | 0.774 | S | S | * | * | trans | 89.6 | 58 | 173.1 | -45.7 | 0 | 0 | 0 | 0 | 116.3 | I239 | S237-I239 PolarHBondContact O-N 3.34Š| ||
| 238 | R | 34.5 | Very low | 35.3 | Very low | 255 Ų | 255 | 138.9 Ų | 138.9 | 96% | 0.962 | 77% | 0.768 | S | S | * | * | trans | -67.6 | 89.2 | 140.3 | -76.6 | -174.9 | -179.3 | -175.4 | -0.2 | 107.2 | A240 | R238-A240 PolarHBondContact O-N 2.92Š| ||
| 239 | I | 33.4 | Very low | 34.8 | Very low | 134 Ų | 134 | 136.3 Ų | 136.3 | 69% | 0.687 | 76% | 0.762 | S | S | * | * | trans | -69.5 | 98.2 | 171.1 | -60.7 | 175.7 | 0 | 0 | 0 | 106.4 | S237 V241 | S237-I239 PolarHBondContact O-N 3.34Å; I239-V241 HydrophobicContact CG2-CG2 3.72Å; I239-V241 PolarHBondContact O-N 3.49Å; I239-V241 VanDerWaalsContact O-N 3.14Å | ||
| 240 | A | 30.7 | Very low | 34.3 | Very low | 97 Ų | 97 | 131.8 Ų | 131.8 | 80% | 0.802 | 75% | 0.751 | S | S | * | * | trans | -71 | 98.1 | 160 | 0 | 0 | 0 | 0 | 0 | 106.7 | R238 G242 | R238-A240 PolarHBondContact O-N 2.92Å; A240-G242 VanDerWaalsContact C-N 3.26Å; A240-G242 PolarHBondContact O-N 3.02Å | ||
| 241 | V | 30.3 | Very low | 34.1 | Very low | 102 Ų | 102 | 132.5 Ų | 132.5 | 62% | 0.618 | 75% | 0.746 | S | S | * | * | trans | -69.2 | 89.3 | 170.7 | -177.2 | 0 | 0 | 0 | 0 | 107.2 | I239 F243 | I239-V241 HydrophobicContact CG2-CG2 3.72Å; I239-V241 PolarHBondContact O-N 3.49Å; I239-V241 VanDerWaalsContact O-N 3.14Å; V241-F243 HydrophobicContact CG1-CD2 3.77Å; V241-F243 HydrophobicContact CG1-CE2 3.44Å; V241-F243 VanDerWaalsContact CG1-CE2 3.44Å; V241-F243 HydrophobicContact CG1-CZ 4.03Å; V241-F243 PolarHBondContact O-N 3.35Å | ||
| 242 | G | 28.4 | Very low | 34 | Very low | 57 Ų | 57 | 135.4 Ų | 135.4 | 59% | 0.588 | 75% | 0.747 | S | S | * | * | trans | -85.7 | 99.4 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.2 | A240 Y244 | A240-G242 VanDerWaalsContact C-N 3.26Å; A240-G242 PolarHBondContact O-N 3.02Å; G242-Y244 PolarHBondContact O-N 3.48Å | ||
| 243 | F | 31.7 | Very low | 33.5 | Very low | 167 Ų | 167 | 135.8 Ų | 135.8 | 73% | 0.732 | 75% | 0.749 | S | S | * | * | trans | -64.8 | 113 | 169 | -77.8 | -88.2 | 0 | 0 | 0 | 109.5 | V241 | V241-F243 HydrophobicContact CG1-CD2 3.77Å; V241-F243 HydrophobicContact CG1-CE2 3.44Å; V241-F243 VanDerWaalsContact CG1-CE2 3.44Å; V241-F243 HydrophobicContact CG1-CZ 4.03Å; V241-F243 PolarHBondContact O-N 3.35Å | ||
| 244 | Y | 27.4 | Very low | 33.3 | Very low | 215 Ų | 215 | 133.7 Ų | 133.7 | 84% | 0.843 | 74% | 0.744 | S | S | * | * | trans | -91.2 | 101.4 | 169.7 | -90 | -94.6 | 0 | 0 | 0 | 108.9 | G242 | G242-Y244 PolarHBondContact O-N 3.48Š| ||
| 245 | C | 31.4 | Very low | 33 | Very low | 113 Ų | 113 | 138.1 Ų | 138.1 | 76% | 0.764 | 75% | 0.752 | S | S | * | * | trans | -83.4 | 112.5 | 162.4 | -79.8 | 0 | 0 | 0 | 0 | 109.5 | A247 | C245-A247 PolarHBondContact O-N 3.42Š| ||
| 246 | K | 28.6 | Very low | 32.5 | Very low | 172 Ų | 172 | 136.8 Ų | 136.8 | 75% | 0.748 | 74% | 0.744 | S | S | * | * | trans | -84.3 | 96.6 | 172.5 | -166.6 | -172.3 | -176.6 | -140.9 | 0 | 107.9 | E248 | K246-E248 IonicContact NZ-OE1 2.8Å; K246-E248 PolarHBondContact NZ-OE1 2.85Å | ||
| 247 | A | 32.9 | Very low | 32.2 | Very low | 85 Ų | 85 | 140.5 Ų | 140.5 | 70% | 0.702 | 75% | 0.752 | S | S | * | * | trans | -87.8 | 104.7 | 169.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | C245 I249 | C245-A247 PolarHBondContact O-N 3.42Å; A247-I249 PolarHBondContact O-N 3.37Å | ||
| 248 | E | 31.5 | Very low | 31.9 | Very low | 153 Ų | 153 | 140.5 Ų | 140.5 | 72% | 0.715 | 76% | 0.758 | S | S | * | * | trans | -73.9 | 99.6 | 168.8 | -76.4 | 175.4 | 180 | 0 | 0 | 108.7 | K246 S250 | K246-E248 IonicContact NZ-OE1 2.8Å; K246-E248 PolarHBondContact NZ-OE1 2.85Å; E248-S250 PolarHBondContact O-N 3.01Å | ||
| 249 | I | 35.2 | Very low | 31.5 | Very low | 140 Ų | 140 | 133.9 Ų | 133.9 | 72% | 0.718 | 75% | 0.751 | S | S | * | * | trans | -84.3 | 97.6 | 170.4 | -58.1 | 175 | 0 | 0 | 0 | 107.4 | A247 D251 | A247-I249 PolarHBondContact O-N 3.37Å; I249-D251 PolarHBondContact O-N 2.83Å | ||
| 250 | S | 36.2 | Very low | 31.2 | Very low | 90 Ų | 90 | 135.5 Ų | 135.5 | 63% | 0.629 | 76% | 0.759 | S | S | * | * | trans | -72.8 | 99.3 | 168.2 | 156.6 | 0 | 0 | 0 | 0 | 109.6 | E248 H252 | E248-S250 PolarHBondContact O-N 3.01Å; S250-H252 PolarHBondContact O-N 3.03Å | ||
| 251 | D | 37.5 | Very low | 31 | Very low | 123 Ų | 123 | 134.4 Ų | 134.4 | 66% | 0.658 | 76% | 0.757 | S | S | * | * | trans | -80.2 | 69.9 | 171.1 | -119 | 0.3 | 0 | 0 | 0 | 110 | I249 D253 | I249-D251 PolarHBondContact O-N 2.83Å; D251-D253 PolarHBondContact O-N 2.79Å | ||
| 252 | H | 36.2 | Very low | 30.8 | Very low | 167 Ų | 167 | 138.8 Ų | 138.8 | 77% | 0.773 | 78% | 0.776 | S | S | * | * | trans | -89.1 | 79 | 164.8 | -101.6 | -67.7 | 0 | 0 | 0 | 108.1 | S250 | S250-H252 PolarHBondContact O-N 3.03Š| ||
| 253 | D | 34 | Very low | 30.8 | Very low | 157 Ų | 157 | 140.1 Ų | 140.1 | 84% | 0.84 | 78% | 0.782 | S | S | * | * | trans | -173.6 | 44.5 | 160.9 | -96.6 | -17.2 | 0 | 0 | 0 | 114.4 | D251 | D251-D253 PolarHBondContact O-N 2.79Š| ||
| 254 | T | 36.3 | Very low | 30.6 | Very low | 132 Ų | 132 | 141.4 Ų | 141.4 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | trans | -116.9 | 59.1 | 164.9 | 46.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 255 | K | 31.1 | Very low | 30.9 | Very low | 203 Ų | 203 | 136.5 Ų | 136.5 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | trans | -118.5 | 58.9 | 167.7 | -93.6 | -172.3 | 178.1 | 178.3 | 0 | 110.6 | ||||
| 256 | T | 28.3 | Very low | 30.7 | Very low | 129 Ų | 129 | 135 Ų | 135 | 79% | 0.791 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -157.4 | 135.7 | 159.8 | -30.3 | 0 | 0 | 0 | 0 | 110.6 | ||
| 257 | I | 26.1 | Very low | 30.8 | Very low | 158 Ų | 158 | 134.1 Ų | 134.1 | 81% | 0.81 | 79% | 0.793 | S | S | * | * | trans | 86 | 75 | 162.4 | -37 | 175.2 | 0 | 0 | 0 | 116.8 | ||||
| 258 | A | 28.1 | Very low | 30.6 | Very low | 102 Ų | 102 | 135.4 Ų | 135.4 | 84% | 0.843 | 80% | 0.797 | S | S | * | * | trans | -157 | 63.7 | 143 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 259 | S | 25.6 | Very low | 30.7 | Very low | 116 Ų | 116 | 132.9 Ų | 132.9 | 81% | 0.811 | 80% | 0.796 | S | S | * | * | trans | -123.2 | 65.7 | 173 | -49.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 260 | I | 27.9 | Very low | 30.3 | Very low | 168 Ų | 168 | 135.7 Ų | 135.7 | 86% | 0.862 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -141.3 | 98 | 169.3 | -58.3 | -178.7 | 0 | 0 | 0 | 108.2 | ||
| 261 | G | 26.7 | Very low | 30 | Very low | 74 Ų | 74 | 136.9 Ų | 136.9 | 76% | 0.763 | 81% | 0.81 | S | S | * | * | trans | 59.5 | 75.1 | 141.6 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 262 | L | 26.3 | Very low | 29.6 | Very low | 194 Ų | 194 | 141 Ų | 141 | 100% | 1.016 | 82% | 0.822 | S | S | * | * | trans | -96.2 | 94.8 | 149.5 | -92.3 | 161 | 0 | 0 | 0 | 107.7 | ||||
| 263 | A | 27 | Very low | 29.2 | Very low | 85 Ų | 85 | 140.6 Ų | 140.6 | 70% | 0.702 | 82% | 0.824 | S | S | * | * | trans | -136.3 | 135.7 | 162.7 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 264 | E | 29.1 | Very low | 29 | Very low | 193 Ų | 193 | 137.8 Ų | 137.8 | 90% | 0.902 | 82% | 0.815 | S | S | * | * | S | Bend | trans | 77.4 | 77.4 | 166.4 | -54.2 | -177.9 | 179 | 0 | 0 | 117.8 | ||
| 265 | S | 33.3 | Very low | 28.5 | Very low | 113 Ų | 113 | 139 Ų | 139 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | -166.8 | 106.2 | 122.4 | 63.6 | 0 | 0 | 0 | 0 | 109.4 | I267 | S265-I267 PolarHBondContact O-N 3.01Š| |||
| 266 | G | 26.8 | Very low | 28.5 | Very low | 82 Ų | 82 | 138.3 Ų | 138.3 | 85% | 0.845 | 81% | 0.813 | S | S | * | * | trans | -68.5 | 111.6 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 267 | I | 30.6 | Very low | 28.6 | Very low | 152 Ų | 152 | 139.5 Ų | 139.5 | 78% | 0.779 | 81% | 0.809 | S | S | * | * | trans | -136.8 | 99.1 | 151.4 | -56.8 | -178.4 | 0 | 0 | 0 | 106.7 | S265 | S265-I267 PolarHBondContact O-N 3.01Š| ||
| 268 | S | 28.1 | Very low | 28.7 | Very low | 113 Ų | 113 | 139.1 Ų | 139.1 | 79% | 0.79 | 81% | 0.809 | S | S | * | * | trans | -72.3 | 114.2 | 166.6 | 167.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 269 | S | 34.2 | Very low | 28.9 | Very low | 100 Ų | 100 | 140 Ų | 140 | 70% | 0.699 | 80% | 0.804 | S | S | * | * | trans | -146.9 | 119.1 | 151.4 | 59 | 0 | 0 | 0 | 0 | 110.3 | C271 | S269-C271 PolarHBondContact O-N 3.29Š| ||
| 270 | K | 28.1 | Very low | 29.1 | Very low | 198 Ų | 198 | 143.2 Ų | 143.2 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | trans | -70.4 | 106.5 | -180 | -66.9 | 167 | 175.8 | 172 | 0 | 108.9 | ||||
| 271 | C | 28.8 | Very low | 29.4 | Very low | 115 Ų | 115 | 145.3 Ų | 145.3 | 78% | 0.777 | 81% | 0.805 | S | S | * | * | trans | -111.6 | 102.5 | 158.6 | -76.6 | 0 | 0 | 0 | 0 | 109 | S269 L273 | S269-C271 PolarHBondContact O-N 3.29Å; C271-L273 PolarHBondContact O-N 3.17Å | ||
| 272 | K | 28.4 | Very low | 29.6 | Very low | 211 Ų | 211 | 147.9 Ų | 147.9 | 92% | 0.917 | 81% | 0.806 | S | S | * | * | trans | -60.1 | 116 | 165.8 | -74.6 | 172.2 | 172.6 | 176.9 | 0 | 108.5 | ||||
| 273 | L | 29 | Very low | 30.1 | Very low | 157 Ų | 157 | 143.6 Ų | 143.6 | 82% | 0.822 | 79% | 0.792 | S | S | * | * | trans | -107.7 | 139.2 | 156.8 | -100.6 | 117.9 | 0 | 0 | 0 | 108.8 | C271 L275 | C271-L273 PolarHBondContact O-N 3.17Å; L273-L275 PolarHBondContact O-N 3.06Å | ||
| 274 | P | 29.3 | Very low | 30.6 | Very low | 98 Ų | 98 | 142.8 Ų | 142.8 | 64% | 0.636 | 78% | 0.778 | S | S | * | * | trans | -71.3 | 130.8 | -172.7 | 28.8 | -32.2 | 0 | 0 | 0 | 111.1 | F276 | P274-F276 HydrophobicContact CG-CD2 4.46Å; P274-F276 HydrophobicContact CG-CE2 4.34Å; P274-F276 PolarHBondContact O-N 2.95Å; P274-F276 VanDerWaalsContact O-N 3.16Å | ||
| 275 | L | 26.9 | Very low | 31.2 | Very low | 157 Ų | 157 | 138.9 Ų | 138.9 | 82% | 0.822 | 77% | 0.77 | S | S | * | * | trans | -53.5 | 108.9 | 159.6 | -81.6 | 149.1 | 0 | 0 | 0 | 109.3 | L273 | L273-L275 PolarHBondContact O-N 3.06Š| ||
| 276 | F | 29.9 | Very low | 31.7 | Very low | 190 Ų | 190 | 137.7 Ų | 137.7 | 83% | 0.833 | 76% | 0.758 | S | S | * | * | trans | -97.3 | 98.4 | 159.3 | -92.9 | -85.1 | 0 | 0 | 0 | 108.7 | P274 | P274-F276 HydrophobicContact CG-CD2 4.46Å; P274-F276 HydrophobicContact CG-CE2 4.34Å; P274-F276 PolarHBondContact O-N 2.95Å; P274-F276 VanDerWaalsContact O-N 3.16Å | ||
| 277 | H | 30.1 | Very low | 32.5 | Very low | 153 Ų | 153 | 138.5 Ų | 138.5 | 71% | 0.708 | 74% | 0.742 | S | S | * | * | trans | -68 | 145.6 | 159.9 | -95.7 | -78.8 | 0 | 0 | 0 | 110.2 | ||||
| 278 | N | 29.3 | Very low | 33.1 | Very low | 151 Ų | 151 | 135.9 Ų | 135.9 | 81% | 0.807 | 73% | 0.729 | S | S | * | * | trans | 49.6 | 93 | 156.7 | -75.3 | -7.3 | 0 | 0 | 0 | 117.7 | ||||
| 279 | T | 31.3 | Very low | 33.9 | Very low | 120 Ų | 120 | 139 Ų | 139 | 74% | 0.736 | 72% | 0.723 | S | S | * | * | trans | -140.6 | 125.3 | 140.2 | 34.9 | 0 | 0 | 0 | 0 | 110.4 | Y281 | T279-Y281 PolarHBondContact O-N 2.72Š| ||
| 280 | Q | 30.4 | Very low | 34.4 | Very low | 184 Ų | 184 | 143.2 Ų | 143.2 | 86% | 0.86 | 72% | 0.724 | S | S | * | * | trans | -59.9 | 121.1 | 172.8 | -65.6 | 166.1 | -12.6 | 0 | 0 | 109.5 | ||||
| 281 | Y | 33.2 | Very low | 35.3 | Very low | 212 Ų | 212 | 138.6 Ų | 138.6 | 83% | 0.831 | 71% | 0.707 | S | S | * | * | trans | -125.4 | 94.9 | 160.5 | -84.7 | -82.1 | 0 | 0 | 0 | 108.6 | T279 S283 | T279-Y281 PolarHBondContact O-N 2.72Å; Y281-S283 PolarHBondContact O-N 3.24Å | ||
| 282 | T | 30.7 | Very low | 36.1 | Very low | 128 Ų | 128 | 139.9 Ų | 139.9 | 79% | 0.785 | 70% | 0.696 | S | S | * | * | trans | -76.8 | 87.2 | 169.8 | 42.3 | 0 | 0 | 0 | 0 | 108.9 | T284 | T282-T284 PolarHBondContact O-N 3.46Š| ||
| 283 | S | 37.5 | Very low | 37.1 | Very low | 103 Ų | 103 | 136.7 Ų | 136.7 | 72% | 0.72 | 68% | 0.684 | S | S | * | * | trans | -82.4 | 98.5 | 165.1 | 66.3 | 0 | 0 | 0 | 0 | 109 | Y281 | Y281-S283 PolarHBondContact O-N 3.24Š| ||
| 284 | T | 36.9 | Very low | 37.7 | Very low | 68 Ų | 68 | 137.2 Ų | 137.2 | 42% | 0.417 | 68% | 0.68 | S | S | . | * | trans | -62.5 | 150.4 | 176.3 | 30.4 | 0 | 0 | 0 | 0 | 112.3 | T282 T286 L287 | T282-T284 PolarHBondContact O-N 3.46Å; T284-T286 PolarHBondContact O-N 3.27Å; T284-L287 PolarHBondContact O-N 3.44Å | ||
| 285 | P | 42.8 | Very low | 38.3 | Very low | 111 Ų | 111 | 137 Ų | 137 | 72% | 0.721 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.4 | -9 | 180 | -20 | 31.2 | 0 | 0 | 0 | 114.8 | ||
| 286 | T | 43.5 | Very low | 39.2 | Very low | 89 Ų | 89 | 137.6 Ų | 137.6 | 55% | 0.546 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -81.1 | -20.6 | -178 | -31.5 | 0 | 0 | 0 | 0 | 113.3 | T284 | T284-T286 PolarHBondContact O-N 3.27Å |
| 287 | L | 42.9 | Very low | 39.8 | Very low | 98 Ų | 98 | 131.9 Ų | 131.9 | 51% | 0.513 | 66% | 0.661 | S | S | . | * | H | α-helix | trans | -75.1 | -28.3 | 177.9 | -107.8 | 144.5 | 0 | 0 | 0 | 112.6 | T284 R290 I291 | T284-L287 PolarHBondContact O-N 3.44Å; L287-R290 PolarHBondContact O-N 3.03Å; L287-I291 HydrophobicContact CD2-CD1 4.21Å; L287-I291 WeakPolarHBondContact O-CG1 3.44Å; L287-I291 PolarHBondContact O-N 3.19Å; L287-I291 VanDerWaalsContact O-N 3.13Å |
| 288 | I | 43.5 | Very low | 40.1 | Very low | 97 Ų | 97 | 131.8 Ų | 131.8 | 50% | 0.497 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -73 | -30.9 | 177.7 | -62.9 | 175.5 | 0 | 0 | 0 | 111.2 | R292 | I288-R292 HydrophobicContact CG2-CG 4.47Å; I288-R292 WeakPolarHBondContact O-CB 3.19Å; I288-R292 WeakPolarHBondContact O-CG 3.35Å; I288-R292 PolarHBondContact O-N 3.37Å; I288-R292 VanDerWaalsContact O-N 3.09Å |
| 289 | R | 45.6 | Very low | 40.5 | Very low | 179 Ų | 179 | 133.8 Ų | 133.8 | 68% | 0.675 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -69.5 | -37.3 | 172.7 | -106.4 | -178.9 | 178.2 | 122.5 | -1.3 | 113.2 | Q293 | R289-Q293 PolarHBondContact O-N 3Å |
| 290 | R | 45.4 | Very low | 40.8 | Very low | 188 Ų | 188 | 135 Ų | 135 | 71% | 0.709 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -74.8 | -31.8 | 177.7 | -76.3 | -174.5 | -171.6 | 159.8 | 3.7 | 113.5 | L287 K294 | L287-R290 PolarHBondContact O-N 3.03Å; R290-K294 WeakPolarHBondContact O-CB 3.39Å; R290-K294 PolarHBondContact O-N 3.15Å |
| 291 | I | 45.5 | Very low | 41.2 | Very low | 101 Ų | 101 | 131.3 Ų | 131.3 | 52% | 0.518 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -76.1 | -36.5 | 176.1 | -64.8 | 168.7 | 0 | 0 | 0 | 110.7 | L287 K294 C295 | L287-I291 HydrophobicContact CD2-CD1 4.21Å; L287-I291 WeakPolarHBondContact O-CG1 3.44Å; L287-I291 PolarHBondContact O-N 3.19Å; L287-I291 VanDerWaalsContact O-N 3.13Å; I291-K294 PolarHBondContact O-N 3.47Å; I291-C295 PolarHBondContact O-N 2.88Å; I291-C295 PolarHBondContact O-SG 3.33Å |
| 292 | R | 46.5 | Very low | 41.4 | Very low | 142 Ų | 142 | 130.8 Ų | 130.8 | 54% | 0.536 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -72.7 | -27.8 | 177.1 | -73.4 | -179.1 | 177.3 | 175 | -1.1 | 114.3 | I288 H296 | I288-R292 HydrophobicContact CG2-CG 4.47Å; I288-R292 WeakPolarHBondContact O-CB 3.19Å; I288-R292 WeakPolarHBondContact O-CG 3.35Å; I288-R292 PolarHBondContact O-N 3.37Å; I288-R292 VanDerWaalsContact O-N 3.09Å; R292-H296 PolarHBondContact O-CD2 3.44Å |
| 293 | Q | 48.4 | Very low | 42 | Very low | 144 Ų | 144 | 133.5 Ų | 133.5 | 67% | 0.673 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -76.7 | -29.4 | 170.7 | -79.5 | -177.5 | -27 | 0 | 0 | 112.9 | R289 C295 S297 | R289-Q293 PolarHBondContact O-N 3Å; Q293-C295 VanDerWaalsContact C-N 3.34Å; Q293-S297 PolarHBondContact O-OG 2.86Å |
| 294 | K | 43 | Very low | 42.2 | Very low | 168 Ų | 168 | 138.1 Ų | 138.1 | 73% | 0.73 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -77.8 | -16.7 | 178.8 | -150 | 168.7 | -176.5 | -179.5 | 0 | 113.6 | R290 I291 | R290-K294 WeakPolarHBondContact O-CB 3.39Å; R290-K294 PolarHBondContact O-N 3.15Å; I291-K294 PolarHBondContact O-N 3.47Å |
| 295 | C | 41.9 | Very low | 42.4 | Very low | 93 Ų | 93 | 139.9 Ų | 139.9 | 63% | 0.628 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.8 | 2.6 | 176.5 | -65.1 | 0 | 0 | 0 | 0 | 115 | I291 Q293 | I291-C295 PolarHBondContact O-N 2.88Å; I291-C295 PolarHBondContact O-SG 3.33Å; Q293-C295 VanDerWaalsContact C-N 3.34Å |
| 296 | H | 44.5 | Very low | 42.2 | Very low | 171 Ų | 171 | 139.3 Ų | 139.3 | 79% | 0.792 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -117 | 15.6 | 173.5 | -73.9 | -49.7 | 0 | 0 | 0 | 113.2 | R292 | R292-H296 PolarHBondContact O-CD2 3.44Š|
| 297 | S | 43.5 | Very low | 42 | Very low | 69 Ų | 69 | 140.7 Ų | 140.7 | 48% | 0.483 | 71% | 0.707 | S | S | . | * | trans | -112.2 | 0 | -176.1 | -52.3 | 0 | 0 | 0 | 0 | 114.8 | Q293 E299 | Q293-S297 PolarHBondContact O-OG 2.86Å; S297-E299 VanDerWaalsContact C-N 3.33Å; S297-E299 PolarHBondContact O-N 2.92Å | ||
| 298 | D | 36.8 | Very low | 41.8 | Very low | 152 Ų | 152 | 145 Ų | 145 | 81% | 0.813 | 72% | 0.722 | S | S | * | * | trans | -93.3 | 17.1 | -177.4 | -67.9 | -18.1 | 0 | 0 | 0 | 113.7 | ||||
| 299 | E | 36.9 | Very low | 41.7 | Very low | 193 Ų | 193 | 148.2 Ų | 148.2 | 90% | 0.902 | 74% | 0.74 | S | S | * | * | trans | -99.9 | 71.7 | 164.3 | -103.4 | -176.5 | 163.7 | 0 | 0 | 109.3 | S297 | S297-E299 VanDerWaalsContact C-N 3.33Å; S297-E299 PolarHBondContact O-N 2.92Å | ||
| 300 | I | 38 | Very low | 41.3 | Very low | 145 Ų | 145 | 148 Ų | 148 | 74% | 0.744 | 75% | 0.747 | S | S | * | * | trans | -130.5 | 121.7 | 167.7 | -57.9 | -179.8 | 0 | 0 | 0 | 110 | ||||
| 301 | S | 38.6 | Very low | 41.1 | Very low | 106 Ų | 106 | 146.1 Ų | 146.1 | 74% | 0.741 | 76% | 0.756 | S | S | * | * | trans | -49.2 | 129.3 | 176.5 | 57.9 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 302 | E | 37.7 | Very low | 40.9 | Very low | 202 Ų | 202 | 150.4 Ų | 150.4 | 94% | 0.944 | 77% | 0.771 | S | S | * | * | trans | -98.4 | 100.9 | 154.9 | -81.8 | -173.2 | 156.2 | 0 | 0 | 109.6 | ||||
| 303 | K | 43.3 | Very low | 40.5 | Very low | 185 Ų | 185 | 147.3 Ų | 147.3 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -132.8 | 116.3 | 164 | -120.3 | -178 | -175.5 | 175.1 | 0 | 108.5 | ||||
| 304 | K | 41.8 | Very low | 40 | Very low | 200 Ų | 200 | 147.6 Ų | 147.6 | 87% | 0.87 | 80% | 0.795 | S | S | * | * | trans | 67.8 | 106.8 | 153.5 | -67.2 | -175.2 | 173.3 | -176 | 0 | 119.6 | ||||
| 305 | A | 39.7 | Very low | 39.7 | Very low | 104 Ų | 104 | 143.2 Ų | 143.2 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | -164.3 | 144.1 | 129.5 | 0 | 0 | 0 | 0 | 0 | 105.1 | |||||
| 306 | S | 39.4 | Very low | 39.5 | Very low | 100 Ų | 100 | 146.3 Ų | 146.3 | 70% | 0.699 | 81% | 0.807 | S | S | * | * | cis | -169.3 | 126.2 | 9.3 | 140.4 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 307 | T | 39.2 | Very low | 39.3 | Very low | 118 Ų | 118 | 145.1 Ų | 145.1 | 72% | 0.724 | 81% | 0.813 | S | S | * | * | trans | 19.6 | 138.2 | 140.6 | 35.8 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 308 | K | 39.2 | Very low | 39 | Very low | 188 Ų | 188 | 147.9 Ų | 147.9 | 82% | 0.817 | 83% | 0.827 | S | S | * | * | trans | 79.8 | 107.9 | 145.9 | -71.8 | 178.4 | 176 | -179.1 | 0 | 118.4 | ||||
| 309 | D | 40.1 | Very low | 39.2 | Very low | 165 Ų | 165 | 150.5 Ų | 150.5 | 88% | 0.882 | 83% | 0.834 | S | S | * | * | -165.4 | 142.3 | 95 | -90.3 | -25.7 | 0 | 0 | 0 | 112 | |||||
| 310 | E | 37.4 | Very low | 39.1 | Very low | 174 Ų | 174 | 144.9 Ų | 144.9 | 81% | 0.813 | 83% | 0.828 | S | S | * | * | trans | -107.2 | 116.7 | -170.7 | -173.6 | -173.9 | -161.4 | 0 | 0 | 107.7 | ||||
| 311 | V | 42.5 | Very low | 39 | Very low | 148 Ų | 148 | 146.9 Ų | 146.9 | 90% | 0.897 | 83% | 0.834 | S | S | * | * | trans | -137.1 | 116.1 | 161.9 | -178.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 312 | K | 41 | Very low | 38.9 | Very low | 191 Ų | 191 | 149.5 Ų | 149.5 | 83% | 0.83 | 84% | 0.838 | S | S | * | * | trans | -54.1 | 147.8 | 172.9 | -68.9 | 165.8 | 171.4 | 172.3 | 0 | 113.1 | ||||
| 313 | G | 37.4 | Very low | 38.9 | Very low | 77 Ų | 77 | 145.3 Ų | 145.3 | 79% | 0.794 | 83% | 0.828 | S | S | * | * | trans | -176.9 | 87.4 | 165.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 314 | T | 37.6 | Very low | 38.7 | Very low | 150 Ų | 150 | 145 Ų | 145 | 92% | 0.92 | 83% | 0.832 | S | S | * | * | trans | -58.8 | 147.3 | 175.4 | 45.6 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 315 | G | 38.2 | Very low | 38.5 | Very low | 76 Ų | 76 | 141.5 Ų | 141.5 | 78% | 0.784 | 83% | 0.827 | S | S | * | * | trans | 177.3 | 91.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 316 | N | 37 | Very low | 38 | Very low | 158 Ų | 158 | 141 Ų | 141 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | trans | -70.1 | 145.6 | 174 | -62.4 | -25.2 | 0 | 0 | 0 | 111.9 | ||||
| 317 | T | 40.2 | Very low | 37.7 | Very low | 147 Ų | 147 | 142 Ų | 142 | 90% | 0.902 | 83% | 0.83 | S | S | * | * | trans | -158.4 | 130.5 | 137.6 | 37.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 318 | T | 37.6 | Very low | 37.4 | Very low | 127 Ų | 127 | 141.8 Ų | 141.8 | 78% | 0.779 | 83% | 0.829 | S | S | * | * | trans | -81.1 | 146.5 | -177.3 | 39.3 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 319 | H | 40 | Very low | 37.1 | Very low | 206 Ų | 206 | 141 Ų | 141 | 95% | 0.954 | 83% | 0.833 | S | S | * | * | trans | -180 | 135.9 | 146.7 | -94.7 | -65.5 | 0 | 0 | 0 | 106.6 | ||||
| 320 | G | 36 | Very low | 36.9 | Very low | 76 Ų | 76 | 143.9 Ų | 143.9 | 78% | 0.784 | 83% | 0.831 | S | S | * | * | cis | -169.6 | 149.7 | 0.1 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 321 | E | 35 | Very low | 36.7 | Very low | 186 Ų | 186 | 141 Ų | 141 | 87% | 0.869 | 83% | 0.831 | S | S | * | * | trans | -78.6 | 148.9 | -175.9 | -59.5 | 167.8 | 140.6 | 0 | 0 | 112.8 | ||||
| 322 | I | 37.7 | Very low | 36.4 | Very low | 161 Ų | 161 | 142.3 Ų | 142.3 | 83% | 0.826 | 83% | 0.827 | S | S | * | * | trans | -149.1 | 120.3 | 135.5 | -55 | -177.7 | 0 | 0 | 0 | 108.3 | ||||
| 323 | P | 36.8 | Very low | 36.2 | Very low | 114 Ų | 114 | 138.9 Ų | 138.9 | 74% | 0.74 | 82% | 0.821 | S | S | * | * | trans | -109.8 | 135.8 | 158.4 | 33.9 | -22.1 | 0 | 0 | 0 | 110.8 | ||||
| 324 | M | 38.4 | Very low | 36.1 | Very low | 179 Ų | 179 | 146.7 Ų | 146.7 | 88% | 0.882 | 83% | 0.827 | S | S | * | * | trans | -117.5 | 129.1 | 168.6 | -86.1 | -95.2 | -73.2 | 0 | 0 | 109.7 | ||||
| 325 | T | 37.4 | Very low | 36.1 | Very low | 126 Ų | 126 | 147.2 Ų | 147.2 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | trans | -83.4 | 149 | -169.2 | 43.9 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 326 | A | 29.5 | Very low | 36.2 | Very low | 93 Ų | 93 | 152.4 Ų | 152.4 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | trans | 53.8 | 115.6 | 138.1 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 327 | S | 33.4 | Very low | 36.2 | Very low | 122 Ų | 122 | 156.8 Ų | 156.8 | 85% | 0.853 | 83% | 0.829 | S | S | * | * | -142.3 | 122.7 | 126.7 | -168.1 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 328 | T | 32.2 | Very low | 36.2 | Very low | 114 Ų | 114 | 160.4 Ų | 160.4 | 70% | 0.699 | 83% | 0.826 | S | S | * | * | trans | -79.3 | 132.9 | 175.1 | -58.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 329 | L | 34.2 | Very low | 36.1 | Very low | 172 Ų | 172 | 159.2 Ų | 159.2 | 90% | 0.901 | 82% | 0.823 | S | S | * | * | trans | -159.8 | 115.2 | 140.8 | -105.5 | 164.1 | 0 | 0 | 0 | 110.2 | ||||
| 330 | R | 35.5 | Very low | 36.1 | Very low | 224 Ų | 224 | 157 Ų | 157 | 85% | 0.845 | 82% | 0.818 | S | S | * | * | trans | -75 | 132.8 | 172.8 | -67.4 | 173.9 | 175.9 | -160.3 | -2 | 109 | ||||
| 331 | S | 33.5 | Very low | 36.2 | Very low | 114 Ų | 114 | 159.6 Ų | 159.6 | 80% | 0.797 | 82% | 0.818 | S | S | * | * | trans | -137.2 | 103.6 | 149.9 | 56.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 332 | H | 36.4 | Very low | 36.4 | Very low | 176 Ų | 176 | 156.9 Ų | 156.9 | 82% | 0.815 | 81% | 0.814 | S | S | * | * | trans | -76.9 | 113.9 | 163.7 | -91.7 | -66.1 | 0 | 0 | 0 | 108 | ||||
| 333 | V | 35.9 | Very low | 36.4 | Very low | 118 Ų | 118 | 154.1 Ų | 154.1 | 72% | 0.715 | 81% | 0.809 | S | S | * | * | trans | -106.5 | 96.4 | 159.2 | 179.8 | 0 | 0 | 0 | 0 | 107.8 | L335 | V333-L335 HydrophobicContact CG1-CD1 4.16Å; V333-L335 HydrophobicContact CG1-CG 4.05Å; V333-L335 PolarHBondContact O-N 3.2Å | ||
| 334 | R | 35.8 | Very low | 36.7 | Very low | 241 Ų | 241 | 156.8 Ų | 156.8 | 91% | 0.909 | 81% | 0.812 | S | S | * | * | trans | -74.6 | 105.4 | 160.6 | -93 | 178.7 | 170.1 | 153.3 | -3 | 107.3 | ||||
| 335 | L | 38.2 | Very low | 37 | Very low | 161 Ų | 161 | 157.5 Ų | 157.5 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -92.6 | 123.9 | 161.3 | -88.9 | 161 | 0 | 0 | 0 | 110 | V333 | V333-L335 HydrophobicContact CG1-CD1 4.16Å; V333-L335 HydrophobicContact CG1-CG 4.05Å; V333-L335 PolarHBondContact O-N 3.2Å |
| 336 | K | 39.9 | Very low | 37.2 | Very low | 185 Ų | 185 | 160.6 Ų | 160.6 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 120.3 | -172.8 | -132 | 162.4 | 178.3 | 170.1 | 0 | 109.9 | R338 | K336-R338 PolarHBondContact O-N 3.01Š|
| 337 | R | 37.3 | Very low | 37.9 | Very low | 250 Ų | 250 | 162.6 Ų | 162.6 | 94% | 0.943 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 116.2 | 157.4 | -78.9 | -177.9 | 172.1 | 156.1 | -2.1 | 107.8 | ||
| 338 | R | 39 | Very low | 38.2 | Very low | 224 Ų | 224 | 162 Ų | 162 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | trans | -103.8 | 114.9 | 160 | -87.7 | -175.5 | 162.4 | 174.2 | -4.6 | 107.9 | K336 | K336-R338 PolarHBondContact O-N 3.01Š| ||
| 339 | S | 36.5 | Very low | 39 | Very low | 101 Ų | 101 | 162.4 Ų | 162.4 | 71% | 0.706 | 82% | 0.816 | S | S | * | * | trans | -66.9 | 131.3 | 165.5 | 54.3 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 340 | N | 39.2 | Very low | 39.4 | Very low | 160 Ų | 160 | 163.1 Ų | 163.1 | 86% | 0.856 | 81% | 0.812 | S | S | * | * | trans | -125.4 | 97.1 | 149.9 | -85.2 | -10.2 | 0 | 0 | 0 | 106.2 | ||||
| 341 | V | 38.1 | Very low | 39.8 | Very low | 130 Ų | 130 | 158.9 Ų | 158.9 | 79% | 0.788 | 81% | 0.806 | S | S | * | * | trans | -90 | 112.2 | 159.7 | 172.3 | 0 | 0 | 0 | 0 | 104.7 | ||||
| 342 | V | 40 | Very low | 40.4 | Very low | 130 Ų | 130 | 162.7 Ų | 162.7 | 79% | 0.788 | 81% | 0.808 | S | S | * | * | trans | -108.2 | 116.1 | 165.5 | 175.2 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 343 | S | 37.6 | Very low | 40.7 | Very low | 103 Ų | 103 | 164.2 Ų | 164.2 | 72% | 0.72 | 81% | 0.812 | S | S | * | * | trans | -112.1 | 111.2 | 170.2 | 55.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 344 | E | 42.1 | Very low | 41.1 | Very low | 170 Ų | 170 | 163.9 Ų | 163.9 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | -143.2 | 105.5 | 159.4 | -74.3 | -164.4 | 150.1 | 0 | 0 | 106.3 | ||||
| 345 | K | 45.7 | Very low | 41.3 | Very low | 194 Ų | 194 | 161.7 Ų | 161.7 | 84% | 0.843 | 82% | 0.815 | S | S | * | * | 79.4 | 111.9 | 100.5 | -96.3 | -178.6 | 176.8 | 174.5 | 0 | 113.6 | |||||
| 346 | E | 42.1 | Very low | 41.4 | Very low | 190 Ų | 190 | 158.7 Ų | 158.7 | 89% | 0.888 | 81% | 0.814 | S | S | * | * | trans | -28.8 | 132.1 | 160.5 | -66.7 | 169 | 125.9 | 0 | 0 | 115.2 | ||||
| 347 | V | 43.2 | Very low | 41.2 | Very low | 135 Ų | 135 | 155.2 Ų | 155.2 | 82% | 0.818 | 81% | 0.813 | S | S | * | * | trans | -138.9 | 110.8 | 140.3 | 178 | 0 | 0 | 0 | 0 | 107.9 | V349 | V347-V349 HydrophobicContact CG1-CG2 3.98Š| ||
| 348 | S | 40 | Very low | 41.6 | Very low | 111 Ų | 111 | 149 Ų | 149 | 78% | 0.776 | 81% | 0.805 | S | S | * | * | trans | -89 | 123 | 165.3 | 123.6 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 349 | V | 49.8 | Very low | 41.5 | Very low | 122 Ų | 122 | 144.3 Ų | 144.3 | 74% | 0.739 | 80% | 0.801 | S | S | * | * | trans | -133.9 | 116.6 | 160 | 177.3 | 0 | 0 | 0 | 0 | 108.4 | V347 | V347-V349 HydrophobicContact CG1-CG2 3.98Š| ||
| 350 | K | 40.9 | Very low | 41.7 | Very low | 186 Ų | 186 | 147.1 Ų | 147.1 | 81% | 0.809 | 81% | 0.807 | S | S | * | * | trans | -73.2 | 135.8 | 164.6 | -75.8 | 171.9 | 171.2 | 172.5 | 0 | 108.7 | ||||
| 351 | D | 45.7 | Very low | 41.8 | Very low | 136 Ų | 136 | 148.1 Ų | 148.1 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | trans | -165.6 | 108.2 | 142.5 | -89.6 | -34.9 | 0 | 0 | 0 | 107.9 | ||||
| 352 | K | 46.1 | Very low | 41.8 | Very low | 193 Ų | 193 | 153.9 Ų | 153.9 | 84% | 0.839 | 81% | 0.811 | S | S | * | * | 74.3 | 102.3 | 95.7 | -78.8 | -175.9 | 179.7 | 171.1 | 0 | 115.3 | |||||
| 353 | K | 42.6 | Very low | 41.8 | Very low | 208 Ų | 208 | 153.8 Ų | 153.8 | 90% | 0.904 | 81% | 0.81 | S | S | * | * | trans | 19.2 | 122.1 | 137.6 | -81.5 | -179.4 | 168.6 | -177.9 | 0 | 119.7 | ||||
| 354 | S | 44.3 | Very low | 41.7 | Very low | 111 Ų | 111 | 152.2 Ų | 152.2 | 78% | 0.776 | 81% | 0.811 | S | S | * | * | 168.1 | 106.2 | 124.5 | 53.1 | 0 | 0 | 0 | 0 | 107.5 | |||||
| 355 | E | 40 | Very low | 41.5 | Very low | 195 Ų | 195 | 151.4 Ų | 151.4 | 91% | 0.911 | 81% | 0.81 | S | S | * | * | 56.3 | 99.5 | 86.7 | -158.3 | 172.1 | -145.5 | 0 | 0 | 113.4 | |||||
| 356 | A | 39.5 | Very low | 41.1 | Very low | 99 Ų | 99 | 147.2 Ų | 147.2 | 82% | 0.818 | 81% | 0.805 | S | S | * | * | trans | 170.3 | 113.1 | 141.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 357 | S | 35.9 | Very low | 41.3 | Very low | 112 Ų | 112 | 145.7 Ų | 145.7 | 78% | 0.783 | 80% | 0.802 | S | S | * | * | trans | -71.2 | 147.5 | 165.6 | -52.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 358 | P | 45.8 | Very low | 41 | Very low | 119 Ų | 119 | 146.2 Ų | 146.2 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | -102.9 | 104.8 | 154.4 | 27 | -14.2 | 0 | 0 | 0 | 110.3 | I360 | P358-I360 PolarHBondContact O-N 2.83Š| ||
| 359 | T | 36.1 | Very low | 41.2 | Very low | 125 Ų | 125 | 149.7 Ų | 149.7 | 77% | 0.767 | 80% | 0.804 | S | S | * | * | trans | -62.9 | 110.3 | 160.4 | -50.8 | 0 | 0 | 0 | 0 | 108.7 | K361 | T359-K361 PolarHBondContact O-N 3.2Š| ||
| 360 | I | 41.3 | Very low | 40.6 | Very low | 160 Ų | 160 | 152.4 Ų | 152.4 | 82% | 0.821 | 81% | 0.809 | S | S | * | * | trans | -75.7 | 109.8 | 171 | -64.3 | 176.2 | 0 | 0 | 0 | 107.9 | P358 | P358-I360 PolarHBondContact O-N 2.83Š| ||
| 361 | K | 40.6 | Very low | 40.7 | Very low | 181 Ų | 181 | 150.8 Ų | 150.8 | 79% | 0.787 | 81% | 0.807 | S | S | * | * | trans | -65.2 | 125.3 | 177 | -69.9 | 175.7 | 176 | 177.1 | 0 | 110.3 | T359 V363 | T359-K361 PolarHBondContact O-N 3.2Å; K361-V363 PolarHBondContact O-N 3.34Å | ||
| 362 | R | 38.3 | Very low | 40.4 | Very low | 251 Ų | 251 | 149.8 Ų | 149.8 | 95% | 0.947 | 81% | 0.806 | S | S | * | * | trans | -63 | 120.4 | 157.9 | -83.7 | 179.2 | 173.5 | 164.6 | -2.6 | 108.5 | ||||
| 363 | V | 40.7 | Very low | 39.9 | Very low | 128 Ų | 128 | 148.4 Ų | 148.4 | 78% | 0.776 | 81% | 0.808 | S | S | * | * | trans | -90.6 | 115.6 | 161.1 | 173.7 | 0 | 0 | 0 | 0 | 106.5 | K361 | K361-V363 PolarHBondContact O-N 3.34Š| ||
| 364 | G | 34.7 | Very low | 39.6 | Very low | 71 Ų | 71 | 142.8 Ų | 142.8 | 73% | 0.732 | 80% | 0.801 | S | S | * | * | trans | -81.5 | 144.9 | 168.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 365 | I | 37.3 | Very low | 39.4 | Very low | 152 Ų | 152 | 143.4 Ų | 143.4 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | trans | -132.3 | 105.5 | 158.6 | -43.2 | 174.9 | 0 | 0 | 0 | 104.7 | ||||
| 366 | S | 38.8 | Very low | 39.4 | Very low | 106 Ų | 106 | 139.4 Ų | 139.4 | 74% | 0.741 | 79% | 0.793 | S | S | * | * | trans | -84.7 | 134.5 | 166.3 | 49.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 367 | I | 45.6 | Very low | 39.2 | Very low | 158 Ų | 158 | 137.9 Ų | 137.9 | 81% | 0.81 | 79% | 0.787 | S | S | * | * | trans | -127 | 99.4 | 160.8 | -61.7 | 173.8 | 0 | 0 | 0 | 105.5 | ||||
| 368 | D | 37.6 | Very low | 39.1 | Very low | 147 Ų | 147 | 140.3 Ų | 140.3 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | trans | -74.6 | 135.6 | 153.4 | -74.6 | -41.2 | 0 | 0 | 0 | 107.5 | ||||
| 369 | E | 44.2 | Very low | 38.7 | Very low | 184 Ų | 184 | 139.4 Ų | 139.4 | 86% | 0.86 | 78% | 0.783 | S | S | * | * | -179.3 | 108 | 127.5 | -103.6 | 176.9 | 165 | 0 | 0 | 110.9 | |||||
| 370 | E | 36.8 | Very low | 38.8 | Very low | 178 Ų | 178 | 142.5 Ų | 142.5 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | trans | -28.2 | 138 | 147.3 | -175.5 | 176.2 | -164.6 | 0 | 0 | 115 | ||||
| 371 | I | 42 | Very low | 38.5 | Very low | 152 Ų | 152 | 139.3 Ų | 139.3 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | trans | -169.4 | 100.6 | 148 | -90.4 | 145.7 | 0 | 0 | 0 | 110 | ||||
| 372 | T | 40.3 | Very low | 38.5 | Very low | 115 Ų | 115 | 138.7 Ų | 138.7 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | trans | 44.4 | 118.9 | 134.7 | 64.1 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 373 | N | 35.4 | Very low | 38.3 | Very low | 165 Ų | 165 | 135.7 Ų | 135.7 | 88% | 0.882 | 78% | 0.783 | S | S | * | * | 18.6 | 123.3 | 125 | -67.8 | -19.4 | 0 | 0 | 0 | 121.2 | |||||
| 374 | A | 37.2 | Very low | 38.2 | Very low | 90 Ų | 90 | 134.3 Ų | 134.3 | 74% | 0.744 | 78% | 0.779 | S | S | * | * | trans | 164.1 | 139 | 136.5 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 375 | T | 39.4 | Very low | 38.2 | Very low | 124 Ų | 124 | 137.9 Ų | 137.9 | 76% | 0.761 | 78% | 0.781 | S | S | * | * | cis | -175.9 | 143 | 39 | -18.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 376 | S | 40.3 | Very low | 38.2 | Very low | 111 Ų | 111 | 138.4 Ų | 138.4 | 78% | 0.776 | 78% | 0.784 | S | S | * | * | trans | 35.7 | 135.6 | 141.3 | 66 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 377 | G | 34.6 | Very low | 38.2 | Very low | 66 Ų | 66 | 138.7 Ų | 138.7 | 68% | 0.68 | 78% | 0.781 | S | S | * | * | cis | 123.8 | 139.5 | 24.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 378 | L | 34.6 | Very low | 37.7 | Very low | 164 Ų | 164 | 137 Ų | 137 | 86% | 0.859 | 78% | 0.778 | S | S | * | * | trans | 70.8 | 139.1 | 159.6 | -108.2 | 74.7 | 0 | 0 | 0 | 117.1 | ||||
| 379 | T | 36.2 | Very low | 37.8 | Very low | 100 Ų | 100 | 136.5 Ų | 136.5 | 61% | 0.613 | 78% | 0.776 | S | S | * | * | cis | -172.7 | 145.9 | 21 | -8.6 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 380 | K | 38.8 | Very low | 37.5 | Very low | 189 Ų | 189 | 138.7 Ų | 138.7 | 82% | 0.822 | 78% | 0.776 | S | S | * | * | trans | 64 | 104.5 | 138.8 | -71.3 | 176.3 | -171.1 | 178.8 | 0 | 123.1 | ||||
| 381 | A | 34.4 | Very low | 37.1 | Very low | 94 Ų | 94 | 133.5 Ų | 133.5 | 78% | 0.777 | 77% | 0.771 | S | S | * | * | 23.2 | 126.1 | 117.1 | 0 | 0 | 0 | 0 | 0 | 120.7 | |||||
| 382 | I | 40.4 | Very low | 37 | Very low | 167 Ų | 167 | 134.3 Ų | 134.3 | 86% | 0.856 | 78% | 0.775 | S | S | * | * | trans | -146.5 | 115.8 | 138.8 | -57.3 | -175.1 | 0 | 0 | 0 | 109.3 | ||||
| 383 | H | 34.9 | Very low | 36.7 | Very low | 188 Ų | 188 | 135.1 Ų | 135.1 | 87% | 0.87 | 78% | 0.775 | S | S | * | * | trans | -85.4 | 136.5 | 156.5 | -93.7 | -78.7 | 0 | 0 | 0 | 108.3 | ||||
| 384 | S | 39.2 | Very low | 37.1 | Very low | 99 Ų | 99 | 132.4 Ų | 132.4 | 69% | 0.692 | 77% | 0.766 | S | S | * | * | trans | 173.8 | 119.4 | 132.1 | 40.4 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 385 | D | 33.9 | Very low | 36.9 | Very low | 146 Ų | 146 | 134 Ų | 134 | 78% | 0.781 | 76% | 0.761 | S | S | * | * | 36.2 | 143.2 | 129.9 | -54.2 | -24.6 | 0 | 0 | 0 | 122.5 | |||||
| 386 | I | 37.5 | Very low | 36.7 | Very low | 163 Ų | 163 | 134.7 Ų | 134.7 | 84% | 0.836 | 76% | 0.76 | S | S | * | * | trans | 139.8 | 131.2 | 144.3 | -72.5 | 160 | 0 | 0 | 0 | 108.9 | ||||
| 387 | V | 37.7 | Very low | 36.3 | Very low | 113 Ų | 113 | 136.6 Ų | 136.6 | 69% | 0.685 | 76% | 0.761 | S | S | * | * | cis | 179.3 | 134.8 | -19.9 | 129.9 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 388 | T | 36 | Very low | 36.2 | Very low | 121 Ų | 121 | 138.5 Ų | 138.5 | 74% | 0.742 | 76% | 0.764 | S | S | * | * | trans | 35.7 | 128.4 | 153.9 | 67 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 389 | D | 39.2 | Very low | 36.2 | Very low | 138 Ų | 138 | 139.2 Ų | 139.2 | 74% | 0.738 | 77% | 0.768 | S | S | * | * | -149.4 | 117.8 | 115.9 | -134.1 | -5.5 | 0 | 0 | 0 | 114 | |||||
| 390 | R | 37.6 | Very low | 36.1 | Very low | 229 Ų | 229 | 142.9 Ų | 142.9 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | trans | 17.9 | 113.7 | 150.5 | -61.2 | 168.3 | -159.2 | -136.4 | -1.4 | 120.7 | ||||
| 391 | G | 29.8 | Very low | 35.8 | Very low | 70 Ų | 70 | 143.1 Ų | 143.1 | 72% | 0.722 | 78% | 0.78 | S | S | * | * | 91.6 | 106.9 | 103.9 | 0 | 0 | 0 | 0 | 0 | 117.8 | |||||
| 392 | I | 39.6 | Very low | 35.8 | Very low | 169 Ų | 169 | 148.6 Ų | 148.6 | 87% | 0.867 | 79% | 0.786 | S | S | * | * | 167.6 | 109.9 | 123.1 | -79.8 | 153.4 | 0 | 0 | 0 | 106.7 | |||||
| 393 | D | 33.6 | Very low | 35.4 | Very low | 131 Ų | 131 | 150 Ų | 150 | 70% | 0.701 | 79% | 0.789 | S | S | * | * | trans | -64.9 | 146.4 | 170.1 | -93.2 | -40.2 | 0 | 0 | 0 | 111.4 | ||||
| 394 | P | 44 | Very low | 35.3 | Very low | 109 Ų | 109 | 149.6 Ų | 149.6 | 71% | 0.708 | 79% | 0.788 | S | S | * | * | trans | -126.3 | 78.1 | 130.3 | 35.3 | -23.8 | 0 | 0 | 0 | 109.8 | ||||
| 395 | I | 33.6 | Very low | 35 | Very low | 124 Ų | 124 | 152.2 Ų | 152.2 | 64% | 0.636 | 79% | 0.794 | S | S | * | * | trans | -65 | 126.9 | 144.7 | -61.2 | 170.3 | 0 | 0 | 0 | 105.1 | ||||
| 396 | N | 34.4 | Very low | 34.9 | Very low | 138 Ų | 138 | 151.7 Ų | 151.7 | 74% | 0.738 | 80% | 0.796 | S | S | * | * | trans | 89.7 | 84.1 | -172.2 | -52.7 | -27.2 | 0 | 0 | 0 | 114.3 | ||||
| 397 | N | 32.8 | Very low | 34.9 | Very low | 150 Ų | 150 | 149.2 Ų | 149.2 | 80% | 0.802 | 79% | 0.792 | S | S | * | * | trans | -159.1 | 113.4 | 137.2 | -91.5 | -28.6 | 0 | 0 | 0 | 111.1 | ||||
| 398 | S | 32.6 | Very low | 34.8 | Very low | 106 Ų | 106 | 153.2 Ų | 153.2 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | trans | 58 | 82.8 | 149.3 | 70 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 399 | L | 33.3 | Very low | 34.8 | Very low | 179 Ų | 179 | 156.3 Ų | 156.3 | 94% | 0.937 | 81% | 0.811 | S | S | * | * | trans | -125.9 | 49.4 | 145.5 | -146.7 | 93 | 0 | 0 | 0 | 109.6 | ||||
| 400 | E | 34 | Very low | 34.7 | Very low | 178 Ų | 178 | 153.2 Ų | 153.2 | 83% | 0.832 | 81% | 0.812 | S | S | * | * | trans | -110.9 | 70.7 | 168.8 | -77.6 | -170.9 | 161.8 | 0 | 0 | 108.7 | ||||
| 401 | F | 32.8 | Very low | 34.5 | Very low | 193 Ų | 193 | 151.4 Ų | 151.4 | 85% | 0.846 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -156.8 | 126.3 | 161 | -89.1 | -74.7 | 0 | 0 | 0 | 107.9 | ||
| 402 | F | 34 | Very low | 34.9 | Very low | 210 Ų | 210 | 151.4 Ų | 151.4 | 92% | 0.921 | 80% | 0.803 | S | S | * | * | S | Bend | trans | 96.5 | 25.9 | -179.2 | -63 | -78 | 0 | 0 | 0 | 119.5 | ||
| 403 | E | 32.4 | Very low | 35.2 | Very low | 196 Ų | 196 | 149.2 Ų | 149.2 | 92% | 0.916 | 80% | 0.801 | S | S | * | * | trans | -115.7 | 57 | 163.3 | -136.1 | 173 | -156.4 | 0 | 0 | 111.4 | ||||
| 404 | Q | 32.7 | Very low | 36.1 | Very low | 180 Ų | 180 | 151.7 Ų | 151.7 | 84% | 0.841 | 81% | 0.808 | S | S | * | * | trans | -152.5 | 90.4 | 167.7 | -111.4 | 167 | 10.9 | 0 | 0 | 107.5 | ||||
| 405 | D | 33.7 | Very low | 36.4 | Very low | 154 Ų | 154 | 151.6 Ų | 151.6 | 82% | 0.824 | 80% | 0.802 | S | S | * | * | trans | 173.6 | 49.3 | 151.5 | -85.9 | -14.7 | 0 | 0 | 0 | 110.6 | C407 | D405-C407 VanDerWaalsContact C-N 3.33Å; D405-C407 PolarHBondContact O-N 3.33Å | ||
| 406 | V | 31.9 | Very low | 37.2 | Very low | 134 Ų | 134 | 154.1 Ų | 154.1 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | trans | -94.6 | 74.4 | 160.8 | -175.3 | 0 | 0 | 0 | 0 | 106.9 | F408 | V406-F408 PolarHBondContact O-N 3.13Š| ||
| 407 | C | 36.7 | Very low | 38.1 | Very low | 112 Ų | 112 | 155.7 Ų | 155.7 | 76% | 0.757 | 81% | 0.806 | S | S | * | * | trans | -69.4 | 112.1 | 169.1 | -72.5 | 0 | 0 | 0 | 0 | 109.1 | D405 L409 | D405-C407 VanDerWaalsContact C-N 3.33Å; D405-C407 PolarHBondContact O-N 3.33Å; C407-L409 PolarHBondContact O-N 3.09Å | ||
| 408 | F | 35.2 | Very low | 39.2 | Very low | 196 Ų | 196 | 152.9 Ų | 152.9 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -47.8 | 126 | 168.6 | -93.9 | -103.8 | 0 | 0 | 0 | 111.4 | V406 G410 | V406-F408 PolarHBondContact O-N 3.13Å; F408-G410 PolarHBondContact O-N 3.12Å | ||
| 409 | L | 37.8 | Very low | 40.4 | Very low | 186 Ų | 186 | 153.9 Ų | 153.9 | 97% | 0.974 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.4 | 106.1 | 165 | -82.3 | 108.5 | 0 | 0 | 0 | 109.6 | C407 | C407-L409 PolarHBondContact O-N 3.09Š|
| 410 | G | 36 | Very low | 41.7 | Very low | 73 Ų | 73 | 150.9 Ų | 150.9 | 75% | 0.753 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 178.5 | -25.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 116.9 | F408 | F408-G410 PolarHBondContact O-N 3.12Š|
| 411 | Q | 34.2 | Very low | 43.3 | Very low | 191 Ų | 191 | 144 Ų | 144 | 89% | 0.893 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -142.5 | 116.6 | -173.2 | -67.6 | 178.3 | -0.4 | 0 | 0 | 111 | ||
| 412 | S | 38.4 | Very low | 45.1 | Very low | 71 Ų | 71 | 139.8 Ų | 139.8 | 50% | 0.497 | 74% | 0.735 | S | S | . | * | trans | 133.5 | 72.5 | 161 | -168 | 0 | 0 | 0 | 0 | 112.3 | Q414 | S412-Q414 VanDerWaalsContact C-N 3.28Š| ||
| 413 | C | 44.2 | Very low | 46.8 | Very low | 123 Ų | 123 | 137.8 Ų | 137.8 | 83% | 0.831 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -82.6 | -4.3 | 165.4 | -72.5 | 0 | 0 | 0 | 0 | 112.8 | ||
| 414 | Q | 52.6 | Low | 48.7 | Very low | 182 Ų | 182 | 135.2 Ų | 135.2 | 85% | 0.85 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -94 | -18.6 | -175.7 | -94.3 | 164.1 | -35.8 | 0 | 0 | 114.9 | S412 | S412-Q414 VanDerWaalsContact C-N 3.28Š|
| 415 | N | 51 | Low | 50.6 | Low | 108 Ų | 108 | 133 Ų | 133 | 58% | 0.578 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -87.4 | -13 | 176.4 | -91.1 | -2.7 | 0 | 0 | 0 | 115 | Q417 T418 E419 | N415-Q417 VanDerWaalsContact C-N 3.34Å; N415-Q417 PolarHBondContact O-N 2.94Å; N415-T418 PolarHBondContact O-N 3.43Å; N415-E419 PolarHBondContact O-N 3.01Å |
| 416 | R | 50 | Low | 52.6 | Low | 177 Ų | 177 | 130.6 Ų | 130.6 | 67% | 0.668 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -67.9 | -26.4 | -173.6 | -82.3 | -172.7 | 177.5 | -179.6 | 0.4 | 114.6 | L420 | R416-L420 WeakPolarHBondContact O-CB 3.45Å; R416-L420 WeakPolarHBondContact O-CD1 3.39Å; R416-L420 WeakPolarHBondContact O-CG 3.35Å; R416-L420 PolarHBondContact O-N 3.22Å |
| 417 | Q | 53.7 | Low | 54.7 | Low | 170 Ų | 170 | 129.9 Ų | 129.9 | 79% | 0.794 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -74.8 | -40.7 | 179.3 | -85.1 | 178.4 | -15.3 | 0 | 0 | 112.5 | N415 L420 G421 | N415-Q417 VanDerWaalsContact C-N 3.34Å; N415-Q417 PolarHBondContact O-N 2.94Å; Q417-L420 PolarHBondContact O-N 3.34Å; Q417-G421 PolarHBondContact O-N 3.3Å; Q417-G421 VanDerWaalsContact O-N 3.16Å |
| 418 | T | 56.5 | Low | 56.7 | Low | 91 Ų | 91 | 129.3 Ų | 129.3 | 56% | 0.558 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -68.8 | -37.9 | 177.5 | -34.9 | 0 | 0 | 0 | 0 | 111.4 | N415 G421 N422 | N415-T418 PolarHBondContact O-N 3.43Å; T418-G421 PolarHBondContact O-N 3.49Å; T418-N422 PolarHBondContact O-N 3.33Å; T418-N422 VanDerWaalsContact O-N 3.09Å |
| 419 | E | 57.1 | Low | 58.6 | Low | 127 Ų | 127 | 122.9 Ų | 122.9 | 59% | 0.593 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -69.2 | -34.3 | 178.9 | -153.6 | 176 | -165.8 | 0 | 0 | 112.5 | N415 R423 | N415-E419 PolarHBondContact O-N 3.01Å; E419-R423 WeakPolarHBondContact O-CB 3.35Å; E419-R423 PolarHBondContact O-N 3.28Å |
| 420 | L | 60.6 | Low | 60.4 | Low | 116 Ų | 116 | 117.6 Ų | 117.6 | 61% | 0.607 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -68.3 | -38.9 | 172.2 | -77.2 | 167.9 | 0 | 0 | 0 | 112.3 | R416 Q417 R423 Y424 | R416-L420 WeakPolarHBondContact O-CB 3.45Å; R416-L420 WeakPolarHBondContact O-CD1 3.39Å; R416-L420 WeakPolarHBondContact O-CG 3.35Å; R416-L420 PolarHBondContact O-N 3.22Å; Q417-L420 PolarHBondContact O-N 3.34Å; L420-R423 PolarHBondContact O-N 2.94Å; L420-Y424 WeakPolarHBondContact O-CB 3.28Å; L420-Y424 PolarHBondContact O-N 3.03Å |
| 421 | G | 67.8 | Low | 62.5 | Low | 35 Ų | 35 | 117.6 Ų | 117.6 | 36% | 0.361 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62.4 | -44.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q417 T418 Y424 Q425 | Q417-G421 PolarHBondContact O-N 3.3Å; Q417-G421 VanDerWaalsContact O-N 3.16Å; T418-G421 PolarHBondContact O-N 3.49Å; G421-Y424 PolarHBondContact O-N 3.29Å; G421-Q425 PolarHBondContact O-N 3.43Å; G421-Q425 VanDerWaalsContact O-N 3.07Å |
| 422 | N | 71 | Confident | 64.5 | Low | 104 Ų | 104 | 111 Ų | 111 | 56% | 0.556 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -68 | -39.6 | 178 | -70.1 | -9.9 | 0 | 0 | 0 | 112.3 | T418 Q425 L426 | T418-N422 PolarHBondContact O-N 3.33Å; T418-N422 VanDerWaalsContact O-N 3.09Å; N422-Q425 PolarHBondContact O-N 3.28Å; N422-L426 WeakPolarHBondContact O-CB 3.22Å; N422-L426 PolarHBondContact O-N 3.24Å |
| 423 | R | 70.5 | Confident | 66.4 | Low | 168 Ų | 168 | 113.8 Ų | 113.8 | 63% | 0.634 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -62.4 | -43.7 | 173.8 | -95.1 | -171.9 | 168.4 | -174.2 | -1.9 | 112.2 | E419 L420 L426 E427 | E419-R423 WeakPolarHBondContact O-CB 3.35Å; E419-R423 PolarHBondContact O-N 3.28Å; L420-R423 PolarHBondContact O-N 2.94Å; R423-L426 PolarHBondContact O-N 2.97Å; R423-E427 WeakPolarHBondContact O-CB 3.35Å; R423-E427 WeakPolarHBondContact O-CG 3.32Å; R423-E427 PolarHBondContact O-N 3.26Å |
| 424 | Y | 72 | Confident | 68.1 | Low | 142 Ų | 142 | 112.7 Ų | 112.7 | 56% | 0.557 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.1 | -42.1 | 179.7 | -174.9 | -107.1 | 0 | 0 | 0 | 112.1 | L420 G421 E427 Q428 | L420-Y424 WeakPolarHBondContact O-CB 3.28Å; L420-Y424 PolarHBondContact O-N 3.03Å; G421-Y424 PolarHBondContact O-N 3.29Å; Y424-E427 PolarHBondContact O-N 3.37Å; Y424-Q428 HydrophobicContact CE1-CG 4.31Å; Y424-Q428 WeakPolarHBondContact O-CG 3.16Å; Y424-Q428 PolarHBondContact O-N 3Å; Y424-Q428 PolarHBondContact OH-NE2 2.91Å |
| 425 | Q | 71.7 | Confident | 69.5 | Low | 134 Ų | 134 | 109.6 Ų | 109.6 | 63% | 0.626 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -64.7 | -40 | 173.9 | -73.6 | -174.1 | 2.1 | 0 | 0 | 112.5 | G421 N422 Q428 S429 | G421-Q425 PolarHBondContact O-N 3.43Å; G421-Q425 VanDerWaalsContact O-N 3.07Å; N422-Q425 PolarHBondContact O-N 3.28Å; Q425-Q428 PolarHBondContact O-N 3.49Å; Q425-S429 WeakPolarHBondContact O-CB 2.89Å; Q425-S429 PolarHBondContact O-N 3.44Å; Q425-S429 PolarHBondContact O-OG 2.91Å |
| 426 | L | 76 | Confident | 70.9 | Confident | 102 Ų | 102 | 111.1 Ų | 111.1 | 53% | 0.534 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.3 | -47 | 176.1 | -176.1 | 65.7 | 0 | 0 | 0 | 111.3 | N422 R423 Q428 S429 I430 | N422-L426 WeakPolarHBondContact O-CB 3.22Å; N422-L426 PolarHBondContact O-N 3.24Å; R423-L426 PolarHBondContact O-N 2.97Å; L426-Q428 VanDerWaalsContact C-N 3.33Å; L426-Q428 PolarHBondContact O-N 3.22Å; L426-S429 WeakPolarHBondContact CA-OG 3.39Å; L426-S429 PolarHBondContact O-N 3.1Å; L426-S429 VanDerWaalsContact O-N 3.16Å; L426-S429 PolarHBondContact O-OG 3.48Å; L426-I430 HydrophobicContact CD1-CD1 4.26Å; L426-I430 HydrophobicContact CG-CD1 3.98Å; L426-I430 WeakPolarHBondContact O-CG1 3.45Å; L426-I430 PolarHBondContact O-N 2.9Å |
| 427 | E | 76.5 | Confident | 72.3 | Confident | 119 Ų | 119 | 106.5 Ų | 106.5 | 56% | 0.556 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.7 | -40.8 | 176.6 | -75.9 | 178.6 | 179.2 | 0 | 0 | 112 | R423 Y424 T431 | R423-E427 WeakPolarHBondContact O-CB 3.35Å; R423-E427 WeakPolarHBondContact O-CG 3.32Å; R423-E427 PolarHBondContact O-N 3.26Å; Y424-E427 PolarHBondContact O-N 3.37Å; E427-T431 WeakPolarHBondContact O-CB 3.27Å; E427-T431 PolarHBondContact O-N 2.96Å; E427-T431 PolarHBondContact O-OG1 3.16Å |
| 428 | Q | 77.2 | Confident | 73.4 | Confident | 100 Ų | 100 | 104.3 Ų | 104.3 | 47% | 0.467 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.5 | -41.7 | 173.3 | -76 | -166.5 | -0.1 | 0 | 0 | 112.5 | Y424 Q425 L426 T431 A432 | Y424-Q428 HydrophobicContact CE1-CG 4.31Å; Y424-Q428 WeakPolarHBondContact O-CG 3.16Å; Y424-Q428 PolarHBondContact O-N 3Å; Y424-Q428 PolarHBondContact OH-NE2 2.91Å; Q425-Q428 PolarHBondContact O-N 3.49Å; L426-Q428 VanDerWaalsContact C-N 3.33Å; L426-Q428 PolarHBondContact O-N 3.22Å; Q428-T431 PolarHBondContact O-N 3.48Å; Q428-A432 WeakPolarHBondContact O-CB 3.47Å; Q428-A432 PolarHBondContact O-N 2.75Å |
| 429 | S | 76 | Confident | 74.6 | Confident | 62 Ų | 62 | 106.6 Ų | 106.6 | 43% | 0.434 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.2 | -40.1 | 179.5 | 70.5 | 0 | 0 | 0 | 0 | 112.7 | Q425 L426 A432 Q433 | Q425-S429 WeakPolarHBondContact O-CB 2.89Å; Q425-S429 PolarHBondContact O-N 3.44Å; Q425-S429 PolarHBondContact O-OG 2.91Å; L426-S429 WeakPolarHBondContact CA-OG 3.39Å; L426-S429 PolarHBondContact O-N 3.1Å; L426-S429 VanDerWaalsContact O-N 3.16Å; L426-S429 PolarHBondContact O-OG 3.48Å; S429-A432 PolarHBondContact O-N 3.32Å; S429-Q433 WeakPolarHBondContact O-CB 3.46Å; S429-Q433 PolarHBondContact O-N 3.29Å |
| 430 | I | 75.6 | Confident | 75.7 | Confident | 74 Ų | 74 | 106.3 Ų | 106.3 | 38% | 0.379 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.8 | -45.7 | 175.5 | -67.9 | 168.7 | 0 | 0 | 0 | 109.6 | L426 A432 Q433 E434 | L426-I430 HydrophobicContact CD1-CD1 4.26Å; L426-I430 HydrophobicContact CG-CD1 3.98Å; L426-I430 WeakPolarHBondContact O-CG1 3.45Å; L426-I430 PolarHBondContact O-N 2.9Å; I430-A432 VanDerWaalsContact C-N 3.32Å; I430-A432 PolarHBondContact O-N 3.01Å; I430-Q433 PolarHBondContact O-N 3.19Å; I430-E434 HydrophobicContact CG2-CG 4.34Å; I430-E434 WeakPolarHBondContact O-CB 3.38Å; I430-E434 WeakPolarHBondContact O-CG 3.44Å; I430-E434 PolarHBondContact O-N 3.4Å |
| 431 | T | 80.7 | Confident | 76.6 | Confident | 74 Ų | 74 | 106.8 Ų | 106.8 | 45% | 0.454 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.7 | -40.1 | 178.7 | -53.3 | 0 | 0 | 0 | 0 | 111.7 | E427 Q428 E434 M435 | E427-T431 WeakPolarHBondContact O-CB 3.27Å; E427-T431 PolarHBondContact O-N 2.96Å; E427-T431 PolarHBondContact O-OG1 3.16Å; Q428-T431 PolarHBondContact O-N 3.48Å; T431-E434 PolarHBondContact O-N 3.46Å; T431-M435 WeakPolarHBondContact O-CG 3.31Å; T431-M435 PolarHBondContact O-N 3.05Å |
| 432 | A | 76.4 | Confident | 77.2 | Confident | 53 Ų | 53 | 107.6 Ų | 107.6 | 44% | 0.438 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.2 | -43.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q428 S429 I430 E434 M435 E436 | Q428-A432 WeakPolarHBondContact O-CB 3.47Å; Q428-A432 PolarHBondContact O-N 2.75Å; S429-A432 PolarHBondContact O-N 3.32Å; I430-A432 VanDerWaalsContact C-N 3.32Å; I430-A432 PolarHBondContact O-N 3.01Å; A432-E434 VanDerWaalsContact C-N 3.34Å; A432-E434 PolarHBondContact O-N 3.45Å; A432-M435 PolarHBondContact O-N 2.8Å; A432-E436 PolarHBondContact O-N 3.47Å |
| 433 | Q | 78.4 | Confident | 77.5 | Confident | 128 Ų | 128 | 105.7 Ų | 105.7 | 60% | 0.598 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.6 | -38.2 | 177 | -171.8 | 179.3 | 5.6 | 0 | 0 | 112 | S429 I430 T437 | S429-Q433 WeakPolarHBondContact O-CB 3.46Å; S429-Q433 PolarHBondContact O-N 3.29Å; I430-Q433 PolarHBondContact O-N 3.19Å; Q433-T437 WeakPolarHBondContact O-CG2 3.46Å; Q433-T437 PolarHBondContact O-N 2.83Å; Q433-T437 PolarHBondContact O-OG1 3.41Å |
| 434 | E | 80 | Confident | 77.9 | Confident | 101 Ų | 101 | 101.1 Ų | 101.1 | 47% | 0.472 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.1 | -38.9 | 175 | -74.8 | -178.5 | 168.3 | 0 | 0 | 112.2 | I430 T431 A432 T437 F438 | I430-E434 HydrophobicContact CG2-CG 4.34Å; I430-E434 WeakPolarHBondContact O-CB 3.38Å; I430-E434 WeakPolarHBondContact O-CG 3.44Å; I430-E434 PolarHBondContact O-N 3.4Å; T431-E434 PolarHBondContact O-N 3.46Å; A432-E434 VanDerWaalsContact C-N 3.34Å; A432-E434 PolarHBondContact O-N 3.45Å; E434-T437 WeakPolarHBondContact CA-OG1 3.4Å; E434-T437 PolarHBondContact O-OG1 3.16Å; E434-F438 VanDerWaalsContact O-CB 3.3Å; E434-F438 WeakPolarHBondContact O-CB 3.49Å; E434-F438 PolarHBondContact O-N 3.25Å |
| 435 | M | 80.2 | Confident | 78 | Confident | 117 Ų | 117 | 98.9 Ų | 98.9 | 58% | 0.576 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -67 | -44.1 | 174.7 | -73.9 | -160.6 | -52.7 | 0 | 0 | 112.2 | T431 A432 T437 F438 E439 | T431-M435 WeakPolarHBondContact O-CG 3.31Å; T431-M435 PolarHBondContact O-N 3.05Å; A432-M435 PolarHBondContact O-N 2.8Å; M435-T437 VanDerWaalsContact C-N 3.35Å; M435-T437 PolarHBondContact O-N 3.08Å; M435-F438 PolarHBondContact O-N 3.02Å; M435-E439 WeakPolarHBondContact O-CG 3.45Å; M435-E439 PolarHBondContact O-N 3.48Å |
| 436 | E | 80.3 | Confident | 78 | Confident | 139 Ų | 139 | 94.4 Ų | 94.4 | 65% | 0.65 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.2 | -42.6 | 179 | -173.3 | 179.3 | -170.2 | 0 | 0 | 111.6 | A432 E439 L440 | A432-E436 PolarHBondContact O-N 3.47Å; E436-E439 PolarHBondContact O-N 3.3Å; E436-L440 WeakPolarHBondContact O-CB 3.49Å; E436-L440 PolarHBondContact O-N 3.49Å |
| 437 | T | 80.4 | Confident | 77.6 | Confident | 81 Ų | 81 | 92.4 Ų | 92.4 | 50% | 0.497 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.7 | -35.8 | 176.3 | 48.7 | 0 | 0 | 0 | 0 | 112.5 | Q433 E434 M435 F441 | Q433-T437 WeakPolarHBondContact O-CG2 3.46Å; Q433-T437 PolarHBondContact O-N 2.83Å; Q433-T437 PolarHBondContact O-OG1 3.41Å; E434-T437 WeakPolarHBondContact CA-OG1 3.4Å; E434-T437 PolarHBondContact O-OG1 3.16Å; M435-T437 VanDerWaalsContact C-N 3.35Å; M435-T437 PolarHBondContact O-N 3.08Å; T437-F441 WeakPolarHBondContact O-CB 3.26Å; T437-F441 PolarHBondContact O-N 3.21Å |
| 438 | F | 77.7 | Confident | 76.9 | Confident | 124 Ų | 124 | 91.1 Ų | 91.1 | 54% | 0.544 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -69.1 | -39.8 | 175 | -175.3 | -96.3 | 0 | 0 | 0 | 112.8 | E434 M435 F441 S442 | E434-F438 VanDerWaalsContact O-CB 3.3Å; E434-F438 WeakPolarHBondContact O-CB 3.49Å; E434-F438 PolarHBondContact O-N 3.25Å; M435-F438 PolarHBondContact O-N 3.02Å; F438-F441 PolarHBondContact O-N 2.89Å; F438-S442 WeakPolarHBondContact O-CB 3.41Å; F438-S442 PolarHBondContact O-N 2.84Å; F438-S442 PolarHBondContact O-OG 3.45Å |
| 439 | E | 80.4 | Confident | 75.9 | Confident | 139 Ų | 139 | 90.5 Ų | 90.5 | 65% | 0.65 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.9 | -43.6 | 173.7 | -76.4 | -173 | 174.3 | 0 | 0 | 111.3 | M435 E436 F441 S442 A443 | M435-E439 WeakPolarHBondContact O-CG 3.45Å; M435-E439 PolarHBondContact O-N 3.48Å; E436-E439 PolarHBondContact O-N 3.3Å; E439-F441 PolarHBondContact O-N 3.46Å; E439-S442 PolarHBondContact O-N 3.02Å; E439-A443 WeakPolarHBondContact O-CB 3.3Å; E439-A443 PolarHBondContact O-N 3.26Å |
| 440 | L | 81 | Confident | 75 | Confident | 121 Ų | 121 | 93.2 Ų | 93.2 | 63% | 0.634 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.4 | -42.1 | 175.8 | -172.7 | 68.2 | 0 | 0 | 0 | 111.8 | E436 T444 | E436-L440 WeakPolarHBondContact O-CB 3.49Å; E436-L440 PolarHBondContact O-N 3.49Å; L440-T444 WeakPolarHBondContact O-CB 3.44Å; L440-T444 PolarHBondContact O-N 3.49Å; L440-T444 PolarHBondContact O-OG1 3.44Å |
| 441 | F | 79.8 | Confident | 74 | Confident | 126 Ų | 126 | 96.3 Ų | 96.3 | 55% | 0.553 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63 | -44.9 | 174.9 | 179.5 | -100 | 0 | 0 | 0 | 111.6 | T437 F438 E439 T444 M445 | T437-F441 WeakPolarHBondContact O-CB 3.26Å; T437-F441 PolarHBondContact O-N 3.21Å; F438-F441 PolarHBondContact O-N 2.89Å; E439-F441 PolarHBondContact O-N 3.46Å; F441-T444 PolarHBondContact O-N 2.91Å; F441-M445 HydrophobicContact CD1-CG 4.27Å; F441-M445 HydrophobicContact CE1-CG 3.83Å; F441-M445 HydrophobicContact CE2-CG 4.11Å; F441-M445 HydrophobicContact CE2-SD 4.43Å; F441-M445 HydrophobicContact CZ-CG 3.74Å; F441-M445 HydrophobicContact CZ-SD 4.19Å; F441-M445 WeakPolarHBondContact O-CG 3.31Å; F441-M445 PolarHBondContact O-N 3.23Å |
| 442 | S | 79.1 | Confident | 72.5 | Confident | 52 Ų | 52 | 97.4 Ų | 97.4 | 36% | 0.364 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.9 | -41.4 | 178.5 | -59.9 | 0 | 0 | 0 | 0 | 112.1 | F438 E439 T444 M445 G446 | F438-S442 WeakPolarHBondContact O-CB 3.41Å; F438-S442 PolarHBondContact O-N 2.84Å; F438-S442 PolarHBondContact O-OG 3.45Å; E439-S442 PolarHBondContact O-N 3.02Å; S442-T444 VanDerWaalsContact C-N 3.32Å; S442-T444 PolarHBondContact O-N 3Å; S442-M445 PolarHBondContact O-N 3.4Å; S442-G446 PolarHBondContact O-N 3.28Å |
| 443 | A | 77.5 | Confident | 71.6 | Confident | 63 Ų | 63 | 106.2 Ų | 106.2 | 52% | 0.521 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -63.5 | -38.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | E439 S447 | E439-A443 WeakPolarHBondContact O-CB 3.3Å; E439-A443 PolarHBondContact O-N 3.26Å; A443-S447 WeakPolarHBondContact O-CB 3.45Å; A443-S447 PolarHBondContact O-N 3.14Å; A443-S447 PolarHBondContact O-OG 3.28Å |
| 444 | T | 78.6 | Confident | 70.5 | Confident | 72 Ų | 72 | 109.3 Ų | 109.3 | 44% | 0.442 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -67.1 | -44 | 176.4 | -54.7 | 0 | 0 | 0 | 0 | 111.1 | L440 F441 S442 S447 V448 | L440-T444 WeakPolarHBondContact O-CB 3.44Å; L440-T444 PolarHBondContact O-N 3.49Å; L440-T444 PolarHBondContact O-OG1 3.44Å; F441-T444 PolarHBondContact O-N 2.91Å; S442-T444 VanDerWaalsContact C-N 3.32Å; S442-T444 PolarHBondContact O-N 3Å; T444-S447 WeakPolarHBondContact CA-OG 3.35Å; T444-S447 PolarHBondContact O-N 2.92Å; T444-S447 PolarHBondContact O-OG 3.02Å; T444-V448 WeakPolarHBondContact O-CG2 3.2Å; T444-V448 PolarHBondContact O-N 3.22Å; T444-V448 VanDerWaalsContact O-N 3.08Å |
| 445 | M | 75.4 | Confident | 69.3 | Low | 96 Ų | 96 | 112.4 Ų | 112.4 | 47% | 0.473 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -69.4 | -35.6 | 178.1 | -70.7 | -61.9 | -63.6 | 0 | 0 | 112.6 | F441 S442 V448 S449 | F441-M445 HydrophobicContact CD1-CG 4.27Å; F441-M445 HydrophobicContact CE1-CG 3.83Å; F441-M445 HydrophobicContact CE2-CG 4.11Å; F441-M445 HydrophobicContact CE2-SD 4.43Å; F441-M445 HydrophobicContact CZ-CG 3.74Å; F441-M445 HydrophobicContact CZ-SD 4.19Å; F441-M445 WeakPolarHBondContact O-CG 3.31Å; F441-M445 PolarHBondContact O-N 3.23Å; S442-M445 PolarHBondContact O-N 3.4Å; M445-V448 PolarHBondContact O-N 3.25Å; M445-S449 PolarHBondContact O-N 3.05Å; M445-S449 PolarHBondContact O-OG 3.05Å |
| 446 | G | 70.9 | Confident | 68.1 | Low | 40 Ų | 40 | 113.1 Ų | 113.1 | 41% | 0.412 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -66.1 | -37 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | S442 S449 T450 | S442-G446 PolarHBondContact O-N 3.28Å; G446-S449 PolarHBondContact O-N 2.66Å; G446-T450 PolarHBondContact O-OG1 2.93Å |
| 447 | S | 66.8 | Low | 66.9 | Low | 60 Ų | 60 | 115.8 Ų | 115.8 | 42% | 0.42 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -74.1 | -30.7 | 175.6 | 43.7 | 0 | 0 | 0 | 0 | 113.1 | A443 T444 S449 T450 | A443-S447 WeakPolarHBondContact O-CB 3.45Å; A443-S447 PolarHBondContact O-N 3.14Å; A443-S447 PolarHBondContact O-OG 3.28Å; T444-S447 WeakPolarHBondContact CA-OG 3.35Å; T444-S447 PolarHBondContact O-N 2.92Å; T444-S447 PolarHBondContact O-OG 3.02Å; S447-S449 VanDerWaalsContact C-N 3.27Å; S447-S449 PolarHBondContact O-N 3.04Å; S447-T450 PolarHBondContact O-N 3.12Å; S447-T450 PolarHBondContact O-OG1 3.23Å |
| 448 | V | 62.2 | Low | 65.5 | Low | 92 Ų | 92 | 121.1 Ų | 121.1 | 56% | 0.558 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -68.5 | -28.5 | 172 | 174.3 | 0 | 0 | 0 | 0 | 112 | T444 M445 T450 | T444-V448 WeakPolarHBondContact O-CG2 3.2Å; T444-V448 PolarHBondContact O-N 3.22Å; T444-V448 VanDerWaalsContact O-N 3.08Å; M445-V448 PolarHBondContact O-N 3.25Å; V448-T450 VanDerWaalsContact C-N 3.31Å; V448-T450 PolarHBondContact O-N 3.47Å |
| 449 | S | 57.4 | Low | 64 | Low | 87 Ų | 87 | 121 Ų | 121 | 61% | 0.608 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.8 | -8.9 | -179.1 | -54.8 | 0 | 0 | 0 | 0 | 114.2 | M445 G446 S447 | M445-S449 PolarHBondContact O-N 3.05Å; M445-S449 PolarHBondContact O-OG 3.05Å; G446-S449 PolarHBondContact O-N 2.66Å; S447-S449 VanDerWaalsContact C-N 3.27Å; S447-S449 PolarHBondContact O-N 3.04Å |
| 450 | T | 55.5 | Low | 62.6 | Low | 119 Ų | 119 | 127.3 Ų | 127.3 | 73% | 0.73 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.1 | 1.6 | 178.2 | 38.3 | 0 | 0 | 0 | 0 | 113.5 | G446 S447 V448 | G446-T450 PolarHBondContact O-OG1 2.93Å; S447-T450 PolarHBondContact O-N 3.12Å; S447-T450 PolarHBondContact O-OG1 3.23Å; V448-T450 VanDerWaalsContact C-N 3.31Å; V448-T450 PolarHBondContact O-N 3.47Å |
| 451 | I | 55.1 | Low | 61.7 | Low | 139 Ų | 139 | 127.7 Ų | 127.7 | 71% | 0.713 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -99.4 | 1.2 | -174.9 | -66.1 | 172.9 | 0 | 0 | 0 | 113 | ||
| 452 | T | 50.3 | Low | 60.7 | Low | 96 Ų | 96 | 127.7 Ų | 127.7 | 59% | 0.589 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -132.3 | 126.1 | 174.4 | 50.4 | 0 | 0 | 0 | 0 | 107.9 | ||
| 453 | W | 56.4 | Low | 59.7 | Low | 238 Ų | 238 | 131.9 Ų | 131.9 | 90% | 0.902 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 145 | -14 | 158.8 | -77.3 | 106.7 | 0 | 0 | 0 | 114.7 | ||
| 454 | E | 56 | Low | 58.6 | Low | 194 Ų | 194 | 136 Ų | 136 | 91% | 0.907 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -100.9 | -6.5 | -176 | -78.6 | -174.6 | 163.6 | 0 | 0 | 117.5 | ||
| 455 | D | 53.9 | Low | 57.4 | Low | 166 Ų | 166 | 140 Ų | 140 | 89% | 0.888 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -108.8 | 31.6 | -173.5 | -75.5 | -22.9 | 0 | 0 | 0 | 115.6 | ||
| 456 | T | 55.1 | Low | 56.2 | Low | 131 Ų | 131 | 142.9 Ų | 142.9 | 80% | 0.804 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -128 | 28.1 | -175.6 | -17.9 | 0 | 0 | 0 | 0 | 117.1 | ||
| 457 | E | 55 | Low | 55.1 | Low | 196 Ų | 196 | 150.3 Ų | 150.3 | 92% | 0.916 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -128.2 | 7.5 | 176.1 | -73.6 | -159.1 | 161.8 | 0 | 0 | 117.5 | ||
| 458 | E | 50.7 | Low | 54.2 | Low | 193 Ų | 193 | 157.2 Ų | 157.2 | 90% | 0.902 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -119.3 | 75.1 | 174.1 | -81.2 | -171.9 | 152.9 | 0 | 0 | 112.9 | ||
| 459 | S | 45.9 | Very low | 53.6 | Low | 122 Ų | 122 | 162.7 Ų | 162.7 | 85% | 0.853 | 84% | 0.84 | S | S | * | * | trans | -173.8 | 73.4 | 154 | -91.8 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 460 | Q | 51.5 | Low | 53.2 | Low | 271 Ų | 271 | 169.5 Ų | 169.5 | 100% | 1.266 | 86% | 0.861 | S | S | * | * | trans | -149 | 0 | 145.1 | -87 | -167.1 | -28.6 | 0 | 0 | 106.7 |
Retrieved 460 of 460 residues in 354.7 ms
(Link to these results)