| 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 | 49.3 | Very low | 57.7 | Low | 248 Ų | 248 | 142.8 Ų | 142.8 | 100% | 1.222 | 85% | 0.851 | S | S | * | * | 0 | 119.1 | 0 | -61.6 | 172.5 | -176.1 | 0 | 0 | 107.1 | |||||
| 2 | M | 47.8 | Very low | 57.2 | Low | 193 Ų | 193 | 142.1 Ų | 142.1 | 95% | 0.951 | 85% | 0.848 | S | S | * | * | trans | -116.8 | 130.6 | 177.6 | -69.9 | -164.8 | 175.1 | 0 | 0 | 109.4 | ||||
| 3 | A | 61.3 | Low | 56.4 | Low | 102 Ų | 102 | 145.3 Ų | 145.3 | 84% | 0.843 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 127.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 4 | A | 61.5 | Low | 56 | Low | 93 Ų | 93 | 147.2 Ų | 147.2 | 77% | 0.769 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 139.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 5 | P | 63.8 | Low | 55.9 | Low | 118 Ų | 118 | 146.3 Ų | 146.3 | 77% | 0.766 | 85% | 0.851 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 156.9 | -177.2 | 28.7 | -35.1 | 0 | 0 | 0 | 112.8 | ||
| 6 | P | 72.3 | Confident | 56.2 | Low | 117 Ų | 117 | 144.2 Ų | 144.2 | 76% | 0.76 | 84% | 0.843 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 149.6 | -178 | 28.3 | -35.5 | 0 | 0 | 0 | 112.9 | ||
| 7 | P | 59.4 | Low | 56.9 | Low | 117 Ų | 117 | 142.7 Ų | 142.7 | 76% | 0.76 | 84% | 0.839 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 150.7 | -178.9 | 29.7 | -35.6 | 0 | 0 | 0 | 113 | ||
| 8 | P | 57.2 | Low | 57.4 | Low | 112 Ų | 112 | 141.4 Ų | 141.4 | 73% | 0.727 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -73 | 156.5 | -179.5 | 30.5 | -35.8 | 0 | 0 | 0 | 113 | L10 | P8-L10 PolarHBondContact O-N 3.25Š|
| 9 | P | 61.1 | Low | 57.9 | Low | 123 Ų | 123 | 140 Ų | 140 | 80% | 0.799 | 83% | 0.831 | S | S | * | * | trans | -70.7 | 112.8 | -178.9 | 28.2 | -34.4 | 0 | 0 | 0 | 112.1 | M11 | P9-M11 PolarHBondContact O-N 3.47Š| ||
| 10 | L | 54.2 | Low | 58.6 | Low | 160 Ų | 160 | 139.3 Ų | 139.3 | 84% | 0.838 | 83% | 0.83 | S | S | * | * | trans | -72 | 106.3 | 171.6 | -83.7 | 168.1 | 0 | 0 | 0 | 111.2 | P8 T12 | P8-L10 PolarHBondContact O-N 3.25Å; L10-T12 PolarHBondContact O-N 3.26Å; L10-T12 PolarHBondContact O-OG1 3.44Å | ||
| 11 | M | 47.3 | Very low | 59.1 | Low | 188 Ų | 188 | 140.2 Ų | 140.2 | 93% | 0.926 | 83% | 0.83 | S | S | * | * | trans | -56.2 | 100.4 | 167.8 | -69.8 | -110.6 | 165.6 | 0 | 0 | 110.3 | P9 | P9-M11 PolarHBondContact O-N 3.47Š| ||
| 12 | T | 51.1 | Low | 60 | Low | 134 Ų | 134 | 133.9 Ų | 133.9 | 82% | 0.822 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -102.1 | 124.8 | 176.4 | 19.8 | 0 | 0 | 0 | 0 | 110.5 | L10 | L10-T12 PolarHBondContact O-N 3.26Å; L10-T12 PolarHBondContact O-OG1 3.44Å |
| 13 | Q | 46.4 | Very low | 60.5 | Low | 184 Ų | 184 | 131.1 Ų | 131.1 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 148.2 | -167.2 | -62 | 174 | 10.2 | 0 | 0 | 114.2 | T15 | Q13-T15 PolarHBondContact O-N 2.96Š|
| 14 | L | 51.6 | Low | 59.9 | Low | 172 Ų | 172 | 134.2 Ų | 134.2 | 90% | 0.901 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 120.2 | 158.5 | -66.9 | 166.2 | 0 | 0 | 0 | 108.9 | ||
| 15 | T | 53.6 | Low | 59.1 | Low | 134 Ų | 134 | 135.7 Ų | 135.7 | 82% | 0.822 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 138.3 | 171.9 | 21.4 | 0 | 0 | 0 | 0 | 110.3 | Q13 | Q13-T15 PolarHBondContact O-N 2.96Š|
| 16 | P | 61.9 | Low | 58.1 | Low | 112 Ų | 112 | 133.2 Ų | 133.2 | 73% | 0.727 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 153.5 | -172.4 | 25 | -34.1 | 0 | 0 | 0 | 112.7 | ||
| 17 | P | 67.8 | Low | 56.7 | Low | 119 Ų | 119 | 137.5 Ų | 137.5 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 152.6 | -174.6 | 27.2 | -35.3 | 0 | 0 | 0 | 113 | ||
| 18 | P | 65.8 | Low | 55.6 | Low | 119 Ų | 119 | 139.1 Ų | 139.1 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 151.5 | -177.4 | 28.6 | -35.7 | 0 | 0 | 0 | 112.9 | ||
| 19 | P | 67.5 | Low | 54.8 | Low | 115 Ų | 115 | 138.2 Ų | 138.2 | 75% | 0.747 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 154 | -177.1 | 28.4 | -35.6 | 0 | 0 | 0 | 113.2 | ||
| 20 | P | 71.8 | Confident | 53.9 | Low | 126 Ų | 126 | 142.1 Ų | 142.1 | 82% | 0.818 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 146.2 | -179.9 | 27.7 | -34.7 | 0 | 0 | 0 | 112.9 | ||
| 21 | L | 68.7 | Low | 53.1 | Low | 158 Ų | 158 | 143.9 Ų | 143.9 | 83% | 0.827 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 144.9 | 179.1 | -72 | 163.3 | 0 | 0 | 0 | 111.9 | V23 | L21-V23 PolarHBondContact O-N 3.45Š|
| 22 | P | 67.3 | Low | 52.7 | Low | 116 Ų | 116 | 140.2 Ų | 140.2 | 75% | 0.753 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 122.2 | 178.5 | -22.7 | 33.3 | 0 | 0 | 0 | 112.5 | L24 | P22-L24 PolarHBondContact O-N 2.95Š|
| 23 | V | 59.6 | Low | 52.4 | Low | 134 Ų | 134 | 139.5 Ų | 139.5 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | trans | -78.3 | 112.9 | 172.7 | -176.3 | 0 | 0 | 0 | 0 | 108.3 | L21 S25 | L21-V23 PolarHBondContact O-N 3.45Å; V23-S25 PolarHBondContact O-N 3.1Å; V23-S25 VanDerWaalsContact O-N 3.07Å | ||
| 24 | L | 49.2 | Very low | 52.5 | Low | 167 Ų | 167 | 135.5 Ų | 135.5 | 87% | 0.874 | 81% | 0.811 | S | S | * | * | trans | -70.4 | 102.9 | 176.1 | -73.5 | 168.8 | 0 | 0 | 0 | 110.4 | P22 G26 | P22-L24 PolarHBondContact O-N 2.95Å; L24-G26 VanDerWaalsContact C-N 3.3Å; L24-G26 PolarHBondContact O-N 3.38Å | ||
| 25 | S | 44.5 | Very low | 52.3 | Low | 125 Ų | 125 | 130.7 Ų | 130.7 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | trans | -66.9 | 80.8 | 174.3 | -64.6 | 0 | 0 | 0 | 0 | 112 | V23 | V23-S25 PolarHBondContact O-N 3.1Å; V23-S25 VanDerWaalsContact O-N 3.07Å | ||
| 26 | G | 42.5 | Very low | 52.2 | Low | 66 Ų | 66 | 128.3 Ų | 128.3 | 68% | 0.68 | 79% | 0.79 | S | S | * | * | trans | -127.5 | 73.4 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | L24 | L24-G26 VanDerWaalsContact C-N 3.3Å; L24-G26 PolarHBondContact O-N 3.38Å | ||
| 27 | K | 42.2 | Very low | 51.9 | Low | 207 Ų | 207 | 126.9 Ų | 126.9 | 90% | 0.9 | 78% | 0.783 | S | S | * | * | trans | 24.8 | 110.6 | 162.9 | -67.5 | -178.5 | 178.7 | 178.1 | 0 | 118.8 | ||||
| 28 | V | 36.4 | Very low | 51.6 | Low | 150 Ų | 150 | 125.9 Ų | 125.9 | 91% | 0.909 | 78% | 0.775 | S | S | * | * | trans | -52.9 | 129.5 | 169.9 | -177.4 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 29 | A | 41.2 | Very low | 51.7 | Low | 94 Ų | 94 | 126.3 Ų | 126.3 | 78% | 0.777 | 77% | 0.77 | S | S | * | * | trans | -143.3 | 103.9 | 158.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 30 | K | 41.8 | Very low | 51.8 | Low | 205 Ų | 205 | 130.1 Ų | 130.1 | 89% | 0.891 | 77% | 0.77 | S | S | * | * | trans | 49 | 88.4 | 164.5 | -67.4 | -177 | 177.9 | 177 | 0 | 118.6 | ||||
| 31 | K | 37.8 | Very low | 52.1 | Low | 197 Ų | 197 | 131 Ų | 131 | 86% | 0.857 | 76% | 0.763 | S | S | * | * | trans | -19.6 | 118.6 | 149.1 | -171.4 | 178.2 | -171.4 | 176.5 | 0 | 114.9 | ||||
| 32 | P | 38.8 | Very low | 52.5 | Low | 110 Ų | 110 | 125.8 Ų | 125.8 | 71% | 0.714 | 74% | 0.743 | S | S | * | * | trans | -70.2 | 145.8 | 165 | 29.7 | -33 | 0 | 0 | 0 | 110.5 | ||||
| 33 | P | 43.6 | Very low | 53 | Low | 119 Ų | 119 | 125.5 Ų | 125.5 | 77% | 0.773 | 74% | 0.735 | S | S | * | * | trans | -69.9 | 148.5 | -175.9 | 27.8 | -34.4 | 0 | 0 | 0 | 112.6 | A35 | P33-A35 VanDerWaalsContact C-N 3.25Å; P33-A35 PolarHBondContact O-N 2.75Å | ||
| 34 | A | 49 | Very low | 53.9 | Low | 101 Ų | 101 | 123.5 Ų | 123.5 | 84% | 0.835 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -77.9 | 54.7 | -168.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | A36 | A34-A36 VanDerWaalsContact C-N 3.31Å; A34-A36 PolarHBondContact O-N 2.82Å |
| 35 | A | 47.8 | Very low | 55.2 | Low | 71 Ų | 71 | 117.6 Ų | 117.6 | 59% | 0.587 | 69% | 0.694 | S | S | * | * | trans | -83.3 | 3.5 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | P33 S37 | P33-A35 VanDerWaalsContact C-N 3.25Å; P33-A35 PolarHBondContact O-N 2.75Å; A35-S37 PolarHBondContact O-N 2.91Å | ||
| 36 | A | 50.3 | Low | 56.6 | Low | 83 Ų | 83 | 116.7 Ų | 116.7 | 69% | 0.686 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -80 | -8.1 | -168.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | A34 | A34-A36 VanDerWaalsContact C-N 3.31Å; A34-A36 PolarHBondContact O-N 2.82Å |
| 37 | S | 56.1 | Low | 58 | Low | 83 Ų | 83 | 118.6 Ų | 118.6 | 58% | 0.58 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -79.9 | -33.8 | 179.5 | 59.7 | 0 | 0 | 0 | 0 | 112.9 | A35 R40 Q41 | A35-S37 PolarHBondContact O-N 2.91Å; S37-R40 PolarHBondContact O-N 3Å; S37-Q41 PolarHBondContact O-N 2.98Å |
| 38 | T | 61.6 | Low | 59.4 | Low | 98 Ų | 98 | 116.8 Ų | 116.8 | 60% | 0.601 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -67.4 | -44.8 | -174.6 | -38 | 0 | 0 | 0 | 0 | 112.2 | R40 Q41 A42 | T38-R40 VanDerWaalsContact C-N 3.29Å; T38-R40 PolarHBondContact O-N 2.84Å; T38-Q41 PolarHBondContact O-N 3.34Å; T38-A42 PolarHBondContact O-N 3.45Å |
| 39 | D | 67.3 | Low | 61.1 | Low | 127 Ų | 127 | 119 Ų | 119 | 68% | 0.679 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -61.6 | -36 | 179.4 | -81.6 | -16.6 | 0 | 0 | 0 | 112.5 | A42 L43 | D39-A42 PolarHBondContact O-N 3.05Å; D39-L43 WeakPolarHBondContact O-CB 3.37Å; D39-L43 PolarHBondContact O-N 3.34Å |
| 40 | R | 70.9 | Confident | 62.2 | Low | 195 Ų | 195 | 118.6 Ų | 118.6 | 74% | 0.736 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -69.4 | -36.7 | 178.2 | -164.8 | 171.8 | -175.5 | 152.2 | 0.2 | 111.8 | S37 T38 L44 | S37-R40 PolarHBondContact O-N 3Å; T38-R40 VanDerWaalsContact C-N 3.29Å; T38-R40 PolarHBondContact O-N 2.84Å; R40-L44 VanDerWaalsContact O-CG 3.29Å; R40-L44 WeakPolarHBondContact O-CG 3.39Å; R40-L44 PolarHBondContact O-N 3.36Å |
| 41 | Q | 77.2 | Confident | 63.1 | Low | 144 Ų | 144 | 112.3 Ų | 112.3 | 67% | 0.673 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -72.5 | -38.1 | 173.6 | -69.7 | -150.3 | 20.3 | 0 | 0 | 112.6 | S37 T38 L44 A45 | S37-Q41 PolarHBondContact O-N 2.98Å; T38-Q41 PolarHBondContact O-N 3.34Å; Q41-L44 PolarHBondContact O-N 3.11Å; Q41-A45 WeakPolarHBondContact O-CB 3.44Å; Q41-A45 PolarHBondContact O-N 3.48Å |
| 42 | A | 78.7 | Confident | 64 | Low | 50 Ų | 50 | 107.6 Ų | 107.6 | 41% | 0.413 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -59.9 | -47 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | T38 D39 L44 A45 D46 | T38-A42 PolarHBondContact O-N 3.45Å; D39-A42 PolarHBondContact O-N 3.05Å; A42-L44 VanDerWaalsContact C-N 3.35Å; A42-L44 PolarHBondContact O-N 3.12Å; A42-A45 WeakPolarHBondContact O-CB 3.49Å; A42-A45 PolarHBondContact O-N 3.23Å; A42-A45 VanDerWaalsContact O-N 3.09Å; A42-D46 PolarHBondContact O-N 2.9Å |
| 43 | L | 77.3 | Confident | 64.2 | Low | 110 Ų | 110 | 104.7 Ų | 104.7 | 58% | 0.576 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -60.9 | -41.1 | 176.6 | -169.9 | 69.5 | 0 | 0 | 0 | 112.4 | D39 A45 D46 I47 | D39-L43 WeakPolarHBondContact O-CB 3.37Å; D39-L43 PolarHBondContact O-N 3.34Å; L43-A45 VanDerWaalsContact C-N 3.32Å; L43-A45 PolarHBondContact O-N 3Å; L43-D46 PolarHBondContact O-N 3.46Å; L43-I47 HydrophobicContact CG-CD1 4.26Å; L43-I47 VanDerWaalsContact O-CG1 3.3Å; L43-I47 WeakPolarHBondContact O-CG1 3.35Å; L43-I47 PolarHBondContact O-N 3.13Å |
| 44 | L | 78.6 | Confident | 64.1 | Low | 91 Ų | 91 | 102.4 Ų | 102.4 | 48% | 0.476 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -71.5 | -23.2 | 175.5 | -70.7 | 171.2 | 0 | 0 | 0 | 113.4 | R40 Q41 A42 R48 | R40-L44 VanDerWaalsContact O-CG 3.29Å; R40-L44 WeakPolarHBondContact O-CG 3.39Å; R40-L44 PolarHBondContact O-N 3.36Å; Q41-L44 PolarHBondContact O-N 3.11Å; A42-L44 VanDerWaalsContact C-N 3.35Å; A42-L44 PolarHBondContact O-N 3.12Å; L44-R48 WeakPolarHBondContact O-CG 3.5Å; L44-R48 PolarHBondContact O-N 3.26Å; L44-R48 PolarHBondContact O-NE 3.5Å; L44-R48 VanDerWaalsContact O-NE 3.09Å |
| 45 | A | 75.2 | Confident | 64 | Low | 44 Ų | 44 | 103.3 Ų | 103.3 | 36% | 0.364 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -76 | -42.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q41 A42 L43 R48 R49 | Q41-A45 WeakPolarHBondContact O-CB 3.44Å; Q41-A45 PolarHBondContact O-N 3.48Å; A42-A45 WeakPolarHBondContact O-CB 3.49Å; A42-A45 PolarHBondContact O-N 3.23Å; A42-A45 VanDerWaalsContact O-N 3.09Å; L43-A45 VanDerWaalsContact C-N 3.32Å; L43-A45 PolarHBondContact O-N 3Å; A45-R48 PolarHBondContact O-N 3.09Å; A45-R49 WeakPolarHBondContact O-CB 3.48Å; A45-R49 PolarHBondContact O-N 3.24Å |
| 46 | D | 74.3 | Confident | 64 | Low | 106 Ų | 106 | 111.4 Ų | 111.4 | 57% | 0.567 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -65.1 | -41.9 | 176.3 | -87.4 | -9.6 | 0 | 0 | 0 | 112.4 | A42 L43 R48 R49 A50 | A42-D46 PolarHBondContact O-N 2.9Å; L43-D46 PolarHBondContact O-N 3.46Å; D46-R48 VanDerWaalsContact C-N 3.33Å; D46-R48 PolarHBondContact O-N 3Å; D46-R49 PolarHBondContact O-N 3.48Å; D46-A50 WeakPolarHBondContact O-CB 3.17Å; D46-A50 PolarHBondContact O-N 3.18Å |
| 47 | I | 71.8 | Confident | 64.2 | Low | 105 Ų | 105 | 114.5 Ų | 114.5 | 54% | 0.538 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -60.8 | -43.3 | 173.7 | -68.3 | 165.6 | 0 | 0 | 0 | 110.7 | L43 G51 | L43-I47 HydrophobicContact CG-CD1 4.26Å; L43-I47 VanDerWaalsContact O-CG1 3.3Å; L43-I47 WeakPolarHBondContact O-CG1 3.35Å; L43-I47 PolarHBondContact O-N 3.13Å; I47-G51 PolarHBondContact O-N 3.4Å |
| 48 | R | 72.2 | Confident | 64 | Low | 169 Ų | 169 | 119.5 Ų | 119.5 | 64% | 0.638 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -64.1 | -40.2 | 175.1 | -79 | -176.4 | -70.9 | 172.5 | -1.5 | 112.2 | L44 A45 D46 G51 S52 | L44-R48 WeakPolarHBondContact O-CG 3.5Å; L44-R48 PolarHBondContact O-N 3.26Å; L44-R48 PolarHBondContact O-NE 3.5Å; L44-R48 VanDerWaalsContact O-NE 3.09Å; A45-R48 PolarHBondContact O-N 3.09Å; D46-R48 VanDerWaalsContact C-N 3.33Å; D46-R48 PolarHBondContact O-N 3Å; R48-G51 PolarHBondContact O-N 3.48Å; R48-S52 WeakPolarHBondContact O-CB 3.27Å; R48-S52 PolarHBondContact O-N 2.91Å; R48-S52 VanDerWaalsContact O-N 3.08Å; R48-S52 PolarHBondContact O-OG 3.32Å |
| 49 | R | 70.7 | Confident | 63.8 | Low | 196 Ų | 196 | 120.9 Ų | 120.9 | 74% | 0.74 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -67.4 | -42.8 | 178.4 | -171.3 | 175.8 | -73.7 | -157.9 | -1.7 | 111.8 | A45 D46 G53 | A45-R49 WeakPolarHBondContact O-CB 3.48Å; A45-R49 PolarHBondContact O-N 3.24Å; D46-R49 PolarHBondContact O-N 3.48Å; R49-G53 PolarHBondContact O-N 3.11Å |
| 50 | A | 65.7 | Low | 63.2 | Low | 87 Ų | 87 | 120.4 Ų | 120.4 | 72% | 0.719 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -68.7 | -33.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | D46 | D46-A50 WeakPolarHBondContact O-CB 3.17Å; D46-A50 PolarHBondContact O-N 3.18Å |
| 51 | G | 60.8 | Low | 61.9 | Low | 72 Ų | 72 | 121.1 Ų | 121.1 | 74% | 0.742 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -85.2 | -19 | -177.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | I47 R48 | I47-G51 PolarHBondContact O-N 3.4Å; R48-G51 PolarHBondContact O-N 3.48Å |
| 52 | S | 56.2 | Low | 61 | Low | 99 Ų | 99 | 119.4 Ų | 119.4 | 69% | 0.692 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -109.4 | -19.3 | -175.2 | 60.5 | 0 | 0 | 0 | 0 | 115.1 | R48 G54 | R48-S52 WeakPolarHBondContact O-CB 3.27Å; R48-S52 PolarHBondContact O-N 2.91Å; R48-S52 VanDerWaalsContact O-N 3.08Å; R48-S52 PolarHBondContact O-OG 3.32Å; S52-G54 PolarHBondContact O-N 2.94Å |
| 53 | G | 43.4 | Very low | 59.7 | Low | 49 Ų | 49 | 124.1 Ų | 124.1 | 51% | 0.505 | 69% | 0.687 | S | S | . | * | trans | -86.5 | 82.3 | 179 | 0 | 0 | 0 | 0 | 0 | 112.8 | R49 V55 | R49-G53 PolarHBondContact O-N 3.11Å; G53-V55 PolarHBondContact O-N 3.41Å | ||
| 54 | G | 41.7 | Very low | 58.3 | Low | 70 Ų | 70 | 123.7 Ų | 123.7 | 72% | 0.722 | 69% | 0.685 | S | S | * | * | trans | -62.1 | 90.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S52 R56 | S52-G54 PolarHBondContact O-N 2.94Å; G54-R56 PolarHBondContact O-N 3.22Å | ||
| 55 | V | 46.9 | Very low | 57.1 | Low | 121 Ų | 121 | 130.6 Ų | 130.6 | 73% | 0.733 | 71% | 0.705 | S | S | * | * | trans | -62.1 | 103.8 | 167.2 | 179.6 | 0 | 0 | 0 | 0 | 107.5 | G53 L57 | G53-V55 PolarHBondContact O-N 3.41Å; V55-L57 HydrophobicContact CG1-CD2 4.03Å; V55-L57 PolarHBondContact O-N 3.32Å | ||
| 56 | R | 46.6 | Very low | 55.8 | Low | 240 Ų | 240 | 133.5 Ų | 133.5 | 91% | 0.906 | 72% | 0.723 | S | S | * | * | trans | -65 | 85 | 173.1 | -69.6 | 176.8 | 73.5 | -168 | 5.6 | 108.8 | G54 K58 | G54-R56 PolarHBondContact O-N 3.22Å; R56-K58 PolarHBondContact O-N 3.42Å; R56-K58 VanDerWaalsContact O-N 3.11Å | ||
| 57 | L | 55.8 | Low | 54.2 | Low | 149 Ų | 149 | 131.9 Ų | 131.9 | 78% | 0.78 | 72% | 0.724 | S | S | * | * | trans | -58.8 | 116.5 | 169 | -63.3 | 178.1 | 0 | 0 | 0 | 107.2 | V55 | V55-L57 HydrophobicContact CG1-CD2 4.03Å; V55-L57 PolarHBondContact O-N 3.32Å | ||
| 58 | K | 51.9 | Low | 52.9 | Low | 187 Ų | 187 | 132.5 Ų | 132.5 | 81% | 0.813 | 74% | 0.735 | S | S | * | * | trans | -52.3 | 135.7 | 171 | -78.5 | -177.6 | 172.5 | 179.6 | 0 | 107.9 | R56 T60 | R56-K58 PolarHBondContact O-N 3.42Å; R56-K58 VanDerWaalsContact O-N 3.11Å; K58-T60 PolarHBondContact O-N 3.27Å | ||
| 59 | P | 55.9 | Low | 51.5 | Low | 127 Ų | 127 | 132.3 Ų | 132.3 | 83% | 0.825 | 75% | 0.746 | S | S | * | * | trans | -59.7 | 101.1 | 175.4 | -23.9 | 34.2 | 0 | 0 | 0 | 110.3 | K61 | P59-K61 PolarHBondContact O-N 3.32Š| ||
| 60 | T | 54.8 | Low | 50 | Low | 117 Ų | 117 | 129.9 Ų | 129.9 | 72% | 0.718 | 75% | 0.753 | S | S | * | * | trans | -66 | 119 | 170.4 | -55 | 0 | 0 | 0 | 0 | 106.9 | K58 T62 | K58-T60 PolarHBondContact O-N 3.27Å; T60-T62 HydrophobicContact CG2-CG2 4.36Å; T60-T62 PolarHBondContact O-N 3.1Å | ||
| 61 | K | 45.3 | Very low | 48.7 | Very low | 210 Ų | 210 | 128.6 Ų | 128.6 | 91% | 0.913 | 75% | 0.748 | S | S | * | * | trans | -68.1 | 75 | 176.2 | -71.4 | -175.6 | 175.6 | -178.4 | 0 | 110.7 | P59 N63 | P59-K61 PolarHBondContact O-N 3.32Å; K61-N63 PolarHBondContact O-N 3.39Å | ||
| 62 | T | 57.7 | Low | 47.3 | Very low | 108 Ų | 108 | 128.8 Ų | 128.8 | 66% | 0.663 | 75% | 0.751 | S | S | * | * | trans | -75.5 | 114 | 165.1 | 46.6 | 0 | 0 | 0 | 0 | 108.2 | T60 D64 | T60-T62 HydrophobicContact CG2-CG2 4.36Å; T60-T62 PolarHBondContact O-N 3.1Å; T62-D64 PolarHBondContact O-N 2.9Å | ||
| 63 | N | 50.1 | Low | 46.3 | Very low | 149 Ų | 149 | 129.4 Ų | 129.4 | 80% | 0.797 | 76% | 0.761 | S | S | * | * | trans | -72.4 | 69.1 | 174.6 | -177.9 | 21.5 | 0 | 0 | 0 | 110.1 | K61 | K61-N63 PolarHBondContact O-N 3.39Š| ||
| 64 | D | 49 | Very low | 45.7 | Very low | 101 Ų | 101 | 132 Ų | 132 | 54% | 0.54 | 77% | 0.771 | S | S | . | * | trans | -108.4 | 93.2 | 178 | -154.6 | -28.6 | 0 | 0 | 0 | 108.3 | T62 S66 | T62-D64 PolarHBondContact O-N 2.9Å; D64-S66 PolarHBondContact O-N 2.93Å; D64-S66 WeakPolarHBondContact OD1-CB 3.43Å; D64-S66 PolarHBondContact OD1-N 3.1Å; D64-S66 PolarHBondContact OD1-OG 2.96Å | ||
| 65 | R | 53 | Low | 45.4 | Very low | 237 Ų | 237 | 137.5 Ų | 137.5 | 89% | 0.894 | 78% | 0.778 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.2 | 12.3 | 179.6 | -72.4 | -177.3 | 170.6 | -174.9 | -5.8 | 113.5 | ||
| 66 | S | 48.3 | Very low | 44.6 | Very low | 105 Ų | 105 | 138.2 Ų | 138.2 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | -6.7 | -173.5 | -34.9 | 0 | 0 | 0 | 0 | 113.9 | D64 | D64-S66 PolarHBondContact O-N 2.93Å; D64-S66 WeakPolarHBondContact OD1-CB 3.43Å; D64-S66 PolarHBondContact OD1-N 3.1Å; D64-S66 PolarHBondContact OD1-OG 2.96Å |
| 67 | A | 40.4 | Very low | 44.1 | Very low | 71 Ų | 71 | 132.5 Ų | 132.5 | 59% | 0.587 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -110.8 | 131.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | N69 | A67-N69 PolarHBondContact O-N 3.27Š|
| 68 | P | 44.5 | Very low | 43 | Very low | 118 Ų | 118 | 136.9 Ų | 136.9 | 77% | 0.766 | 78% | 0.784 | S | S | * | * | trans | -64.8 | 133.9 | 174.9 | 26.8 | -33.2 | 0 | 0 | 0 | 110.5 | V70 | P68-V70 PolarHBondContact O-N 2.94Š| ||
| 69 | N | 42.5 | Very low | 42.4 | Very low | 166 Ų | 166 | 133.9 Ų | 133.9 | 89% | 0.888 | 78% | 0.783 | S | S | * | * | trans | -77.5 | 87.9 | -171.4 | -141.4 | 20.1 | 0 | 0 | 0 | 110.3 | A67 G71 | A67-N69 PolarHBondContact O-N 3.27Å; N69-G71 PolarHBondContact O-N 2.73Å; N69-G71 VanDerWaalsContact O-N 3.09Å | ||
| 70 | V | 38.9 | Very low | 41.8 | Very low | 144 Ų | 144 | 133.7 Ų | 133.7 | 87% | 0.873 | 79% | 0.785 | S | S | * | * | trans | -85.9 | 63 | 168.6 | -168.9 | 0 | 0 | 0 | 0 | 109 | P68 | P68-V70 PolarHBondContact O-N 2.94Š| ||
| 71 | G | 38.5 | Very low | 40.6 | Very low | 60 Ų | 60 | 136.7 Ų | 136.7 | 62% | 0.619 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 137.2 | 167.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | N69 | N69-G71 PolarHBondContact O-N 2.73Å; N69-G71 VanDerWaalsContact O-N 3.09Å |
| 72 | G | 33 | Very low | 40.2 | Very low | 77 Ų | 77 | 130.7 Ų | 130.7 | 79% | 0.794 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 168.6 | -170 | 0 | 0 | 0 | 0 | 0 | 115.7 | S74 | G72-S74 PolarHBondContact O-N 3.08Š|
| 73 | A | 35.3 | Very low | 39.1 | Very low | 111 Ų | 111 | 133.7 Ų | 133.7 | 92% | 0.917 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 120.5 | -175 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 74 | S | 30.8 | Very low | 38 | Very low | 103 Ų | 103 | 130 Ų | 130 | 72% | 0.72 | 79% | 0.792 | S | S | * | * | trans | -175.6 | 109.7 | 146.4 | 54.3 | 0 | 0 | 0 | 0 | 103.6 | G72 | G72-S74 PolarHBondContact O-N 3.08Š| ||
| 75 | E | 33.6 | Very low | 37.1 | Very low | 186 Ų | 186 | 131.3 Ų | 131.3 | 87% | 0.869 | 81% | 0.806 | S | S | * | * | -138.8 | 135.1 | 63.8 | -73.4 | 142.3 | -174.2 | 0 | 0 | 112.4 | P77 | E75-P77 WeakPolarHBondContact O-CD 3.17Š| |||
| 76 | T | 31.9 | Very low | 35.8 | Very low | 137 Ų | 137 | 124.5 Ų | 124.5 | 84% | 0.84 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -87.4 | 117.5 | 156.8 | 18.6 | 0 | 0 | 0 | 0 | 108.6 | ||
| 77 | P | 35.4 | Very low | 35.1 | Very low | 120 Ų | 120 | 124.3 Ų | 124.3 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 136.9 | 159.2 | -18.3 | 32.2 | 0 | 0 | 0 | 108.8 | E75 | E75-P77 WeakPolarHBondContact O-CD 3.17Š|
| 78 | R | 33.2 | Very low | 34.6 | Very low | 241 Ų | 241 | 125 Ų | 125 | 91% | 0.909 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 145.5 | 173.9 | -79.2 | 176.5 | 166.2 | 174.2 | -5.9 | 110.1 | ||
| 79 | P | 38.5 | Very low | 33.7 | Very low | 123 Ų | 123 | 124 Ų | 124 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 135.1 | -175.6 | 30.1 | -34.5 | 0 | 0 | 0 | 111.4 | ||
| 80 | S | 43.9 | Very low | 33.3 | Very low | 123 Ų | 123 | 120.7 Ų | 120.7 | 86% | 0.86 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 144.6 | 165 | -166.9 | 0 | 0 | 0 | 0 | 110 | ||
| 81 | M | 29.1 | Very low | 32.9 | Very low | 181 Ų | 181 | 117.9 Ų | 117.9 | 89% | 0.892 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 146.1 | -175.8 | -59.4 | -179.8 | 174 | 0 | 0 | 112.1 | ||
| 82 | A | 37 | Very low | 32.3 | Very low | 83 Ų | 83 | 119.1 Ų | 119.1 | 69% | 0.686 | 81% | 0.805 | S | S | * | * | 171.2 | 133 | 123.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 83 | N | 33.6 | Very low | 32.3 | Very low | 171 Ų | 171 | 122.1 Ų | 122.1 | 91% | 0.914 | 81% | 0.807 | S | S | * | * | trans | 53 | 113.9 | 151.1 | -56.2 | -19 | 0 | 0 | 0 | 120.6 | ||||
| 84 | G | 27.7 | Very low | 32.1 | Very low | 73 Ų | 73 | 123 Ų | 123 | 75% | 0.753 | 80% | 0.802 | S | S | * | * | trans | 152.4 | 119.1 | 165.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 85 | P | 30.8 | Very low | 31.9 | Very low | 128 Ų | 128 | 122 Ų | 122 | 83% | 0.831 | 81% | 0.808 | S | S | * | * | trans | -85.7 | 144.9 | -160.5 | 32.7 | -36.3 | 0 | 0 | 0 | 115.3 | A87 | P85-A87 PolarHBondContact O-N 3.26Š| ||
| 86 | A | 25.9 | Very low | 31.8 | Very low | 94 Ų | 94 | 117.5 Ų | 117.5 | 78% | 0.777 | 80% | 0.802 | S | S | * | * | trans | 48.5 | 59.4 | 136.6 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 87 | A | 32.5 | Very low | 31.7 | Very low | 101 Ų | 101 | 120.2 Ų | 120.2 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | -111.5 | 72 | 129.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | P85 | P85-A87 PolarHBondContact O-N 3.26Š| |||
| 88 | A | 30.8 | Very low | 31.8 | Very low | 84 Ų | 84 | 121 Ų | 121 | 69% | 0.694 | 81% | 0.805 | S | S | * | * | 49.2 | 75.5 | 84 | 0 | 0 | 0 | 0 | 0 | 112.3 | A90 | A88-A90 PolarHBondContact O-N 3.14Š| |||
| 89 | A | 24.6 | Very low | 31.7 | Very low | 99 Ų | 99 | 119.6 Ų | 119.6 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | 56.6 | 62.3 | 120.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 90 | A | 35 | Very low | 32 | Very low | 96 Ų | 96 | 119.8 Ų | 119.8 | 79% | 0.793 | 80% | 0.801 | S | S | * | * | trans | -138.6 | 75.5 | 138.3 | 0 | 0 | 0 | 0 | 0 | 107.7 | A88 | A88-A90 PolarHBondContact O-N 3.14Š| ||
| 91 | A | 29.7 | Very low | 31.8 | Very low | 85 Ų | 85 | 120.4 Ų | 120.4 | 70% | 0.702 | 80% | 0.8 | S | S | * | * | 46.1 | 103.9 | 87.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 92 | A | 26.1 | Very low | 32.5 | Very low | 86 Ų | 86 | 114.5 Ų | 114.5 | 71% | 0.711 | 79% | 0.785 | S | S | * | * | 58.1 | 138.2 | 65.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 93 | T | 32.6 | Very low | 32.9 | Very low | 139 Ų | 139 | 119.4 Ų | 119.4 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | trans | 71.6 | 124.8 | -163.1 | 78.1 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 94 | T | 32.3 | Very low | 34.1 | Very low | 130 Ų | 130 | 115.6 Ų | 115.6 | 80% | 0.798 | 78% | 0.779 | S | S | * | * | cis | -132.9 | 149.2 | 18.9 | 49.1 | 0 | 0 | 0 | 0 | 112.9 | A96 | T94-A96 PolarHBondContact O-N 3.16Š| ||
| 95 | G | 26 | Very low | 36.2 | Very low | 83 Ų | 83 | 116 Ų | 116 | 86% | 0.856 | 76% | 0.764 | S | S | * | * | trans | -72.1 | 95.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | K97 | G95-K97 PolarHBondContact O-N 3.49Š| ||
| 96 | A | 31.2 | Very low | 38 | Very low | 91 Ų | 91 | 114.6 Ų | 114.6 | 75% | 0.752 | 75% | 0.745 | S | S | * | * | trans | -79.1 | 66.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | T94 V98 | T94-A96 PolarHBondContact O-N 3.16Å; A96-V98 PolarHBondContact O-N 3.28Å | ||
| 97 | K | 30.1 | Very low | 40.2 | Very low | 193 Ų | 193 | 112 Ų | 112 | 84% | 0.839 | 72% | 0.723 | S | S | * | * | trans | 26.2 | 71.9 | 152 | -160.9 | 169 | -170.7 | 169.5 | 0 | 114.9 | G95 R99 | G95-K97 PolarHBondContact O-N 3.49Å; K97-R99 PolarHBondContact O-N 3.14Å | ||
| 98 | V | 36.4 | Very low | 42.1 | Very low | 137 Ų | 137 | 110.4 Ų | 110.4 | 83% | 0.83 | 71% | 0.706 | S | S | * | * | trans | -56 | 105.5 | 179 | 178.2 | 0 | 0 | 0 | 0 | 108.8 | A96 | A96-V98 PolarHBondContact O-N 3.28Š| ||
| 99 | R | 32.8 | Very low | 44.2 | Very low | 211 Ų | 211 | 111.2 Ų | 111.2 | 80% | 0.796 | 70% | 0.696 | S | S | * | * | trans | -61.2 | 147.1 | 173.5 | -75.1 | 169.2 | 144.8 | 176.2 | -8.4 | 108.3 | K97 T101 | K97-R99 PolarHBondContact O-N 3.14Å; R99-T101 VanDerWaalsContact C-N 3.31Å; R99-T101 PolarHBondContact O-N 3.33Å | ||
| 100 | P | 42.9 | Very low | 46.6 | Very low | 127 Ų | 127 | 108.1 Ų | 108.1 | 83% | 0.825 | 67% | 0.665 | S | S | * | * | trans | -66.2 | 92.2 | 175.7 | 28 | -34.1 | 0 | 0 | 0 | 109.8 | G102 | P100-G102 PolarHBondContact O-N 3.49Š| ||
| 101 | T | 40 | Very low | 48.6 | Very low | 137 Ų | 137 | 108 Ų | 108 | 84% | 0.84 | 65% | 0.651 | S | S | * | * | trans | -75.6 | 56.9 | 171 | 44 | 0 | 0 | 0 | 0 | 110.2 | R99 | R99-T101 VanDerWaalsContact C-N 3.31Å; R99-T101 PolarHBondContact O-N 3.33Å | ||
| 102 | G | 45 | Very low | 50.8 | Low | 57 Ų | 57 | 112.6 Ų | 112.6 | 59% | 0.588 | 65% | 0.65 | S | S | * | * | trans | -122.1 | 59 | 166.5 | 0 | 0 | 0 | 0 | 0 | 108 | P100 V104 | P100-G102 PolarHBondContact O-N 3.49Å; G102-V104 PolarHBondContact O-N 3.41Å | ||
| 103 | M | 45.4 | Very low | 53 | Low | 185 Ų | 185 | 111.4 Ų | 111.4 | 91% | 0.911 | 64% | 0.64 | S | S | * | * | trans | -65.4 | 86.7 | 163.3 | -77.6 | -177.9 | 64.8 | 0 | 0 | 107.1 | D105 | M103-D105 PolarHBondContact O-N 3.36Š| ||
| 104 | V | 57.9 | Low | 55.2 | Low | 91 Ų | 91 | 106.2 Ų | 106.2 | 55% | 0.552 | 61% | 0.608 | S | S | * | * | trans | -58.8 | 109.9 | 160.8 | -176.2 | 0 | 0 | 0 | 0 | 104.7 | G102 F106 E109 | G102-V104 PolarHBondContact O-N 3.41Å; V104-F106 PolarHBondContact O-N 3.18Å; V104-F106 VanDerWaalsContact O-N 3.08Å; V104-E109 HydrophobicContact CG1-CB 3.93Å | ||
| 105 | D | 71.5 | Confident | 57.2 | Low | 81 Ų | 81 | 105 Ų | 105 | 43% | 0.433 | 60% | 0.597 | S | S | . | * | trans | -53.4 | 120.4 | 178.1 | 158.9 | 39 | 0 | 0 | 0 | 108.5 | M103 A107 S108 E109 | M103-D105 PolarHBondContact O-N 3.36Å; D105-A107 PolarHBondContact O-N 2.58Å; D105-A107 WeakPolarHBondContact OD1-CB 3.4Å; D105-A107 PolarHBondContact OD1-N 2.79Å; D105-S108 WeakPolarHBondContact O-CA 3.47Å; D105-S108 WeakPolarHBondContact O-CB 3.45Å; D105-S108 PolarHBondContact O-N 3.05Å; D105-S108 VanDerWaalsContact OD2-CB 3.24Å; D105-S108 WeakPolarHBondContact OD2-CB 3.32Å; D105-S108 PolarHBondContact OD2-N 3.19Å; D105-S108 PolarHBondContact OD2-OG 3.29Å; D105-E109 PolarHBondContact O-N 3.36Å | ||
| 106 | F | 69.1 | Low | 59.6 | Low | 99 Ų | 99 | 102.9 Ų | 102.9 | 43% | 0.434 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -60.3 | -33.1 | -176.9 | -179.8 | -102.6 | 0 | 0 | 0 | 110.9 | V104 E109 L110 L154 L157 | V104-F106 PolarHBondContact O-N 3.18Å; V104-F106 VanDerWaalsContact O-N 3.08Å; F106-E109 PolarHBondContact O-N 3Å; F106-L110 HydrophobicContact CE1-CD1 3.8Å; F106-L110 HydrophobicContact CZ-CD1 3.76Å; F106-L110 WeakPolarHBondContact O-CB 3.37Å; F106-L110 PolarHBondContact O-N 3Å; F106-L154 HydrophobicContact CD1-CD1 3.86Å; F106-L154 HydrophobicContact CE1-CD1 3.79Å; F106-L157 HydrophobicContact CD1-CD2 3.79Å; F106-L157 HydrophobicContact CE1-CD2 3.84Å; F106-L157 HydrophobicContact CG-CD2 4.19Å; F106-L157 HydrophobicContact CZ-CD2 4.29Å |
| 107 | A | 72.6 | Confident | 61.8 | Low | 39 Ų | 39 | 101.4 Ų | 101.4 | 32% | 0.322 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -66 | -42 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | D105 L110 N111 | D105-A107 PolarHBondContact O-N 2.58Å; D105-A107 WeakPolarHBondContact OD1-CB 3.4Å; D105-A107 PolarHBondContact OD1-N 2.79Å; A107-L110 PolarHBondContact O-N 2.83Å; A107-N111 VanDerWaalsContact O-CB 3.28Å; A107-N111 WeakPolarHBondContact O-CB 3.28Å; A107-N111 VanDerWaalsContact O-CG 3.28Å; A107-N111 PolarHBondContact O-N 3.29Å; A107-N111 PolarHBondContact O-ND2 3.28Å; A107-N111 VanDerWaalsContact O-ND2 3.14Å |
| 108 | S | 71.7 | Confident | 63.7 | Low | 68 Ų | 68 | 95.9 Ų | 95.9 | 48% | 0.476 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.8 | -42.6 | 174.1 | -67.9 | 0 | 0 | 0 | 0 | 113.1 | D105 R112 | D105-S108 WeakPolarHBondContact O-CA 3.47Å; D105-S108 WeakPolarHBondContact O-CB 3.45Å; D105-S108 PolarHBondContact O-N 3.05Å; D105-S108 VanDerWaalsContact OD2-CB 3.24Å; D105-S108 WeakPolarHBondContact OD2-CB 3.32Å; D105-S108 PolarHBondContact OD2-N 3.19Å; D105-S108 PolarHBondContact OD2-OG 3.29Å; S108-R112 WeakPolarHBondContact O-CB 3.42Å; S108-R112 PolarHBondContact O-N 2.95Å |
| 109 | E | 76.2 | Confident | 65.5 | Low | 102 Ų | 102 | 94.5 Ų | 94.5 | 48% | 0.477 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -72.8 | -36.2 | 176.3 | -174.2 | 155.2 | -150.9 | 0 | 0 | 112.5 | V104 D105 F106 R112 A113 | V104-E109 HydrophobicContact CG1-CB 3.93Å; D105-E109 PolarHBondContact O-N 3.36Å; F106-E109 PolarHBondContact O-N 3Å; E109-R112 WeakPolarHBondContact O-CB 3.21Å; E109-R112 PolarHBondContact O-N 3.1Å; E109-A113 WeakPolarHBondContact O-CB 3.46Å; E109-A113 PolarHBondContact O-N 3.42Å |
| 110 | L | 74.4 | Confident | 67.6 | Low | 34 Ų | 34 | 91.2 Ų | 91.2 | 18% | 0.178 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -63.3 | -46.4 | 173.3 | -167.6 | 106.8 | 0 | 0 | 0 | 111.3 | F106 A107 R112 A113 V114 V150 | F106-L110 HydrophobicContact CE1-CD1 3.8Å; F106-L110 HydrophobicContact CZ-CD1 3.76Å; F106-L110 WeakPolarHBondContact O-CB 3.37Å; F106-L110 PolarHBondContact O-N 3Å; A107-L110 PolarHBondContact O-N 2.83Å; L110-R112 VanDerWaalsContact C-N 3.3Å; L110-R112 PolarHBondContact O-N 3.04Å; L110-A113 PolarHBondContact O-N 3.25Å; L110-A113 VanDerWaalsContact O-N 3.12Å; L110-V114 WeakPolarHBondContact O-CG2 3.45Å; L110-V114 PolarHBondContact O-N 2.84Å; L110-V150 HydrophobicContact CD1-CG1 3.85Å; L110-V150 HydrophobicContact CD2-CG1 3.74Å; L110-V150 HydrophobicContact CG-CG1 4.07Å |
| 111 | N | 76.9 | Confident | 68.9 | Low | 93 Ų | 93 | 86.3 Ų | 86.3 | 50% | 0.497 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.7 | -41.1 | 174.3 | -80.1 | -35.4 | 0 | 0 | 0 | 111.3 | A107 A113 N115 | A107-N111 VanDerWaalsContact O-CB 3.28Å; A107-N111 WeakPolarHBondContact O-CB 3.28Å; A107-N111 VanDerWaalsContact O-CG 3.28Å; A107-N111 PolarHBondContact O-N 3.29Å; A107-N111 PolarHBondContact O-ND2 3.28Å; A107-N111 VanDerWaalsContact O-ND2 3.14Å; N111-A113 PolarHBondContact O-N 2.76Å; N111-N115 VanDerWaalsContact O-CB 3.25Å; N111-N115 WeakPolarHBondContact O-CB 3.42Å; N111-N115 VanDerWaalsContact O-CG 3.23Å; N111-N115 PolarHBondContact O-N 3.17Å; N111-N115 PolarHBondContact O-ND2 3.06Å |
| 112 | R | 75.1 | Confident | 70.3 | Confident | 181 Ų | 181 | 82.4 Ų | 82.4 | 68% | 0.683 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -60.1 | -44.5 | 172.8 | -172.1 | -174.4 | -65.8 | -169.3 | -1.4 | 111.6 | S108 E109 L110 A116 | S108-R112 WeakPolarHBondContact O-CB 3.42Å; S108-R112 PolarHBondContact O-N 2.95Å; E109-R112 WeakPolarHBondContact O-CB 3.21Å; E109-R112 PolarHBondContact O-N 3.1Å; L110-R112 VanDerWaalsContact C-N 3.3Å; L110-R112 PolarHBondContact O-N 3.04Å; R112-A116 VanDerWaalsContact O-CB 3.23Å; R112-A116 WeakPolarHBondContact O-CB 3.25Å; R112-A116 PolarHBondContact O-N 3.44Å |
| 113 | A | 73.9 | Confident | 71.6 | Confident | 61 Ų | 61 | 87.1 Ų | 87.1 | 50% | 0.504 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -66.9 | -44.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | E109 L110 N111 A116 Q117 | E109-A113 WeakPolarHBondContact O-CB 3.46Å; E109-A113 PolarHBondContact O-N 3.42Å; L110-A113 PolarHBondContact O-N 3.25Å; L110-A113 VanDerWaalsContact O-N 3.12Å; N111-A113 PolarHBondContact O-N 2.76Å; A113-A116 PolarHBondContact O-N 3.39Å; A113-Q117 PolarHBondContact O-N 2.95Å |
| 114 | V | 77.5 | Confident | 72.8 | Confident | 30 Ų | 30 | 89 Ų | 89 | 18% | 0.182 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -62 | -48.8 | 176.5 | 171.2 | 0 | 0 | 0 | 0 | 110.5 | L110 A116 Q117 H118 L147 | L110-V114 WeakPolarHBondContact O-CG2 3.45Å; L110-V114 PolarHBondContact O-N 2.84Å; V114-A116 VanDerWaalsContact C-N 3.34Å; V114-A116 PolarHBondContact O-N 3.35Å; V114-Q117 PolarHBondContact O-N 3.13Å; V114-Q117 VanDerWaalsContact O-N 3.16Å; V114-H118 WeakPolarHBondContact O-CB 3.47Å; V114-H118 PolarHBondContact O-N 3.02Å; V114-L147 HydrophobicContact CG1-CD2 4.06Å; V114-L147 HydrophobicContact CG2-CD2 4.36Å |
| 115 | N | 75.4 | Confident | 73.1 | Confident | 104 Ų | 104 | 85.9 Ų | 85.9 | 56% | 0.556 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -62.2 | -40.4 | 177.4 | -73.1 | -24.5 | 0 | 0 | 0 | 111.9 | N111 Q117 H118 Q119 | N111-N115 VanDerWaalsContact O-CB 3.25Å; N111-N115 WeakPolarHBondContact O-CB 3.42Å; N111-N115 VanDerWaalsContact O-CG 3.23Å; N111-N115 PolarHBondContact O-N 3.17Å; N111-N115 PolarHBondContact O-ND2 3.06Å; N115-Q117 PolarHBondContact O-N 2.93Å; N115-H118 PolarHBondContact O-N 3.3Å; N115-Q119 WeakPolarHBondContact O-CB 3.33Å; N115-Q119 WeakPolarHBondContact O-CG 3.35Å; N115-Q119 PolarHBondContact O-N 3.03Å |
| 116 | A | 75.6 | Confident | 72.9 | Confident | 39 Ų | 39 | 89.2 Ų | 89.2 | 32% | 0.322 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.8 | -35.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | R112 A113 V114 K120 | R112-A116 VanDerWaalsContact O-CB 3.23Å; R112-A116 WeakPolarHBondContact O-CB 3.25Å; R112-A116 PolarHBondContact O-N 3.44Å; A113-A116 PolarHBondContact O-N 3.39Å; V114-A116 VanDerWaalsContact C-N 3.34Å; V114-A116 PolarHBondContact O-N 3.35Å; A116-K120 WeakPolarHBondContact O-CB 3.42Å; A116-K120 WeakPolarHBondContact O-CD 3.27Å; A116-K120 WeakPolarHBondContact O-CG 3.22Å; A116-K120 PolarHBondContact O-N 2.85Å; A116-K120 VanDerWaalsContact O-N 3.07Å |
| 117 | Q | 76.8 | Confident | 72.4 | Confident | 60 Ų | 60 | 86.8 Ų | 86.8 | 28% | 0.28 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -72.2 | -38.5 | 174.3 | -177.1 | 167 | -67.8 | 0 | 0 | 112.3 | A113 V114 N115 K120 T121 F143 F146 | A113-Q117 PolarHBondContact O-N 2.95Å; V114-Q117 PolarHBondContact O-N 3.13Å; V114-Q117 VanDerWaalsContact O-N 3.16Å; N115-Q117 PolarHBondContact O-N 2.93Å; Q117-K120 PolarHBondContact O-N 3.3Å; Q117-T121 WeakPolarHBondContact O-CB 3.2Å; Q117-T121 PolarHBondContact O-N 2.86Å; Q117-T121 PolarHBondContact O-OG1 2.89Å; Q117-F143 HydrophobicContact CG-CE2 4.39Å; Q117-F146 VanDerWaalsContact NE2-CE1 3.31Å |
| 118 | H | 71.2 | Confident | 71.4 | Confident | 77 Ų | 77 | 93.6 Ų | 93.6 | 36% | 0.356 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -63.3 | -47.9 | 176.3 | -166.1 | 80.3 | 0 | 0 | 0 | 110.7 | V114 N115 K120 T121 L122 F143 | V114-H118 WeakPolarHBondContact O-CB 3.47Å; V114-H118 PolarHBondContact O-N 3.02Å; N115-H118 PolarHBondContact O-N 3.3Å; H118-K120 PolarHBondContact O-N 2.93Å; H118-T121 WeakPolarHBondContact O-CB 3.37Å; H118-T121 PolarHBondContact O-N 3.36Å; H118-T121 VanDerWaalsContact O-N 3.1Å; H118-L122 VanDerWaalsContact CD2-CD1 3.45Å; H118-L122 WeakPolarHBondContact CD2-CD1 3.23Å; H118-L122 PolarHBondContact O-N 2.94Å; H118-F143 AromaticContact ND1-CZ 3.63Å |
| 119 | Q | 74.4 | Confident | 70.4 | Confident | 109 Ų | 109 | 94.5 Ų | 94.5 | 51% | 0.509 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -54.2 | -47.4 | 170.8 | -79.5 | -84.6 | -12.6 | 0 | 0 | 112.9 | N115 T121 K123 | N115-Q119 WeakPolarHBondContact O-CB 3.33Å; N115-Q119 WeakPolarHBondContact O-CG 3.35Å; N115-Q119 PolarHBondContact O-N 3.03Å; Q119-T121 VanDerWaalsContact C-N 3.29Å; Q119-T121 PolarHBondContact O-N 3.01Å; Q119-K123 WeakPolarHBondContact O-CB 3.32Å; Q119-K123 VanDerWaalsContact O-CG 3.32Å; Q119-K123 WeakPolarHBondContact O-CG 3.35Å; Q119-K123 PolarHBondContact O-N 3.19Å |
| 120 | K | 76.1 | Confident | 69.2 | Low | 141 Ų | 141 | 92.2 Ų | 92.2 | 61% | 0.613 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -63.1 | -35 | 176.4 | -75.1 | 166.5 | -173.7 | 170.3 | 0 | 112.5 | A116 Q117 H118 R124 | A116-K120 WeakPolarHBondContact O-CB 3.42Å; A116-K120 WeakPolarHBondContact O-CD 3.27Å; A116-K120 WeakPolarHBondContact O-CG 3.22Å; A116-K120 PolarHBondContact O-N 2.85Å; A116-K120 VanDerWaalsContact O-N 3.07Å; Q117-K120 PolarHBondContact O-N 3.3Å; H118-K120 PolarHBondContact O-N 2.93Å; K120-R124 WeakPolarHBondContact O-CG 3.45Å; K120-R124 PolarHBondContact O-N 3.22Å |
| 121 | T | 70.6 | Confident | 68.1 | Low | 25 Ų | 25 | 95.3 Ų | 95.3 | 15% | 0.153 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -71.1 | -51.2 | 178.4 | -54.2 | 0 | 0 | 0 | 0 | 110.6 | Q117 H118 Q119 K123 R124 T125 L129 L139 | Q117-T121 WeakPolarHBondContact O-CB 3.2Å; Q117-T121 PolarHBondContact O-N 2.86Å; Q117-T121 PolarHBondContact O-OG1 2.89Å; H118-T121 WeakPolarHBondContact O-CB 3.37Å; H118-T121 PolarHBondContact O-N 3.36Å; H118-T121 VanDerWaalsContact O-N 3.1Å; Q119-T121 VanDerWaalsContact C-N 3.29Å; Q119-T121 PolarHBondContact O-N 3.01Å; T121-K123 VanDerWaalsContact C-N 3.29Å; T121-K123 PolarHBondContact O-N 3.42Å; T121-R124 PolarHBondContact O-N 3.11Å; T121-T125 HydrophobicContact CG2-CG2 4.42Å; T121-T125 PolarHBondContact O-N 3.23Å; T121-T125 PolarHBondContact O-OG1 3.46Å; T121-T125 VanDerWaalsContact O-OG1 3.13Å; T121-L129 HydrophobicContact CG2-CD2 4.29Å; T121-L139 HydrophobicContact CG2-CD2 4.47Å |
| 122 | L | 68.4 | Low | 67 | Low | 55 Ų | 55 | 95.5 Ų | 95.5 | 29% | 0.288 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -54.5 | -42.3 | 175.6 | -76.8 | 168.1 | 0 | 0 | 0 | 112.7 | H118 T125 N126 G127 | H118-L122 VanDerWaalsContact CD2-CD1 3.45Å; H118-L122 WeakPolarHBondContact CD2-CD1 3.23Å; H118-L122 PolarHBondContact O-N 2.94Å; L122-T125 PolarHBondContact O-N 3.49Å; L122-T125 PolarHBondContact O-OG1 3.36Å; L122-N126 PolarHBondContact O-N 3.04Å; L122-G127 PolarHBondContact O-N 2.9Å |
| 123 | K | 72.9 | Confident | 65.9 | Low | 155 Ų | 155 | 88.4 Ų | 88.4 | 67% | 0.674 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -66.7 | -34.8 | 176.1 | -72.2 | 179.2 | -177.3 | -170.8 | 0 | 113 | Q119 T121 | Q119-K123 WeakPolarHBondContact O-CB 3.32Å; Q119-K123 VanDerWaalsContact O-CG 3.32Å; Q119-K123 WeakPolarHBondContact O-CG 3.35Å; Q119-K123 PolarHBondContact O-N 3.19Å; T121-K123 VanDerWaalsContact C-N 3.29Å; T121-K123 PolarHBondContact O-N 3.42Å |
| 124 | R | 70.1 | Confident | 65.2 | Low | 225 Ų | 225 | 89.1 Ų | 89.1 | 85% | 0.849 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -74.6 | -27.4 | 174.6 | -79 | 179.1 | 173.4 | -179.8 | -2.7 | 113.4 | K120 T121 | K120-R124 WeakPolarHBondContact O-CG 3.45Å; K120-R124 PolarHBondContact O-N 3.22Å; T121-R124 PolarHBondContact O-N 3.11Å |
| 125 | T | 64.4 | Low | 64.5 | Low | 26 Ų | 26 | 91.5 Ų | 91.5 | 16% | 0.16 | 50% | 0.497 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.6 | 2.7 | -179 | 59.6 | 0 | 0 | 0 | 0 | 113.6 | T121 L122 G127 R128 L129 L139 | T121-T125 HydrophobicContact CG2-CG2 4.42Å; T121-T125 PolarHBondContact O-N 3.23Å; T121-T125 PolarHBondContact O-OG1 3.46Å; T121-T125 VanDerWaalsContact O-OG1 3.13Å; L122-T125 PolarHBondContact O-N 3.49Å; L122-T125 PolarHBondContact O-OG1 3.36Å; T125-G127 PolarHBondContact O-N 2.78Å; T125-R128 WeakPolarHBondContact O-CA 3.5Å; T125-R128 VanDerWaalsContact O-CB 3.25Å; T125-R128 WeakPolarHBondContact O-CB 3.45Å; T125-R128 PolarHBondContact O-N 2.84Å; T125-L129 HydrophobicContact CG2-CD2 4.31Å; T125-L139 HydrophobicContact CG2-CD2 3.74Å |
| 126 | N | 67.3 | Low | 63.7 | Low | 150 Ų | 150 | 87.6 Ų | 87.6 | 80% | 0.802 | 48% | 0.482 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.6 | 43.4 | -171.3 | -66.8 | -31 | 0 | 0 | 0 | 112.1 | L122 R128 | L122-N126 PolarHBondContact O-N 3.04Å; N126-R128 PolarHBondContact O-N 2.93Å |
| 127 | G | 58.3 | Low | 63.4 | Low | 49 Ų | 49 | 92.3 Ų | 92.3 | 51% | 0.505 | 50% | 0.495 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 71.1 | -13.2 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115 | L122 T125 L129 | L122-G127 PolarHBondContact O-N 2.9Å; T125-G127 PolarHBondContact O-N 2.78Å; G127-L129 PolarHBondContact O-N 2.96Å |
| 128 | R | 51.9 | Low | 63.2 | Low | 181 Ų | 181 | 98.7 Ų | 98.7 | 68% | 0.683 | 52% | 0.517 | S | S | * | . | trans | -84 | 73.5 | -173 | -154.8 | 179.1 | -166.7 | -158 | 1.5 | 112 | T125 N126 T130 | T125-R128 WeakPolarHBondContact O-CA 3.5Å; T125-R128 VanDerWaalsContact O-CB 3.25Å; T125-R128 WeakPolarHBondContact O-CB 3.45Å; T125-R128 PolarHBondContact O-N 2.84Å; N126-R128 PolarHBondContact O-N 2.93Å; R128-T130 HydrophobicContact CG-CG2 3.53Å; R128-T130 PolarHBondContact O-N 2.6Å | ||
| 129 | L | 51.9 | Low | 63.2 | Low | 88 Ų | 88 | 98.6 Ų | 98.6 | 46% | 0.461 | 52% | 0.518 | S | S | . | . | trans | -72.5 | 51.7 | 160.4 | -72.4 | 173.6 | 0 | 0 | 0 | 111 | T121 T125 G127 T131 | T121-L129 HydrophobicContact CG2-CD2 4.29Å; T125-L129 HydrophobicContact CG2-CD2 4.31Å; G127-L129 PolarHBondContact O-N 2.96Å; L129-T131 PolarHBondContact O-N 2.82Å | ||
| 130 | T | 51.2 | Low | 63.2 | Low | 54 Ų | 54 | 94.5 Ų | 94.5 | 33% | 0.331 | 50% | 0.503 | S | S | . | . | trans | -69.5 | 106.8 | 175 | 39.7 | 0 | 0 | 0 | 0 | 110.4 | R128 S132 | R128-T130 HydrophobicContact CG-CG2 3.53Å; R128-T130 PolarHBondContact O-N 2.6Å; T130-S132 PolarHBondContact O-N 3.21Å | ||
| 131 | T | 51.5 | Low | 63.2 | Low | 99 Ų | 99 | 90.6 Ų | 90.6 | 61% | 0.607 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | -8 | 173.7 | 49.6 | 0 | 0 | 0 | 0 | 113.8 | L129 K137 | L129-T131 PolarHBondContact O-N 2.82Å; T131-K137 VanDerWaalsContact O-CE 3.22Å; T131-K137 WeakPolarHBondContact O-CE 3.48Å; T131-K137 VanDerWaalsContact O-CG 3.27Å; T131-K137 WeakPolarHBondContact O-CG 3.42Å |
| 132 | S | 53.5 | Low | 63.7 | Low | 97 Ų | 97 | 96.8 Ų | 96.8 | 68% | 0.678 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | -28 | -179.3 | 53.6 | 0 | 0 | 0 | 0 | 114.4 | T130 | T130-S132 PolarHBondContact O-N 3.21Š|
| 133 | G | 51.3 | Low | 64.3 | Low | 31 Ų | 31 | 96 Ų | 96 | 32% | 0.32 | 52% | 0.516 | S | S | . | . | S | Bend | trans | -87.9 | 142.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | A135 G136 K137 | G133-A135 PolarHBondContact O-N 3.33Å; G133-G136 CarbonylContact O-C 3.58Å; G133-G136 WeakPolarHBondContact O-CA 3.22Å; G133-G136 PolarHBondContact O-N 3.07Å; G133-K137 PolarHBondContact O-N 3.42Å |
| 134 | A | 60.4 | Low | 64.7 | Low | 76 Ų | 76 | 96.3 Ų | 96.3 | 63% | 0.628 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -56.5 | -33.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | R138 | A134-R138 WeakPolarHBondContact O-CG 3.09Å; A134-R138 PolarHBondContact O-N 3.13Å |
| 135 | A | 61 | Low | 65.4 | Low | 80 Ų | 80 | 92.1 Ų | 92.1 | 66% | 0.661 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -66.4 | -40.6 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | G133 R138 L139 | G133-A135 PolarHBondContact O-N 3.33Å; A135-R138 PolarHBondContact O-N 2.87Å; A135-L139 PolarHBondContact O-N 3.41Å |
| 136 | G | 59 | Low | 66.3 | Low | 23 Ų | 23 | 94.8 Ų | 94.8 | 24% | 0.237 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -62.5 | -46.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | G133 R138 L139 A140 | G133-G136 CarbonylContact O-C 3.58Å; G133-G136 WeakPolarHBondContact O-CA 3.22Å; G133-G136 PolarHBondContact O-N 3.07Å; G136-R138 PolarHBondContact O-N 3.16Å; G136-L139 PolarHBondContact O-N 2.93Å; G136-A140 WeakPolarHBondContact O-CB 3.12Å; G136-A140 PolarHBondContact O-N 3.47Å |
| 137 | K | 70.4 | Confident | 67.2 | Low | 137 Ų | 137 | 90.2 Ų | 90.2 | 60% | 0.596 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -58 | -45.4 | 173.4 | -65.1 | -174.9 | 179.6 | -177.4 | 0 | 111.9 | T131 G133 L139 A140 A141 | T131-K137 VanDerWaalsContact O-CE 3.22Å; T131-K137 WeakPolarHBondContact O-CE 3.48Å; T131-K137 VanDerWaalsContact O-CG 3.27Å; T131-K137 WeakPolarHBondContact O-CG 3.42Å; G133-K137 PolarHBondContact O-N 3.42Å; K137-L139 PolarHBondContact O-N 3.1Å; K137-A140 PolarHBondContact O-N 2.9Å; K137-A141 VanDerWaalsContact O-CB 3.28Å; K137-A141 WeakPolarHBondContact O-CB 3.28Å; K137-A141 PolarHBondContact O-N 2.98Å |
| 138 | R | 71.9 | Confident | 68.4 | Low | 195 Ų | 195 | 94.2 Ų | 94.2 | 74% | 0.736 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -64.1 | -36.9 | 176 | -76.7 | 179.7 | 176.9 | -177.1 | 0.2 | 113.4 | A134 A135 G136 K142 | A134-R138 WeakPolarHBondContact O-CG 3.09Å; A134-R138 PolarHBondContact O-N 3.13Å; A135-R138 PolarHBondContact O-N 2.87Å; G136-R138 PolarHBondContact O-N 3.16Å; R138-K142 WeakPolarHBondContact O-CG 3.41Å; R138-K142 PolarHBondContact O-N 3.03Å |
| 139 | L | 72.2 | Confident | 70.1 | Confident | 75 Ų | 75 | 89.2 Ų | 89.2 | 39% | 0.393 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -73.1 | -43.6 | 177.5 | -175.1 | 63.1 | 0 | 0 | 0 | 111.6 | T121 T125 A135 G136 K137 K142 F143 | T121-L139 HydrophobicContact CG2-CD2 4.47Å; T125-L139 HydrophobicContact CG2-CD2 3.74Å; A135-L139 PolarHBondContact O-N 3.41Å; G136-L139 PolarHBondContact O-N 2.93Å; K137-L139 PolarHBondContact O-N 3.1Å; L139-K142 PolarHBondContact O-N 2.76Å; L139-F143 PolarHBondContact O-N 3.03Å |
| 140 | A | 73.4 | Confident | 71.6 | Confident | 22 Ų | 22 | 86.3 Ų | 86.3 | 18% | 0.182 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -59.5 | -47.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111 | G136 K137 K142 F143 Y144 | G136-A140 WeakPolarHBondContact O-CB 3.12Å; G136-A140 PolarHBondContact O-N 3.47Å; K137-A140 PolarHBondContact O-N 2.9Å; A140-K142 VanDerWaalsContact C-N 3.32Å; A140-K142 PolarHBondContact O-N 3.49Å; A140-F143 WeakPolarHBondContact O-CB 3.41Å; A140-F143 PolarHBondContact O-N 3.34Å; A140-Y144 HydrophobicContact CB-CD2 4.32Å; A140-Y144 HydrophobicContact CB-CE2 4.16Å; A140-Y144 WeakPolarHBondContact O-CD2 3.46Å; A140-Y144 PolarHBondContact O-N 3.04Å |
| 141 | A | 76.5 | Confident | 73.2 | Confident | 59 Ų | 59 | 90.8 Ų | 90.8 | 49% | 0.488 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -57 | -42.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | K137 F143 F145 | K137-A141 VanDerWaalsContact O-CB 3.28Å; K137-A141 WeakPolarHBondContact O-CB 3.28Å; K137-A141 PolarHBondContact O-N 2.98Å; A141-F143 PolarHBondContact O-N 3.22Å; A141-F145 WeakPolarHBondContact O-CB 3.32Å; A141-F145 PolarHBondContact O-N 2.99Å |
| 142 | K | 80.8 | Confident | 74.8 | Confident | 155 Ų | 155 | 88.9 Ų | 88.9 | 67% | 0.674 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -63.4 | -38.8 | 173.8 | -74.8 | 176 | 179.3 | -176.4 | 0 | 112.7 | R138 L139 A140 F146 | R138-K142 WeakPolarHBondContact O-CG 3.41Å; R138-K142 PolarHBondContact O-N 3.03Å; L139-K142 PolarHBondContact O-N 2.76Å; A140-K142 VanDerWaalsContact C-N 3.32Å; A140-K142 PolarHBondContact O-N 3.49Å; K142-F146 WeakPolarHBondContact O-CB 3.44Å; K142-F146 PolarHBondContact O-N 3.29Å |
| 143 | F | 80.6 | Confident | 76.1 | Confident | 40 Ų | 40 | 87.5 Ų | 87.5 | 18% | 0.175 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -68.5 | -46.4 | 177.8 | -175.2 | -102.7 | 0 | 0 | 0 | 111.8 | Q117 H118 L139 A140 A141 F146 L147 | Q117-F143 HydrophobicContact CG-CE2 4.39Å; H118-F143 AromaticContact ND1-CZ 3.63Å; L139-F143 PolarHBondContact O-N 3.03Å; A140-F143 WeakPolarHBondContact O-CB 3.41Å; A140-F143 PolarHBondContact O-N 3.34Å; A141-F143 PolarHBondContact O-N 3.22Å; F143-F146 PolarHBondContact O-N 2.88Å; F143-L147 HydrophobicContact CD1-CD1 3.94Å; F143-L147 HydrophobicContact CD1-CG 4.47Å; F143-L147 HydrophobicContact CE1-CD1 3.46Å; F143-L147 VanDerWaalsContact CE1-CD1 3.46Å; F143-L147 HydrophobicContact CE1-CG 4.17Å; F143-L147 HydrophobicContact CZ-CD1 3.97Å; F143-L147 HydrophobicContact CZ-CG 4.32Å; F143-L147 WeakPolarHBondContact O-CG 3.42Å; F143-L147 PolarHBondContact O-N 2.82Å |
| 144 | Y | 82.2 | Confident | 77.5 | Confident | 161 Ų | 161 | 88 Ų | 88 | 63% | 0.631 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -63.6 | -40.6 | 174.8 | -72 | -62.9 | 0 | 0 | 0 | 112.5 | A140 F146 L147 F148 | A140-Y144 HydrophobicContact CB-CD2 4.32Å; A140-Y144 HydrophobicContact CB-CE2 4.16Å; A140-Y144 WeakPolarHBondContact O-CD2 3.46Å; A140-Y144 PolarHBondContact O-N 3.04Å; Y144-F146 PolarHBondContact O-N 2.89Å; Y144-L147 PolarHBondContact O-N 2.65Å; Y144-F148 WeakPolarHBondContact O-CB 3.47Å; Y144-F148 PolarHBondContact O-N 2.93Å |
| 145 | F | 84.1 | Confident | 78.3 | Confident | 136 Ų | 136 | 87.3 Ų | 87.3 | 60% | 0.596 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -64.3 | -38.9 | 175.6 | -174.9 | -107.4 | 0 | 0 | 0 | 112.4 | A141 F148 I149 | A141-F145 WeakPolarHBondContact O-CB 3.32Å; A141-F145 PolarHBondContact O-N 2.99Å; F145-F148 PolarHBondContact O-N 3.1Å; F145-I149 HydrophobicContact CD1-CD1 3.85Å; F145-I149 HydrophobicContact CE1-CD1 3.43Å; F145-I149 VanDerWaalsContact CE1-CD1 3.43Å; F145-I149 HydrophobicContact CE1-CG1 4.41Å; F145-I149 HydrophobicContact CZ-CD1 3.84Å; F145-I149 HydrophobicContact CZ-CG1 4.46Å; F145-I149 WeakPolarHBondContact O-CG1 3.47Å; F145-I149 PolarHBondContact O-N 2.98Å |
| 146 | F | 83.4 | Confident | 79 | Confident | 83 Ų | 83 | 89 Ų | 89 | 36% | 0.364 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -63.6 | -46 | 172.2 | 177.7 | -91 | 0 | 0 | 0 | 112 | Q117 K142 F143 Y144 F148 I149 V150 | Q117-F146 VanDerWaalsContact NE2-CE1 3.31Å; K142-F146 WeakPolarHBondContact O-CB 3.44Å; K142-F146 PolarHBondContact O-N 3.29Å; F143-F146 PolarHBondContact O-N 2.88Å; Y144-F146 PolarHBondContact O-N 2.89Å; F146-F148 VanDerWaalsContact C-N 3.29Å; F146-F148 PolarHBondContact O-N 3.49Å; F146-I149 PolarHBondContact O-N 2.86Å; F146-V150 HydrophobicContact CD1-CG2 4.16Å; F146-V150 HydrophobicContact CE1-CG2 3.71Å; F146-V150 HydrophobicContact CE2-CG2 4.46Å; F146-V150 HydrophobicContact CZ-CG2 3.89Å; F146-V150 WeakPolarHBondContact O-CB 3.44Å; F146-V150 WeakPolarHBondContact O-CG2 3.41Å; F146-V150 PolarHBondContact O-N 2.78Å |
| 147 | L | 85 | Confident | 79.8 | Confident | 54 Ų | 54 | 92.3 Ų | 92.3 | 28% | 0.283 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.2 | -37.1 | 175.1 | -74.3 | -178.2 | 0 | 0 | 0 | 112.4 | V114 F143 Y144 V150 R151 | V114-L147 HydrophobicContact CG1-CD2 4.06Å; V114-L147 HydrophobicContact CG2-CD2 4.36Å; F143-L147 HydrophobicContact CD1-CD1 3.94Å; F143-L147 HydrophobicContact CD1-CG 4.47Å; F143-L147 HydrophobicContact CE1-CD1 3.46Å; F143-L147 VanDerWaalsContact CE1-CD1 3.46Å; F143-L147 HydrophobicContact CE1-CG 4.17Å; F143-L147 HydrophobicContact CZ-CD1 3.97Å; F143-L147 HydrophobicContact CZ-CG 4.32Å; F143-L147 WeakPolarHBondContact O-CG 3.42Å; F143-L147 PolarHBondContact O-N 2.82Å; Y144-L147 PolarHBondContact O-N 2.65Å; L147-V150 PolarHBondContact O-N 3.47Å; L147-R151 WeakPolarHBondContact O-CB 3.46Å; L147-R151 PolarHBondContact O-N 3.44Å |
| 148 | F | 84.6 | Confident | 79.8 | Confident | 133 Ų | 133 | 90 Ų | 90 | 58% | 0.583 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -64.6 | -47.6 | 175.5 | 179.1 | -98.3 | 0 | 0 | 0 | 111.8 | Y144 F145 F146 V150 R151 V152 | Y144-F148 WeakPolarHBondContact O-CB 3.47Å; Y144-F148 PolarHBondContact O-N 2.93Å; F145-F148 PolarHBondContact O-N 3.1Å; F146-F148 VanDerWaalsContact C-N 3.29Å; F146-F148 PolarHBondContact O-N 3.49Å; F148-V150 VanDerWaalsContact C-N 3.31Å; F148-V150 PolarHBondContact O-N 2.74Å; F148-R151 WeakPolarHBondContact O-CB 3.47Å; F148-R151 PolarHBondContact O-N 2.9Å; F148-V152 HydrophobicContact CD1-CG2 4.27Å; F148-V152 HydrophobicContact CE1-CG2 3.85Å; F148-V152 HydrophobicContact CE2-CG2 4.16Å; F148-V152 HydrophobicContact CZ-CG2 3.79Å; F148-V152 WeakPolarHBondContact O-CG2 3.25Å; F148-V152 PolarHBondContact O-N 3.22Å |
| 149 | I | 87.1 | Confident | 79.4 | Confident | 76 Ų | 76 | 83.3 Ų | 83.3 | 39% | 0.39 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -58.2 | -45.7 | 173.9 | -71.1 | 167 | 0 | 0 | 0 | 110.6 | F145 F146 R151 V152 C153 | F145-I149 HydrophobicContact CD1-CD1 3.85Å; F145-I149 HydrophobicContact CE1-CD1 3.43Å; F145-I149 VanDerWaalsContact CE1-CD1 3.43Å; F145-I149 HydrophobicContact CE1-CG1 4.41Å; F145-I149 HydrophobicContact CZ-CD1 3.84Å; F145-I149 HydrophobicContact CZ-CG1 4.46Å; F145-I149 WeakPolarHBondContact O-CG1 3.47Å; F145-I149 PolarHBondContact O-N 2.98Å; F146-I149 PolarHBondContact O-N 2.86Å; I149-R151 VanDerWaalsContact C-N 3.34Å; I149-R151 PolarHBondContact O-N 2.82Å; I149-V152 PolarHBondContact O-N 2.85Å; I149-C153 WeakPolarHBondContact O-CB 3.47Å; I149-C153 PolarHBondContact O-N 2.99Å; I149-C153 PolarHBondContact O-SG 3.45Å; I149-C153 VanDerWaalsContact O-SG 3.33Å |
| 150 | V | 84 | Confident | 79.1 | Confident | 27 Ų | 27 | 82.4 Ų | 82.4 | 16% | 0.164 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -58.3 | -44.2 | 176.6 | 160.2 | 0 | 0 | 0 | 0 | 111.7 | L110 F146 L147 F148 C153 L154 | L110-V150 HydrophobicContact CD1-CG1 3.85Å; L110-V150 HydrophobicContact CD2-CG1 3.74Å; L110-V150 HydrophobicContact CG-CG1 4.07Å; F146-V150 HydrophobicContact CD1-CG2 4.16Å; F146-V150 HydrophobicContact CE1-CG2 3.71Å; F146-V150 HydrophobicContact CE2-CG2 4.46Å; F146-V150 HydrophobicContact CZ-CG2 3.89Å; F146-V150 WeakPolarHBondContact O-CB 3.44Å; F146-V150 WeakPolarHBondContact O-CG2 3.41Å; F146-V150 PolarHBondContact O-N 2.78Å; L147-V150 PolarHBondContact O-N 3.47Å; F148-V150 VanDerWaalsContact C-N 3.31Å; F148-V150 PolarHBondContact O-N 2.74Å; V150-C153 PolarHBondContact O-N 3.22Å; V150-L154 WeakPolarHBondContact O-CB 3.36Å; V150-L154 PolarHBondContact O-N 3.47Å |
| 151 | R | 84.4 | Confident | 78.5 | Confident | 147 Ų | 147 | 85 Ų | 85 | 56% | 0.555 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -62.3 | -46.3 | 176.6 | -169 | 78.8 | 173.6 | 121.1 | 1.3 | 111.6 | L147 F148 I149 L154 C155 | L147-R151 WeakPolarHBondContact O-CB 3.46Å; L147-R151 PolarHBondContact O-N 3.44Å; F148-R151 WeakPolarHBondContact O-CB 3.47Å; F148-R151 PolarHBondContact O-N 2.9Å; I149-R151 VanDerWaalsContact C-N 3.34Å; I149-R151 PolarHBondContact O-N 2.82Å; R151-L154 PolarHBondContact O-N 3.41Å; R151-C155 PolarHBondContact O-N 2.97Å; R151-C155 PolarHBondContact O-SG 2.91Å; R151-C155 VanDerWaalsContact O-SG 3.37Å |
| 152 | V | 84.4 | Confident | 77.4 | Confident | 60 Ų | 60 | 86.8 Ų | 86.8 | 36% | 0.364 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.5 | -42.8 | 178.3 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | F148 I149 L154 C155 L156 | F148-V152 HydrophobicContact CD1-CG2 4.27Å; F148-V152 HydrophobicContact CE1-CG2 3.85Å; F148-V152 HydrophobicContact CE2-CG2 4.16Å; F148-V152 HydrophobicContact CZ-CG2 3.79Å; F148-V152 WeakPolarHBondContact O-CG2 3.25Å; F148-V152 PolarHBondContact O-N 3.22Å; I149-V152 PolarHBondContact O-N 2.85Å; V152-L154 VanDerWaalsContact C-N 3.33Å; V152-L154 PolarHBondContact O-N 2.91Å; V152-C155 PolarHBondContact O-N 3.4Å; V152-L156 HydrophobicContact CG1-CD1 3.93Å; V152-L156 HydrophobicContact CG1-CG 4.5Å; V152-L156 WeakPolarHBondContact O-CB 3.17Å; V152-L156 WeakPolarHBondContact O-CG 3.36Å; V152-L156 PolarHBondContact O-N 3.19Å |
| 153 | C | 81.7 | Confident | 76 | Confident | 68 Ų | 68 | 85.8 Ų | 85.8 | 46% | 0.459 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -61.9 | -39.4 | 174.4 | -72.7 | 0 | 0 | 0 | 0 | 112.2 | I149 V150 L156 L157 | I149-C153 WeakPolarHBondContact O-CB 3.47Å; I149-C153 PolarHBondContact O-N 2.99Å; I149-C153 PolarHBondContact O-SG 3.45Å; I149-C153 VanDerWaalsContact O-SG 3.33Å; V150-C153 PolarHBondContact O-N 3.22Å; C153-L156 PolarHBondContact O-N 3.33Å; C153-L157 WeakPolarHBondContact O-CB 3.49Å; C153-L157 PolarHBondContact O-N 3.08Å |
| 154 | L | 80.7 | Confident | 74.4 | Confident | 41 Ų | 41 | 88.4 Ų | 88.4 | 22% | 0.215 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -63.4 | -49.2 | 175.9 | -169.8 | 69.9 | 0 | 0 | 0 | 111.1 | F106 V150 R151 V152 L156 L157 E158 | F106-L154 HydrophobicContact CD1-CD1 3.86Å; F106-L154 HydrophobicContact CE1-CD1 3.79Å; V150-L154 WeakPolarHBondContact O-CB 3.36Å; V150-L154 PolarHBondContact O-N 3.47Å; R151-L154 PolarHBondContact O-N 3.41Å; V152-L154 VanDerWaalsContact C-N 3.33Å; V152-L154 PolarHBondContact O-N 2.91Å; L154-L156 VanDerWaalsContact C-N 3.33Å; L154-L156 PolarHBondContact O-N 3.22Å; L154-L157 PolarHBondContact O-N 3.5Å; L154-L157 VanDerWaalsContact O-N 3.16Å; L154-E158 WeakPolarHBondContact O-CB 3.39Å; L154-E158 PolarHBondContact O-N 3.29Å |
| 155 | C | 76.1 | Confident | 72.5 | Confident | 61 Ų | 61 | 88.6 Ų | 88.6 | 41% | 0.412 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.1 | -36.6 | 177.8 | -65.5 | 0 | 0 | 0 | 0 | 113.1 | R151 V152 A159 | R151-C155 PolarHBondContact O-N 2.97Å; R151-C155 PolarHBondContact O-SG 2.91Å; R151-C155 VanDerWaalsContact O-SG 3.37Å; V152-C155 PolarHBondContact O-N 3.4Å; C155-A159 WeakPolarHBondContact O-CB 3.46Å; C155-A159 PolarHBondContact O-N 3.43Å |
| 156 | L | 76 | Confident | 70.3 | Confident | 115 Ų | 115 | 86.3 Ų | 86.3 | 60% | 0.602 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -68 | -37.3 | 174.6 | -75.5 | 168 | 0 | 0 | 0 | 112.6 | V152 C153 L154 A160 | V152-L156 HydrophobicContact CG1-CD1 3.93Å; V152-L156 HydrophobicContact CG1-CG 4.5Å; V152-L156 WeakPolarHBondContact O-CB 3.17Å; V152-L156 WeakPolarHBondContact O-CG 3.36Å; V152-L156 PolarHBondContact O-N 3.19Å; C153-L156 PolarHBondContact O-N 3.33Å; L154-L156 VanDerWaalsContact C-N 3.33Å; L154-L156 PolarHBondContact O-N 3.22Å; L156-A160 PolarHBondContact O-N 2.95Å; L156-A160 VanDerWaalsContact O-N 3.14Å |
| 157 | L | 76.3 | Confident | 68.1 | Low | 94 Ų | 94 | 87.5 Ų | 87.5 | 49% | 0.492 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -71.7 | -38 | 177.8 | -157 | 74.5 | 0 | 0 | 0 | 111.5 | F106 C153 L154 A160 S161 | F106-L157 HydrophobicContact CD1-CD2 3.79Å; F106-L157 HydrophobicContact CE1-CD2 3.84Å; F106-L157 HydrophobicContact CG-CD2 4.19Å; F106-L157 HydrophobicContact CZ-CD2 4.29Å; C153-L157 WeakPolarHBondContact O-CB 3.49Å; C153-L157 PolarHBondContact O-N 3.08Å; L154-L157 PolarHBondContact O-N 3.5Å; L154-L157 VanDerWaalsContact O-N 3.16Å; L157-A160 PolarHBondContact O-N 2.87Å; L157-S161 WeakPolarHBondContact O-CB 3.18Å; L157-S161 PolarHBondContact O-N 3.41Å |
| 158 | E | 71 | Confident | 65.6 | Low | 89 Ų | 89 | 90.4 Ų | 90.4 | 42% | 0.416 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.8 | -40.6 | 175.9 | -171.3 | 165.7 | -158.1 | 0 | 0 | 111.8 | L154 S161 N162 | L154-E158 WeakPolarHBondContact O-CB 3.39Å; L154-E158 PolarHBondContact O-N 3.29Å; E158-S161 PolarHBondContact O-N 2.93Å; E158-N162 PolarHBondContact O-N 3.37Å; E158-N162 PolarHBondContact O-ND2 3.12Å |
| 159 | A | 63.7 | Low | 63.2 | Low | 53 Ų | 53 | 93.5 Ų | 93.5 | 44% | 0.438 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59 | -49.1 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | C155 S161 N162 D163 | C155-A159 WeakPolarHBondContact O-CB 3.46Å; C155-A159 PolarHBondContact O-N 3.43Å; A159-S161 VanDerWaalsContact C-N 3.25Å; A159-S161 PolarHBondContact O-N 3.34Å; A159-N162 PolarHBondContact O-N 2.94Å; A159-D163 PolarHBondContact O-N 2.86Å |
| 160 | A | 64.2 | Low | 60.5 | Low | 57 Ų | 57 | 101.1 Ų | 101.1 | 47% | 0.471 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.5 | -28.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | L156 L157 S164 | L156-A160 PolarHBondContact O-N 2.95Å; L156-A160 VanDerWaalsContact O-N 3.14Å; L157-A160 PolarHBondContact O-N 2.87Å; A160-S164 PolarHBondContact O-OG 2.86Å |
| 161 | S | 60.8 | Low | 58.1 | Low | 75 Ų | 75 | 105.7 Ų | 105.7 | 52% | 0.524 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -74.7 | -36 | 174.7 | -168.4 | 0 | 0 | 0 | 0 | 112.6 | L157 E158 A159 S164 | L157-S161 WeakPolarHBondContact O-CB 3.18Å; L157-S161 PolarHBondContact O-N 3.41Å; E158-S161 PolarHBondContact O-N 2.93Å; A159-S161 VanDerWaalsContact C-N 3.25Å; A159-S161 PolarHBondContact O-N 3.34Å; S161-S164 WeakPolarHBondContact O-CB 3.27Å; S161-S164 PolarHBondContact O-N 3.42Å |
| 162 | N | 55.2 | Low | 55.6 | Low | 98 Ų | 98 | 105.1 Ų | 105.1 | 52% | 0.524 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -70.8 | -36.3 | -179.4 | -80.9 | -55.2 | 0 | 0 | 0 | 112.6 | E158 A159 S164 Q165 | E158-N162 PolarHBondContact O-N 3.37Å; E158-N162 PolarHBondContact O-ND2 3.12Å; A159-N162 PolarHBondContact O-N 2.94Å; N162-S164 PolarHBondContact O-N 2.84Å; N162-S164 VanDerWaalsContact O-N 3.1Å; N162-Q165 PolarHBondContact O-N 2.95Å |
| 163 | D | 50.5 | Low | 53.3 | Low | 133 Ų | 133 | 108.6 Ų | 108.6 | 71% | 0.711 | 62% | 0.617 | S | S | * | * | G | 310 helix | trans | -58.9 | -22.5 | 172 | -77.4 | -31.7 | 0 | 0 | 0 | 112.9 | A159 | A159-D163 PolarHBondContact O-N 2.86Š|
| 164 | S | 46.5 | Very low | 50.8 | Low | 95 Ų | 95 | 109 Ų | 109 | 66% | 0.664 | 62% | 0.619 | S | S | * | * | G | 310 helix | trans | -82.2 | -11.3 | -177.9 | -58.5 | 0 | 0 | 0 | 0 | 114.5 | A160 S161 N162 | A160-S164 PolarHBondContact O-OG 2.86Å; S161-S164 WeakPolarHBondContact O-CB 3.27Å; S161-S164 PolarHBondContact O-N 3.42Å; N162-S164 PolarHBondContact O-N 2.84Å; N162-S164 VanDerWaalsContact O-N 3.1Å |
| 165 | Q | 42.1 | Very low | 48.1 | Very low | 166 Ų | 166 | 114 Ų | 114 | 78% | 0.776 | 65% | 0.646 | S | S | * | * | G | 310 helix | trans | -98.3 | -6.1 | -178.8 | -74.7 | -78.1 | 6.6 | 0 | 0 | 113.8 | N162 V167 | N162-Q165 PolarHBondContact O-N 2.95Å; Q165-V167 VanDerWaalsContact C-N 3.28Å; Q165-V167 PolarHBondContact O-N 3.41Å |
| 166 | A | 38.9 | Very low | 45.9 | Very low | 88 Ų | 88 | 113.7 Ų | 113.7 | 73% | 0.727 | 65% | 0.647 | S | S | * | * | S | Bend | trans | -80.6 | 5.9 | -173.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 167 | V | 36 | Very low | 43.8 | Very low | 108 Ų | 108 | 115.3 Ų | 115.3 | 66% | 0.655 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -129.9 | 125.6 | -171.3 | -174.7 | 0 | 0 | 0 | 0 | 112.5 | Q165 | Q165-V167 VanDerWaalsContact C-N 3.28Å; Q165-V167 PolarHBondContact O-N 3.41Å |
| 168 | T | 32.9 | Very low | 41.7 | Very low | 115 Ų | 115 | 118 Ų | 118 | 71% | 0.706 | 67% | 0.67 | S | S | * | * | trans | 62.7 | 114.4 | 170.6 | 45.5 | 0 | 0 | 0 | 0 | 117 | ||||
| 169 | K | 35.6 | Very low | 40 | Very low | 197 Ų | 197 | 119.7 Ų | 119.7 | 86% | 0.857 | 69% | 0.688 | S | S | * | * | cis | -171.2 | 163.8 | 40.2 | -101.4 | 152 | -174.8 | -177.9 | 0 | 111.6 | ||||
| 170 | R | 29.4 | Very low | 38.7 | Very low | 236 Ų | 236 | 123.8 Ų | 123.8 | 89% | 0.891 | 71% | 0.707 | S | S | * | * | trans | -78.1 | 155.3 | -176.9 | -61.8 | 173.3 | 178.2 | -176.1 | -2.9 | 113.2 | ||||
| 171 | P | 34.1 | Very low | 37.3 | Very low | 124 Ų | 124 | 128.2 Ų | 128.2 | 81% | 0.805 | 73% | 0.728 | S | S | * | * | trans | -77.6 | 144.8 | 174.7 | 33 | -34.7 | 0 | 0 | 0 | 112.1 | ||||
| 172 | V | 31.6 | Very low | 35.9 | Very low | 134 Ų | 134 | 135.4 Ų | 135.4 | 81% | 0.812 | 74% | 0.744 | S | S | * | * | trans | -136.4 | 132.1 | 170 | 177.4 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 173 | V | 35.8 | Very low | 34.6 | Very low | 133 Ų | 133 | 138 Ų | 138 | 81% | 0.806 | 75% | 0.753 | S | S | * | * | trans | -119.3 | 128.4 | -178.2 | 175.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 174 | P | 29 | Very low | 33.4 | Very low | 77 Ų | 77 | 139.8 Ų | 139.8 | 50% | 0.5 | 76% | 0.757 | S | S | . | * | trans | -118.7 | 171 | 164.1 | 17.7 | 3.9 | 0 | 0 | 0 | 113.3 | Q197 | P174-Q197 VanDerWaalsContact CG-OE1 3.27Š| ||
| 175 | L | 23.9 | Very low | 32.5 | Very low | 147 Ų | 147 | 140.1 Ų | 140.1 | 77% | 0.77 | 76% | 0.759 | S | S | * | * | trans | -142.9 | 133.7 | -154 | -170.6 | 78.1 | 0 | 0 | 0 | 113.2 | ||||
| 176 | A | 30 | Very low | 31.7 | Very low | 53 Ų | 53 | 143.3 Ų | 143.3 | 44% | 0.438 | 76% | 0.764 | S | S | . | * | trans | 57.9 | 142.4 | 149.5 | 0 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 177 | T | 31.5 | Very low | 31 | Very low | 149 Ų | 149 | 147.9 Ų | 147.9 | 91% | 0.914 | 77% | 0.77 | S | S | * | * | 177.7 | 162.8 | 120.2 | 26.1 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 178 | K | 33.4 | Very low | 30.7 | Very low | 152 Ų | 152 | 147 Ų | 147 | 66% | 0.661 | 78% | 0.775 | S | S | * | * | trans | -127 | 162.3 | -166.9 | -56.3 | -175.8 | 174.1 | -160.1 | 0 | 114.5 | D191 | K178-D191 PolarHBondContact NZ-O 3.4Š| ||
| 179 | P | 34.2 | Very low | 30.5 | Very low | 123 Ų | 123 | 148.1 Ų | 148.1 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | -156.7 | 137.6 | 122.2 | 37 | -17.2 | 0 | 0 | 0 | 120.7 | |||||
| 180 | V | 36.1 | Very low | 30.6 | Very low | 139 Ų | 139 | 143.5 Ų | 143.5 | 84% | 0.842 | 77% | 0.772 | S | S | * | * | 42.6 | 115 | 124.7 | -169.7 | 0 | 0 | 0 | 0 | 125.4 | |||||
| 181 | V | 35.3 | Very low | 30.9 | Very low | 151 Ų | 151 | 138.4 Ų | 138.4 | 92% | 0.915 | 76% | 0.762 | S | S | * | * | trans | -141.9 | 176.1 | 147.4 | 175.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 182 | R | 31.4 | Very low | 30.6 | Very low | 225 Ų | 225 | 140.3 Ų | 140.3 | 85% | 0.849 | 76% | 0.76 | S | S | * | * | trans | -109.7 | 152.4 | -148.7 | -173 | 178.5 | 178.8 | 163.3 | -2.7 | 115.8 | ||||
| 183 | Q | 27.9 | Very low | 30.6 | Very low | 153 Ų | 153 | 140.3 Ų | 140.3 | 72% | 0.715 | 76% | 0.755 | S | S | * | * | trans | 111 | 95.2 | 147.3 | -148.1 | 160.6 | 4.9 | 0 | 0 | 120.6 | ||||
| 184 | Q | 26.1 | Very low | 30.3 | Very low | 170 Ų | 170 | 140 Ų | 140 | 79% | 0.794 | 75% | 0.749 | S | S | * | * | trans | 51.2 | 132.7 | 131.9 | -64.2 | 165.5 | -25.5 | 0 | 0 | 120.3 | ||||
| 185 | S | 27.1 | Very low | 30.7 | Very low | 102 Ų | 102 | 144.5 Ų | 144.5 | 71% | 0.713 | 76% | 0.763 | S | S | * | * | cis | -161.7 | 148 | 11.9 | 58.2 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 186 | R | 25.5 | Very low | 31 | Very low | 234 Ų | 234 | 146.8 Ų | 146.8 | 88% | 0.883 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 62.6 | 113.3 | 170 | -54.7 | -176.9 | -176.1 | -145.1 | 0.8 | 115.7 | ||
| 187 | Q | 24.3 | Very low | 31.2 | Very low | 183 Ų | 183 | 150.9 Ų | 150.9 | 86% | 0.855 | 78% | 0.78 | S | S | * | * | S | Bend | cis | -159.5 | 137.9 | -1.7 | -160.9 | 162.2 | -14.6 | 0 | 0 | 108.5 | ||
| 188 | A | 29.5 | Very low | 31.5 | Very low | 90 Ų | 90 | 152 Ų | 152 | 74% | 0.744 | 78% | 0.775 | S | S | * | * | S | Bend | trans | 72.6 | 77.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||
| 189 | T | 28.3 | Very low | 31.7 | Very low | 139 Ų | 139 | 152.1 Ų | 152.1 | 85% | 0.853 | 78% | 0.778 | S | S | * | * | trans | 73.3 | 109.1 | 132.3 | -25 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 190 | P | 37.3 | Very low | 31.8 | Very low | 99 Ų | 99 | 155.5 Ų | 155.5 | 64% | 0.643 | 78% | 0.782 | S | S | * | * | trans | -113.6 | -176.4 | -179.3 | 41.4 | -34.3 | 0 | 0 | 0 | 118.1 | ||||
| 191 | D | 35.7 | Very low | 31.6 | Very low | 129 Ų | 129 | 152.7 Ų | 152.7 | 69% | 0.69 | 77% | 0.774 | S | S | * | * | trans | 96.9 | 145.4 | 152.4 | -80.3 | -45.3 | 0 | 0 | 0 | 125.2 | K178 | K178-D191 PolarHBondContact NZ-O 3.4Š| ||
| 192 | Q | 29.4 | Very low | 31.6 | Very low | 164 Ų | 164 | 152 Ų | 152 | 77% | 0.766 | 77% | 0.769 | S | S | * | * | trans | -96.5 | 174 | -151.5 | -56.9 | 177.6 | -9.6 | 0 | 0 | 117.2 | ||||
| 193 | L | 31.2 | Very low | 31.8 | Very low | 135 Ų | 135 | 150.8 Ų | 150.8 | 71% | 0.707 | 77% | 0.77 | S | S | * | * | trans | 90.4 | 85.7 | 143.1 | -129.1 | 165 | 0 | 0 | 0 | 120.6 | Q195 | L193-Q195 HydrophobicContact CD2-CB 3.75Š| ||
| 194 | D | 30.2 | Very low | 32.4 | Very low | 125 Ų | 125 | 149.6 Ų | 149.6 | 67% | 0.668 | 77% | 0.773 | S | S | * | * | trans | -81.7 | 106 | 154.2 | -99.1 | -60.6 | 0 | 0 | 0 | 110.4 | ||||
| 195 | Q | 36 | Very low | 32.5 | Very low | 172 Ų | 172 | 150.4 Ų | 150.4 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | -158.5 | 44.3 | 160.3 | -144.5 | -176.1 | 116.7 | 0 | 0 | 116.8 | L193 | L193-Q195 HydrophobicContact CD2-CB 3.75Š| ||
| 196 | Q | 31.3 | Very low | 32.6 | Very low | 195 Ų | 195 | 151.5 Ų | 151.5 | 91% | 0.911 | 76% | 0.763 | S | S | * | * | trans | -153.8 | 87.7 | 156.5 | -138.5 | 177.9 | 5.1 | 0 | 0 | 114.7 | ||||
| 197 | Q | 33.2 | Very low | 32.8 | Very low | 139 Ų | 139 | 147.2 Ų | 147.2 | 65% | 0.65 | 75% | 0.753 | S | S | * | * | trans | -137.7 | 93.4 | 154.8 | -154.7 | -174.5 | 105.2 | 0 | 0 | 110.6 | P174 | P174-Q197 VanDerWaalsContact CG-OE1 3.27Š| ||
| 198 | Q | 37.4 | Very low | 33.4 | Very low | 173 Ų | 173 | 145.8 Ų | 145.8 | 81% | 0.808 | 75% | 0.75 | S | S | * | * | trans | -159.2 | 141.1 | 165.3 | -128.5 | 174.9 | 81.4 | 0 | 0 | 111.6 | ||||
| 199 | Q | 38.4 | Very low | 33.7 | Very low | 155 Ų | 155 | 146.8 Ų | 146.8 | 72% | 0.724 | 75% | 0.747 | S | S | * | * | trans | 83.5 | 79.1 | 165.6 | -51.6 | 177.9 | 34.5 | 0 | 0 | 119 | ||||
| 200 | H | 35.2 | Very low | 33.8 | Very low | 193 Ų | 193 | 145.8 Ų | 145.8 | 89% | 0.894 | 74% | 0.741 | S | S | * | * | -153.1 | 112.1 | 115.7 | -76.2 | -67.1 | 0 | 0 | 0 | 105.9 | |||||
| 201 | A | 32.4 | Very low | 33.7 | Very low | 81 Ų | 81 | 145 Ų | 145 | 67% | 0.669 | 75% | 0.751 | S | S | * | * | cis | 73.1 | 137.5 | 31 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 202 | V | 36.7 | Very low | 33.8 | Very low | 135 Ų | 135 | 143.7 Ų | 143.7 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | trans | 86.1 | 85.2 | 161.9 | -161.6 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 203 | K | 34.7 | Very low | 34.3 | Very low | 200 Ų | 200 | 145.7 Ų | 145.7 | 87% | 0.87 | 76% | 0.758 | S | S | * | * | trans | -166.9 | 127.1 | 138.9 | -103.2 | 166.8 | -177.1 | 176 | 0 | 104 | ||||
| 204 | V | 39.7 | Very low | 34.9 | Very low | 128 Ų | 128 | 145.4 Ų | 145.4 | 78% | 0.776 | 76% | 0.764 | S | S | * | * | cis | -145.1 | 126.3 | 18.9 | 169.1 | 0 | 0 | 0 | 0 | 105.3 | ||||
| 205 | R | 28.2 | Very low | 35.4 | Very low | 188 Ų | 188 | 143.8 Ų | 143.8 | 71% | 0.709 | 77% | 0.769 | S | S | * | * | cis | 74.7 | 110.4 | 49 | -174.1 | 177.5 | 169 | 166.7 | 1.3 | 113.5 | ||||
| 206 | Q | 30.7 | Very low | 36.1 | Very low | 124 Ų | 124 | 141.8 Ų | 141.8 | 58% | 0.579 | 77% | 0.77 | S | S | * | * | trans | 68 | 162.5 | 158.8 | -68.2 | 174.8 | -41.8 | 0 | 0 | 116.6 | ||||
| 207 | Q | 28.6 | Very low | 36.7 | Very low | 145 Ų | 145 | 138.5 Ų | 138.5 | 68% | 0.678 | 76% | 0.759 | S | S | * | * | cis | -158.3 | 171.9 | -17.6 | -109.5 | 156.7 | -20.4 | 0 | 0 | 106.4 | ||||
| 208 | L | 37.6 | Very low | 38.2 | Very low | 152 Ų | 152 | 137.2 Ų | 137.2 | 80% | 0.796 | 76% | 0.763 | S | S | * | * | 141.2 | 147.5 | 93.9 | -153.7 | 72.2 | 0 | 0 | 0 | 106.1 | |||||
| 209 | T | 35 | Very low | 38.6 | Very low | 111 Ų | 111 | 135.6 Ų | 135.6 | 68% | 0.681 | 76% | 0.76 | S | S | * | * | cis | -151.4 | 139.2 | -32.9 | -91.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 210 | V | 31.3 | Very low | 38.7 | Very low | 118 Ų | 118 | 137 Ų | 137 | 72% | 0.715 | 76% | 0.763 | S | S | * | * | trans | 17.7 | 132.4 | 147.1 | -169.9 | 0 | 0 | 0 | 0 | 120.9 | S212 | V210-S212 WeakPolarHBondContact CG1-OG 3.43Š| ||
| 211 | G | 34.8 | Very low | 39.1 | Very low | 84 Ų | 84 | 132.8 Ų | 132.8 | 87% | 0.866 | 75% | 0.753 | S | S | * | * | trans | -134.1 | 115.7 | 147.6 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 212 | S | 38.2 | Very low | 40.1 | Very low | 101 Ų | 101 | 137 Ų | 137 | 71% | 0.706 | 76% | 0.764 | S | S | * | * | trans | -139.2 | 128.7 | -173.1 | 50.5 | 0 | 0 | 0 | 0 | 112.8 | V210 | V210-S212 WeakPolarHBondContact CG1-OG 3.43Š| ||
| 213 | K | 39.5 | Very low | 40.3 | Very low | 206 Ų | 206 | 139.3 Ų | 139.3 | 90% | 0.896 | 76% | 0.764 | S | S | * | * | trans | -114.3 | 154.8 | 164 | -83.4 | -172.6 | 174.2 | -177 | 0 | 109.9 | ||||
| 214 | P | 43.1 | Very low | 40.2 | Very low | 128 Ų | 128 | 140.7 Ų | 140.7 | 83% | 0.831 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 158.5 | -153.3 | -16.3 | 32.8 | 0 | 0 | 0 | 115.6 | ||
| 215 | A | 42.5 | Very low | 40.3 | Very low | 92 Ų | 92 | 141 Ų | 141 | 76% | 0.76 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -84.4 | 145.4 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 216 | P | 49.1 | Very low | 40.6 | Very low | 129 Ų | 129 | 136.1 Ų | 136.1 | 84% | 0.838 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 133.3 | 171.7 | -19.4 | 32.5 | 0 | 0 | 0 | 112.3 | ||
| 217 | N | 45.1 | Very low | 40.6 | Very low | 127 Ų | 127 | 138 Ų | 138 | 68% | 0.679 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -81.6 | 125.1 | 178.2 | -177.5 | -17.5 | 0 | 0 | 0 | 110.9 | N219 | N217-N219 PolarHBondContact O-N 3.34Å; N217-N219 PolarHBondContact OD1-N 3Å |
| 218 | P | 65 | Low | 40.7 | Very low | 112 Ų | 112 | 137.9 Ų | 137.9 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | -77.8 | -8.3 | -176.5 | 31.3 | -36.3 | 0 | 0 | 0 | 115.5 | K220 | P218-K220 VanDerWaalsContact C-N 3.27Å; P218-K220 PolarHBondContact O-N 3.28Å; P218-K220 VanDerWaalsContact O-N 3.1Å | ||
| 219 | N | 44 | Very low | 40.5 | Very low | 139 Ų | 139 | 136.6 Ų | 136.6 | 74% | 0.743 | 78% | 0.78 | S | S | * | * | trans | -86.1 | 34.2 | -170.2 | -71 | -19.1 | 0 | 0 | 0 | 115.4 | N217 | N217-N219 PolarHBondContact O-N 3.34Å; N217-N219 PolarHBondContact OD1-N 3Å | ||
| 220 | K | 41 | Very low | 40.3 | Very low | 184 Ų | 184 | 138 Ų | 138 | 80% | 0.8 | 79% | 0.788 | S | S | * | * | trans | -134.3 | 110 | 163.2 | -74.5 | -168.3 | 177.9 | -173.5 | 0 | 110.2 | P218 N222 | P218-K220 VanDerWaalsContact C-N 3.27Å; P218-K220 PolarHBondContact O-N 3.28Å; P218-K220 VanDerWaalsContact O-N 3.1Å; K220-N222 PolarHBondContact O-N 2.95Å | ||
| 221 | P | 43.2 | Very low | 40.9 | Very low | 105 Ų | 105 | 137.9 Ų | 137.9 | 68% | 0.682 | 79% | 0.79 | S | S | * | * | trans | -70.7 | 114.3 | 165.3 | 29.5 | -30.5 | 0 | 0 | 0 | 108.1 | F223 | P221-F223 WeakPolarHBondContact O-CD2 3.41Å; P221-F223 PolarHBondContact O-N 3.42Å | ||
| 222 | N | 53.5 | Low | 40.7 | Very low | 168 Ų | 168 | 143.1 Ų | 143.1 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | trans | -72.1 | 120.3 | 171.4 | -118.1 | -17.9 | 0 | 0 | 0 | 108.3 | K220 | K220-N222 PolarHBondContact O-N 2.95Š| ||
| 223 | F | 41.9 | Very low | 40 | Very low | 185 Ų | 185 | 146.5 Ų | 146.5 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | trans | -67.1 | 138.9 | -169.2 | -85.2 | -99.9 | 0 | 0 | 0 | 112.3 | P221 V225 | P221-F223 WeakPolarHBondContact O-CD2 3.41Å; P221-F223 PolarHBondContact O-N 3.42Å; F223-V225 PolarHBondContact O-N 3.33Å | ||
| 224 | R | 32.5 | Very low | 39.3 | Very low | 229 Ų | 229 | 142.9 Ų | 142.9 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | -67.7 | 106.3 | 170.9 | -177.4 | -170.2 | -165.8 | -170.2 | 3.1 | 108.7 | S226 | R224-S226 PolarHBondContact O-N 2.84Š| ||
| 225 | V | 41.9 | Very low | 38.8 | Very low | 135 Ų | 135 | 141.1 Ų | 141.1 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | trans | -79.7 | 116.3 | 163.4 | -173 | 0 | 0 | 0 | 0 | 107.1 | F223 | F223-V225 PolarHBondContact O-N 3.33Š| ||
| 226 | S | 34.9 | Very low | 38.3 | Very low | 85 Ų | 85 | 143.2 Ų | 143.2 | 59% | 0.594 | 78% | 0.781 | S | S | * | * | trans | -69.2 | 144.4 | 175 | -67.8 | 0 | 0 | 0 | 0 | 110.8 | R224 | R224-S226 PolarHBondContact O-N 2.84Š| ||
| 227 | I | 29.8 | Very low | 37.5 | Very low | 163 Ų | 163 | 147 Ų | 147 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | trans | -89.4 | 101.8 | 172.7 | -58.7 | 157.6 | 0 | 0 | 0 | 106.6 | ||||
| 228 | D | 31.4 | Very low | 37.1 | Very low | 142 Ų | 142 | 147 Ų | 147 | 76% | 0.759 | 79% | 0.791 | S | S | * | * | trans | -153.7 | 87.5 | 168.6 | -88.5 | -48.3 | 0 | 0 | 0 | 110.9 | ||||
| 229 | S | 33.3 | Very low | 35.7 | Very low | 125 Ų | 125 | 144.6 Ų | 144.6 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | trans | -162.3 | 136 | 146.6 | -81.7 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 230 | V | 29.8 | Very low | 35.6 | Very low | 140 Ų | 140 | 144.1 Ų | 144.1 | 85% | 0.848 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -101.6 | 156.4 | -160.4 | 164.2 | 0 | 0 | 0 | 0 | 109.6 | ||
| 231 | P | 43.8 | Very low | 35.9 | Very low | 117 Ų | 117 | 142.2 Ų | 142.2 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -95.9 | 163.5 | -138.5 | 37.1 | -37.8 | 0 | 0 | 0 | 115.5 | ||
| 232 | Q | 30.9 | Very low | 35.8 | Very low | 193 Ų | 193 | 142.1 Ų | 142.1 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 154.7 | 156.2 | -83.1 | -172.5 | -49.7 | 0 | 0 | 112 | ||
| 233 | Q | 24 | Very low | 35.5 | Very low | 173 Ų | 173 | 137.5 Ų | 137.5 | 81% | 0.808 | 79% | 0.789 | S | S | * | * | trans | -43.5 | 157.2 | 161.8 | -73.4 | 167 | -107.4 | 0 | 0 | 113 | ||||
| 234 | D | 25.6 | Very low | 35.8 | Very low | 129 Ų | 129 | 132.7 Ų | 132.7 | 69% | 0.69 | 78% | 0.775 | S | S | * | * | cis | -155.2 | 177.1 | 22.5 | -136.8 | -50.3 | 0 | 0 | 0 | 112.7 | ||||
| 235 | S | 31.2 | Very low | 37 | Very low | 92 Ų | 92 | 125 Ų | 125 | 64% | 0.643 | 76% | 0.756 | S | S | * | * | trans | 75.6 | 133.2 | 161.8 | 76.9 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 236 | T | 31.8 | Very low | 38.3 | Very low | 135 Ų | 135 | 124.7 Ų | 124.7 | 83% | 0.828 | 75% | 0.754 | S | S | * | * | trans | 63 | 83.5 | 163.2 | 63 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 237 | K | 32.5 | Very low | 40.2 | Very low | 210 Ų | 210 | 129.3 Ų | 129.3 | 91% | 0.913 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -100.1 | 121.8 | 151.5 | -87.3 | 179.9 | 178.3 | 170.3 | 0 | 110.7 | ||
| 238 | P | 36.5 | Very low | 42 | Very low | 125 Ų | 125 | 123.5 Ų | 123.5 | 81% | 0.812 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 154.8 | 177.5 | 29.2 | -34.4 | 0 | 0 | 0 | 112.1 | ||
| 239 | G | 36.6 | Very low | 43.8 | Very low | 62 Ų | 62 | 121.1 Ų | 121.1 | 64% | 0.639 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 168.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | V241 | G239-V241 PolarHBondContact O-N 3.38Å; G239-V241 VanDerWaalsContact O-N 3.1Å |
| 240 | P | 41.9 | Very low | 46 | Very low | 130 Ų | 130 | 123.8 Ų | 123.8 | 84% | 0.844 | 72% | 0.717 | S | S | * | * | trans | -70.5 | 108.9 | -167.7 | 27.9 | -35.1 | 0 | 0 | 0 | 112.5 | S242 | P240-S242 PolarHBondContact O-N 2.82Š| ||
| 241 | V | 46.6 | Very low | 47.8 | Very low | 144 Ų | 144 | 119.9 Ų | 119.9 | 87% | 0.873 | 70% | 0.7 | S | S | * | * | trans | -65.7 | 87.5 | 157.6 | -77.3 | 0 | 0 | 0 | 0 | 108.8 | G239 G243 | G239-V241 PolarHBondContact O-N 3.38Å; G239-V241 VanDerWaalsContact O-N 3.1Å; V241-G243 VanDerWaalsContact C-N 3.25Å; V241-G243 PolarHBondContact O-N 2.97Å | ||
| 242 | S | 41.1 | Very low | 49.3 | Very low | 103 Ų | 103 | 121.8 Ų | 121.8 | 72% | 0.72 | 70% | 0.696 | S | S | * | * | trans | -63.6 | 85.2 | 177.2 | 173.1 | 0 | 0 | 0 | 0 | 110.3 | P240 V244 | P240-S242 PolarHBondContact O-N 2.82Å; S242-V244 PolarHBondContact O-N 3.49Å | ||
| 243 | G | 46.8 | Very low | 51.2 | Low | 71 Ų | 71 | 119.2 Ų | 119.2 | 73% | 0.732 | 69% | 0.687 | S | S | * | * | trans | -61.4 | 98.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110 | V241 S245 | V241-G243 VanDerWaalsContact C-N 3.25Å; V241-G243 PolarHBondContact O-N 2.97Å; G243-S245 VanDerWaalsContact C-N 3.35Å; G243-S245 PolarHBondContact O-N 3.44Å | ||
| 244 | V | 48.3 | Very low | 53.7 | Low | 84 Ų | 84 | 117.8 Ų | 117.8 | 51% | 0.509 | 68% | 0.681 | S | S | . | * | trans | -63.9 | 97.4 | 177.6 | -174.7 | 0 | 0 | 0 | 0 | 108.2 | S242 A248 L249 | S242-V244 PolarHBondContact O-N 3.49Å; V244-A248 HydrophobicContact CG1-CB 4.13Å; V244-L249 HydrophobicContact CG1-CB 4.19Å; V244-L249 HydrophobicContact CG1-CD1 4.27Å | ||
| 245 | S | 58.7 | Low | 55.2 | Low | 66 Ų | 66 | 117.9 Ų | 117.9 | 46% | 0.462 | 68% | 0.681 | S | S | . | * | trans | -58.1 | 148 | 179 | 72.7 | 0 | 0 | 0 | 0 | 110.2 | G243 K247 A248 L249 | G243-S245 VanDerWaalsContact C-N 3.35Å; G243-S245 PolarHBondContact O-N 3.44Å; S245-K247 PolarHBondContact O-N 3.42Å; S245-A248 WeakPolarHBondContact O-CB 3.35Å; S245-A248 PolarHBondContact O-N 3.07Å; S245-A248 PolarHBondContact OG-N 3.01Å; S245-L249 PolarHBondContact O-N 3.3Å; S245-L249 VanDerWaalsContact O-N 3.09Å | ||
| 246 | V | 69.8 | Low | 56.3 | Low | 129 Ų | 129 | 118.3 Ų | 118.3 | 78% | 0.782 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -55 | -27.6 | 178.5 | -178.8 | 0 | 0 | 0 | 0 | 111.6 | R250 | V246-R250 WeakPolarHBondContact O-CB 3.3Å; V246-R250 PolarHBondContact O-N 3.09Å |
| 247 | K | 75 | Confident | 57.6 | Low | 183 Ų | 183 | 117.4 Ų | 117.4 | 80% | 0.796 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -67.2 | -43.8 | 174.3 | -163.8 | 177.8 | -178.3 | -175.2 | 0 | 112.4 | S245 R250 A251 | S245-K247 PolarHBondContact O-N 3.42Å; K247-R250 PolarHBondContact O-N 2.97Å; K247-A251 PolarHBondContact O-N 3.46Å |
| 248 | A | 67.3 | Low | 58.5 | Low | 40 Ų | 40 | 116.5 Ų | 116.5 | 33% | 0.331 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -67.6 | -38.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | V244 S245 A251 K252 | V244-A248 HydrophobicContact CG1-CB 4.13Å; S245-A248 WeakPolarHBondContact O-CB 3.35Å; S245-A248 PolarHBondContact O-N 3.07Å; S245-A248 PolarHBondContact OG-N 3.01Å; A248-A251 PolarHBondContact O-N 2.64Å; A248-K252 PolarHBondContact O-N 3.43Å |
| 249 | L | 69.4 | Low | 59 | Low | 92 Ų | 92 | 118.8 Ų | 118.8 | 48% | 0.482 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -68.7 | -37 | 177.4 | -148.1 | 149.4 | 0 | 0 | 0 | 111.4 | V244 S245 K252 L253 | V244-L249 HydrophobicContact CG1-CB 4.19Å; V244-L249 HydrophobicContact CG1-CD1 4.27Å; S245-L249 PolarHBondContact O-N 3.3Å; S245-L249 VanDerWaalsContact O-N 3.09Å; L249-K252 PolarHBondContact O-N 3.08Å; L249-L253 HydrophobicContact CD2-CD1 3.92Å; L249-L253 HydrophobicContact CD2-CG 4.43Å; L249-L253 WeakPolarHBondContact O-CG 3.37Å; L249-L253 PolarHBondContact O-N 3.47Å; L249-L253 VanDerWaalsContact O-N 3.11Å |
| 250 | R | 77.9 | Confident | 59.3 | Low | 182 Ų | 182 | 125.4 Ų | 125.4 | 69% | 0.687 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -64.8 | -41.7 | 171.4 | -167.2 | 176.5 | -166.5 | 167.7 | 5.1 | 112.5 | V246 K247 L253 Q254 | V246-R250 WeakPolarHBondContact O-CB 3.3Å; V246-R250 PolarHBondContact O-N 3.09Å; K247-R250 PolarHBondContact O-N 2.97Å; R250-L253 PolarHBondContact O-N 3Å; R250-Q254 WeakPolarHBondContact O-CB 3.29Å; R250-Q254 PolarHBondContact O-N 3.35Å |
| 251 | A | 69 | Low | 59.2 | Low | 58 Ų | 58 | 124.5 Ų | 124.5 | 48% | 0.479 | 69% | 0.687 | S | S | . | * | H | α-helix | trans | -62.3 | -44.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | K247 A248 L253 Q254 N255 | K247-A251 PolarHBondContact O-N 3.46Å; A248-A251 PolarHBondContact O-N 2.64Å; A251-L253 VanDerWaalsContact C-N 3.29Å; A251-L253 PolarHBondContact O-N 3.09Å; A251-Q254 PolarHBondContact O-N 3.49Å; A251-Q254 VanDerWaalsContact O-N 3.12Å; A251-N255 PolarHBondContact O-N 2.88Å |
| 252 | K | 75.1 | Confident | 59.2 | Low | 156 Ų | 156 | 123.7 Ų | 123.7 | 68% | 0.678 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -63.2 | -29.7 | 175.8 | -75.9 | -171.6 | 173.1 | -170.8 | 0 | 114 | A248 L249 | A248-K252 PolarHBondContact O-N 3.43Å; L249-K252 PolarHBondContact O-N 3.08Å |
| 253 | L | 70.1 | Confident | 59.1 | Low | 139 Ų | 139 | 123.8 Ų | 123.8 | 73% | 0.728 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -79 | -25.6 | 173.7 | -74.5 | 171.1 | 0 | 0 | 0 | 113.2 | L249 R250 A251 | L249-L253 HydrophobicContact CD2-CD1 3.92Å; L249-L253 HydrophobicContact CD2-CG 4.43Å; L249-L253 WeakPolarHBondContact O-CG 3.37Å; L249-L253 PolarHBondContact O-N 3.47Å; L249-L253 VanDerWaalsContact O-N 3.11Å; R250-L253 PolarHBondContact O-N 3Å; A251-L253 VanDerWaalsContact C-N 3.29Å; A251-L253 PolarHBondContact O-N 3.09Å |
| 254 | Q | 76.1 | Confident | 58.5 | Low | 144 Ų | 144 | 125 Ų | 125 | 67% | 0.673 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -92 | -19.6 | -177.7 | -164.3 | 158.9 | -2.4 | 0 | 0 | 113 | R250 A251 | R250-Q254 WeakPolarHBondContact O-CB 3.29Å; R250-Q254 PolarHBondContact O-N 3.35Å; A251-Q254 PolarHBondContact O-N 3.49Å; A251-Q254 VanDerWaalsContact O-N 3.12Å |
| 255 | N | 58.3 | Low | 58 | Low | 131 Ų | 131 | 128.7 Ų | 128.7 | 70% | 0.701 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -134.5 | 98.1 | 168.2 | -81.9 | -52.3 | 0 | 0 | 0 | 109.9 | A251 | A251-N255 PolarHBondContact O-N 2.88Š|
| 256 | P | 53.4 | Low | 56.8 | Low | 100 Ų | 100 | 132.3 Ų | 132.3 | 65% | 0.649 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 132.9 | 171.3 | 29.2 | -32.7 | 0 | 0 | 0 | 109.8 | Q258 | P256-Q258 PolarHBondContact O-N 3.31Š|
| 257 | P | 58.7 | Low | 54.9 | Low | 117 Ų | 117 | 130.7 Ų | 130.7 | 76% | 0.76 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 122.1 | 175.3 | 26.9 | -32.7 | 0 | 0 | 0 | 109.8 | L259 | P257-L259 PolarHBondContact O-N 3.09Š|
| 258 | Q | 51.6 | Low | 53.2 | Low | 191 Ų | 191 | 130.5 Ų | 130.5 | 89% | 0.893 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 129 | 175.2 | -69.3 | -170.8 | -6 | 0 | 0 | 110.1 | P256 K260 | P256-Q258 PolarHBondContact O-N 3.31Å; Q258-K260 PolarHBondContact O-N 3.22Å |
| 259 | L | 46.8 | Very low | 51.4 | Low | 172 Ų | 172 | 136.3 Ų | 136.3 | 90% | 0.901 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 122.7 | 179.7 | -65.1 | 165.4 | 0 | 0 | 0 | 109.8 | P257 | P257-L259 PolarHBondContact O-N 3.09Š|
| 260 | K | 43.4 | Very low | 49.6 | Very low | 202 Ų | 202 | 142.1 Ų | 142.1 | 88% | 0.878 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -96.4 | 125.7 | 165.3 | -152.1 | 172.1 | -173.6 | -179.6 | 0 | 107.7 | Q258 | Q258-K260 PolarHBondContact O-N 3.22Š|
| 261 | P | 40.9 | Very low | 48.2 | Very low | 110 Ų | 110 | 137.9 Ų | 137.9 | 71% | 0.714 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 150.9 | -169.1 | 26.9 | -34.7 | 0 | 0 | 0 | 112.6 | S263 | P261-S263 PolarHBondContact O-N 3.36Š|
| 262 | P | 44.8 | Very low | 46.6 | Very low | 127 Ų | 127 | 143.2 Ų | 143.2 | 83% | 0.825 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 124.6 | 178.6 | 30 | -33.4 | 0 | 0 | 0 | 110.8 | ||
| 263 | S | 38.9 | Very low | 44.5 | Very low | 105 Ų | 105 | 139.4 Ų | 139.4 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 126 | 172.8 | -159.6 | 0 | 0 | 0 | 0 | 110.1 | P261 | P261-S263 PolarHBondContact O-N 3.36Š|
| 264 | S | 35.7 | Very low | 42.9 | Very low | 97 Ų | 97 | 137.7 Ų | 137.7 | 68% | 0.678 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -91.2 | 125.4 | -179.5 | 53 | 0 | 0 | 0 | 0 | 112.3 | ||
| 265 | H | 37 | Very low | 40.6 | Very low | 161 Ų | 161 | 135.5 Ų | 135.5 | 75% | 0.745 | 77% | 0.767 | S | S | * | * | trans | -123.4 | 112.4 | 154.7 | -65.8 | -76.3 | 0 | 0 | 0 | 106 | ||||
| 266 | L | 33.3 | Very low | 39.4 | Very low | 142 Ų | 142 | 136.4 Ų | 136.4 | 74% | 0.743 | 77% | 0.767 | S | S | * | * | 60.3 | 134.2 | 87.8 | -84.3 | 85.6 | 0 | 0 | 0 | 112 | |||||
| 267 | S | 31.1 | Very low | 38.1 | Very low | 95 Ų | 95 | 138.9 Ų | 138.9 | 66% | 0.664 | 77% | 0.77 | S | S | * | * | cis | -173 | -172.7 | -4.2 | -111.4 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 268 | Q | 38.8 | Very low | 36.9 | Very low | 180 Ų | 180 | 141.4 Ų | 141.4 | 84% | 0.841 | 78% | 0.775 | S | S | * | * | trans | 81.8 | 138.7 | 165.4 | -48.3 | -177.6 | 17.9 | 0 | 0 | 116.2 | ||||
| 269 | H | 30.2 | Very low | 35.9 | Very low | 162 Ų | 162 | 136.9 Ų | 136.9 | 75% | 0.75 | 77% | 0.765 | S | S | * | * | cis | -158.9 | 122.3 | -17.6 | -141.1 | -124 | 0 | 0 | 0 | 110.5 | ||||
| 270 | R | 30 | Very low | 35.1 | Very low | 213 Ų | 213 | 135 Ų | 135 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | 59.7 | 171.3 | 128.4 | -124 | -160.9 | 164.4 | 133 | -1.8 | 120.7 | |||||
| 271 | P | 49.7 | Very low | 34.7 | Very low | 94 Ų | 94 | 136.7 Ų | 136.7 | 61% | 0.61 | 76% | 0.761 | S | S | * | * | -126.3 | 168.3 | -85 | 39 | -24.8 | 0 | 0 | 0 | 116.7 | |||||
| 272 | N | 35.4 | Very low | 34.2 | Very low | 170 Ų | 170 | 140.1 Ų | 140.1 | 91% | 0.909 | 77% | 0.767 | S | S | * | * | trans | -168.2 | 143.3 | 133.3 | -92.1 | -22.4 | 0 | 0 | 0 | 106.2 | ||||
| 273 | G | 29.2 | Very low | 33.9 | Very low | 76 Ų | 76 | 142.4 Ų | 142.4 | 78% | 0.784 | 77% | 0.767 | S | S | * | * | cis | 147.2 | 46.7 | 7.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 274 | A | 37.2 | Very low | 33.6 | Very low | 102 Ų | 102 | 143.7 Ų | 143.7 | 84% | 0.843 | 78% | 0.775 | S | S | * | * | trans | -163.3 | 106.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 275 | S | 28.8 | Very low | 33.8 | Very low | 98 Ų | 98 | 144 Ų | 144 | 69% | 0.685 | 78% | 0.778 | S | S | * | * | trans | -76.2 | 170.2 | 157.7 | -101.6 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 276 | H | 33.2 | Very low | 33.7 | Very low | 150 Ų | 150 | 142 Ų | 142 | 69% | 0.694 | 78% | 0.782 | S | S | * | * | cis | -145.9 | 154.9 | 4.2 | -116.2 | -69.4 | 0 | 0 | 0 | 109.9 | ||||
| 277 | E | 25.1 | Very low | 33.9 | Very low | 153 Ų | 153 | 143.5 Ų | 143.5 | 72% | 0.715 | 79% | 0.79 | S | S | * | * | trans | 8.9 | 141.5 | 152.4 | -66.6 | 168.2 | 102.8 | 0 | 0 | 122.3 | ||||
| 278 | I | 34.4 | Very low | 34.1 | Very low | 170 Ų | 170 | 143.7 Ų | 143.7 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | -149.2 | 126.4 | 110.9 | -96 | 147.3 | 0 | 0 | 0 | 111.4 | |||||
| 279 | S | 29.5 | Very low | 33.9 | Very low | 96 Ų | 96 | 143.3 Ų | 143.3 | 67% | 0.671 | 79% | 0.794 | S | S | * | * | trans | 46.4 | 97.8 | 154.2 | -150.6 | 0 | 0 | 0 | 0 | 122.1 | R281 | S279-R281 PolarHBondContact O-N 2.99Š| ||
| 280 | V | 30.5 | Very low | 34.3 | Very low | 132 Ų | 132 | 141.8 Ų | 141.8 | 80% | 0.8 | 80% | 0.796 | S | S | * | * | 14.4 | 104.8 | 122.9 | -168.8 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 281 | R | 35 | Very low | 34.5 | Very low | 238 Ų | 238 | 134.9 Ų | 134.9 | 90% | 0.898 | 78% | 0.784 | S | S | * | * | trans | -146.8 | 132 | 148 | -139.6 | 175.1 | -173.2 | -175.6 | 2.4 | 111.9 | S279 Q283 | S279-R281 PolarHBondContact O-N 2.99Å; R281-Q283 PolarHBondContact O-N 3.46Å | ||
| 282 | H | 31.3 | Very low | 34 | Very low | 182 Ų | 182 | 140.3 Ų | 140.3 | 84% | 0.843 | 80% | 0.798 | S | S | * | * | trans | -51.4 | 120.7 | -174.7 | -61.1 | -93.8 | 0 | 0 | 0 | 113.3 | ||||
| 283 | Q | 36.6 | Very low | 33.9 | Very low | 175 Ų | 175 | 135.7 Ų | 135.7 | 82% | 0.818 | 79% | 0.791 | S | S | * | * | trans | -129.5 | 111.3 | 152.4 | -69.7 | -162.2 | 11.5 | 0 | 0 | 110 | R281 S285 | R281-Q283 PolarHBondContact O-N 3.46Å; Q283-S285 PolarHBondContact O-N 3.06Å; Q283-S285 VanDerWaalsContact O-N 3.13Å | ||
| 284 | S | 33.7 | Very low | 34 | Very low | 131 Ų | 131 | 144 Ų | 144 | 92% | 0.916 | 80% | 0.799 | S | S | * | * | trans | -59.9 | 105 | 162.3 | 47.8 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 285 | S | 40.1 | Very low | 34.1 | Very low | 104 Ų | 104 | 145 Ų | 145 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -123.7 | 140.8 | 172.7 | 49.3 | 0 | 0 | 0 | 0 | 110.5 | Q283 | Q283-S285 PolarHBondContact O-N 3.06Å; Q283-S285 VanDerWaalsContact O-N 3.13Å | ||
| 286 | S | 33.6 | Very low | 34.3 | Very low | 119 Ų | 119 | 145.5 Ų | 145.5 | 83% | 0.832 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 125 | -170.8 | 49.2 | 0 | 0 | 0 | 0 | 112.7 | ||
| 287 | L | 37.4 | Very low | 34.7 | Very low | 174 Ų | 174 | 145 Ų | 145 | 91% | 0.911 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 125.3 | 161.2 | -80 | 171.2 | 0 | 0 | 0 | 110.8 | ||
| 288 | S | 36.8 | Very low | 35.1 | Very low | 98 Ų | 98 | 145.4 Ų | 145.4 | 69% | 0.685 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 128 | -179.8 | 36.9 | 0 | 0 | 0 | 0 | 111.7 | V290 | S288-V290 PolarHBondContact O-N 3.04Š|
| 289 | L | 34.1 | Very low | 34.9 | Very low | 173 Ų | 173 | 146 Ų | 146 | 91% | 0.906 | 81% | 0.809 | S | S | * | * | trans | -83.2 | 92.5 | 162.8 | -98.5 | 161.4 | 0 | 0 | 0 | 109.1 | A291 | L289-A291 VanDerWaalsContact C-N 3.28Å; L289-A291 PolarHBondContact O-N 3.41Å | ||
| 290 | V | 38.3 | Very low | 35.1 | Very low | 130 Ų | 130 | 151 Ų | 151 | 79% | 0.788 | 82% | 0.821 | S | S | * | * | trans | -69.8 | 87 | 168.7 | -176.9 | 0 | 0 | 0 | 0 | 108.5 | S288 | S288-V290 PolarHBondContact O-N 3.04Š| ||
| 291 | A | 34.3 | Very low | 35.2 | Very low | 68 Ų | 68 | 150.5 Ų | 150.5 | 56% | 0.562 | 82% | 0.819 | S | S | * | * | trans | -89.4 | 150.2 | 161.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | L289 | L289-A291 VanDerWaalsContact C-N 3.28Å; L289-A291 PolarHBondContact O-N 3.41Å | ||
| 292 | F | 39 | Very low | 35 | Very low | 207 Ų | 207 | 147.7 Ų | 147.7 | 91% | 0.908 | 82% | 0.816 | S | S | * | * | S | Bend | trans | 80.1 | 79.9 | -177.3 | -50.8 | -72.6 | 0 | 0 | 0 | 116.5 | ||
| 293 | G | 34.5 | Very low | 35.3 | Very low | 73 Ų | 73 | 148.8 Ų | 148.8 | 75% | 0.753 | 82% | 0.821 | S | S | * | * | 81.3 | 88.8 | 117.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | P295 | G293-P295 WeakPolarHBondContact O-CD 3.44Š| |||
| 294 | R | 30.6 | Very low | 35.1 | Very low | 250 Ų | 250 | 148.3 Ų | 148.3 | 94% | 0.943 | 82% | 0.824 | S | S | * | * | trans | -80.2 | 117.1 | 142.6 | -81.2 | -174.6 | 169.2 | -155.9 | -2.3 | 108.8 | ||||
| 295 | P | 39.8 | Very low | 35.2 | Very low | 124 Ų | 124 | 152.8 Ų | 152.8 | 81% | 0.805 | 82% | 0.821 | S | S | * | * | trans | -72.8 | 131.9 | 147.9 | 31.4 | -29.1 | 0 | 0 | 0 | 107.9 | G293 | G293-P295 WeakPolarHBondContact O-CD 3.44Š| ||
| 296 | S | 31.8 | Very low | 35 | Very low | 109 Ų | 109 | 154.1 Ų | 154.1 | 76% | 0.762 | 83% | 0.825 | S | S | * | * | trans | -100.4 | 102.4 | 173.6 | -167.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 297 | V | 41.6 | Very low | 35.4 | Very low | 140 Ų | 140 | 153.8 Ų | 153.8 | 85% | 0.848 | 83% | 0.829 | S | S | * | * | trans | -139.8 | 121.4 | 158.6 | -176.2 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 298 | E | 35 | Very low | 35.3 | Very low | 161 Ų | 161 | 148.9 Ų | 148.9 | 75% | 0.752 | 82% | 0.821 | S | S | * | * | trans | -79.9 | 164.2 | 176.5 | -72.2 | 150 | 113.9 | 0 | 0 | 111.2 | ||||
| 299 | Q | 29.6 | Very low | 35.2 | Very low | 183 Ų | 183 | 155.1 Ų | 155.1 | 86% | 0.855 | 84% | 0.836 | S | S | * | * | trans | 61.2 | 91.4 | 164.7 | -65.4 | 177.4 | -17.1 | 0 | 0 | 117.7 | ||||
| 300 | Q | 33.3 | Very low | 35.5 | Very low | 200 Ų | 200 | 152 Ų | 152 | 94% | 0.935 | 83% | 0.828 | S | S | * | * | -144.8 | 107.5 | 116.8 | -140.8 | 168.4 | -8.7 | 0 | 0 | 110.4 | |||||
| 301 | T | 32.5 | Very low | 35.4 | Very low | 121 Ų | 121 | 151.4 Ų | 151.4 | 74% | 0.742 | 83% | 0.83 | S | S | * | * | trans | -78.2 | 161.3 | 173 | -40.1 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 302 | E | 31.8 | Very low | 36 | Very low | 180 Ų | 180 | 154.2 Ų | 154.2 | 84% | 0.841 | 84% | 0.84 | S | S | * | * | trans | 70.3 | 82.7 | 170.6 | -53.5 | -165.5 | 122.4 | 0 | 0 | 117.5 | ||||
| 303 | Q | 36.3 | Very low | 36 | Very low | 204 Ų | 204 | 149 Ų | 149 | 95% | 0.953 | 83% | 0.827 | S | S | * | * | trans | -147.5 | 53.3 | 131.7 | -130.1 | 175 | 22.2 | 0 | 0 | 113.4 | R305 | Q303-R305 PolarHBondContact O-N 3.28Š| ||
| 304 | D | 32.5 | Very low | 36.2 | Very low | 165 Ų | 165 | 155.2 Ų | 155.2 | 88% | 0.882 | 83% | 0.834 | S | S | * | * | trans | -74.5 | 99.7 | 159.7 | -124.9 | -35.8 | 0 | 0 | 0 | 108.5 | ||||
| 305 | R | 37.5 | Very low | 37.1 | Very low | 225 Ų | 225 | 148 Ų | 148 | 85% | 0.849 | 83% | 0.827 | S | S | * | * | trans | -178.7 | 136.5 | 143 | -103.8 | 168.4 | -178.2 | 171.3 | 2.2 | 116.1 | Q303 | Q303-R305 PolarHBondContact O-N 3.28Š| ||
| 306 | T | 35.3 | Very low | 37.7 | Very low | 132 Ų | 132 | 152.1 Ų | 152.1 | 81% | 0.81 | 83% | 0.833 | S | S | * | * | trans | 59.8 | 89.7 | 146.7 | 52.7 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 307 | A | 42.4 | Very low | 39.4 | Very low | 112 Ų | 112 | 150.9 Ų | 150.9 | 93% | 0.926 | 83% | 0.829 | S | S | * | * | -179.4 | 142.2 | 116.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 308 | G | 35.1 | Very low | 40.6 | Very low | 71 Ų | 71 | 149.8 Ų | 149.8 | 73% | 0.732 | 83% | 0.825 | S | S | * | * | cis | 164.9 | 134 | 5.6 | 0 | 0 | 0 | 0 | 0 | 106 | S310 | G308-S310 PolarHBondContact O-N 3.46Š| ||
| 309 | F | 33.3 | Very low | 42.4 | Very low | 230 Ų | 230 | 147.6 Ų | 147.6 | 100% | 1.009 | 83% | 0.825 | S | S | * | * | trans | -62.8 | 134.5 | -172.8 | -73.1 | -102.9 | 0 | 0 | 0 | 112 | ||||
| 310 | S | 40.5 | Very low | 44.8 | Very low | 106 Ų | 106 | 144.2 Ų | 144.2 | 74% | 0.741 | 82% | 0.819 | S | S | * | * | trans | -142.3 | 102.9 | 159.1 | -167.6 | 0 | 0 | 0 | 0 | 110.7 | G308 | G308-S310 PolarHBondContact O-N 3.46Š| ||
| 311 | S | 36 | Very low | 47 | Very low | 118 Ų | 118 | 140.7 Ų | 140.7 | 83% | 0.825 | 81% | 0.813 | S | S | * | * | trans | -83.3 | 113 | 171.2 | 52.1 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 312 | V | 47.3 | Very low | 49.2 | Very low | 128 Ų | 128 | 142.6 Ų | 142.6 | 78% | 0.776 | 82% | 0.818 | S | S | * | * | trans | -122.1 | 114.6 | 168.1 | -144.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 313 | P | 39.2 | Very low | 51.4 | Low | 98 Ų | 98 | 139.9 Ų | 139.9 | 64% | 0.636 | 82% | 0.816 | S | S | * | * | trans | -89.6 | 160.2 | -179.8 | 37.7 | -35.8 | 0 | 0 | 0 | 111.5 | ||||
| 314 | F | 39.3 | Very low | 53.4 | Low | 202 Ų | 202 | 134.8 Ų | 134.8 | 89% | 0.886 | 81% | 0.808 | S | S | * | * | trans | 60.1 | 86.7 | 168.8 | -62.2 | -78.5 | 0 | 0 | 0 | 118.6 | ||||
| 315 | A | 50 | Low | 55.4 | Low | 98 Ų | 98 | 136.3 Ų | 136.3 | 81% | 0.81 | 81% | 0.807 | S | S | * | * | -134.4 | 112.2 | 127.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | A317 | A315-A317 VanDerWaalsContact C-N 3.34Å; A315-A317 PolarHBondContact O-N 2.82Å | |||
| 316 | K | 50.7 | Low | 57.2 | Low | 212 Ų | 212 | 131.1 Ų | 131.1 | 92% | 0.922 | 80% | 0.803 | S | S | * | * | trans | -74 | 90.5 | -179.1 | -164.3 | 167.1 | -172.9 | 169.8 | 0 | 108.2 | ||||
| 317 | A | 68.3 | Low | 59 | Low | 83 Ų | 83 | 130.5 Ų | 130.5 | 69% | 0.686 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 135.9 | -175.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | A315 | A315-A317 VanDerWaalsContact C-N 3.34Å; A315-A317 PolarHBondContact O-N 2.82Å |
| 318 | P | 66 | Low | 60.4 | Low | 117 Ų | 117 | 129.6 Ų | 129.6 | 76% | 0.76 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 140.8 | -179.7 | 24.6 | -33.4 | 0 | 0 | 0 | 109.7 | ||
| 319 | P | 74 | Confident | 62.1 | Low | 115 Ų | 115 | 138 Ų | 138 | 75% | 0.747 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 143.2 | -178.2 | 24.7 | -33.8 | 0 | 0 | 0 | 110.5 | ||
| 320 | P | 79.4 | Confident | 63.9 | Low | 112 Ų | 112 | 134.8 Ų | 134.8 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 146.7 | -175.8 | 24.6 | -34.4 | 0 | 0 | 0 | 111.3 | L322 | P320-L322 PolarHBondContact O-N 3.46Š|
| 321 | P | 79.2 | Confident | 65.3 | Low | 125 Ų | 125 | 133.3 Ų | 133.3 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 134.8 | -179.1 | 24.9 | -33.9 | 0 | 0 | 0 | 110.7 | ||
| 322 | L | 79.5 | Confident | 67.1 | Low | 161 Ų | 161 | 130 Ų | 130 | 84% | 0.843 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -60 | 141.2 | 177.8 | -67.4 | 174.9 | 0 | 0 | 0 | 110.6 | P320 A324 | P320-L322 PolarHBondContact O-N 3.46Å; L322-A324 PolarHBondContact O-N 3.45Å |
| 323 | P | 78.5 | Confident | 68.3 | Low | 123 Ų | 123 | 129.7 Ų | 129.7 | 80% | 0.799 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -53 | 131.7 | 178.9 | -27.5 | 34.6 | 0 | 0 | 0 | 112.2 | K325 | P323-K325 PolarHBondContact O-N 3.44Š|
| 324 | A | 77.9 | Confident | 70 | Confident | 97 Ų | 97 | 131 Ų | 131 | 80% | 0.802 | 74% | 0.738 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 128.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | L322 | L322-A324 PolarHBondContact O-N 3.45Š|
| 325 | K | 73.8 | Confident | 71.5 | Confident | 198 Ų | 198 | 127.3 Ų | 127.3 | 86% | 0.861 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 126.4 | 178.2 | -71.5 | 175.9 | 179.9 | 172.1 | 0 | 108.9 | P323 | P323-K325 PolarHBondContact O-N 3.44Š|
| 326 | P | 75 | Confident | 72.7 | Confident | 115 Ų | 115 | 130.3 Ų | 130.3 | 75% | 0.747 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 142.3 | -176.9 | 24.3 | -33.8 | 0 | 0 | 0 | 110.4 | S328 | P326-S328 PolarHBondContact O-N 2.97Š|
| 327 | P | 73.9 | Confident | 73.8 | Confident | 120 Ų | 120 | 126.9 Ų | 126.9 | 78% | 0.779 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 130.7 | -178.1 | 22.6 | -32.9 | 0 | 0 | 0 | 110.5 | R329 | P327-R329 PolarHBondContact O-N 3.23Å; P327-R329 VanDerWaalsContact O-N 3.1Å |
| 328 | S | 72.6 | Confident | 73.7 | Confident | 92 Ų | 92 | 127.1 Ų | 127.1 | 64% | 0.643 | 69% | 0.688 | S | S | * | * | trans | -61.1 | 116 | -174.5 | -166.4 | 0 | 0 | 0 | 0 | 110.6 | P326 K330 | P326-S328 PolarHBondContact O-N 2.97Å; S328-K330 PolarHBondContact O-N 3.46Å | ||
| 329 | R | 69.1 | Low | 73.7 | Confident | 248 Ų | 248 | 125.2 Ų | 125.2 | 94% | 0.936 | 68% | 0.675 | S | S | * | * | trans | -69.8 | 34 | 177.9 | -68.2 | -172.3 | 174.4 | -163.9 | 0.6 | 114 | P327 P331 | P327-R329 PolarHBondContact O-N 3.23Å; P327-R329 VanDerWaalsContact O-N 3.1Å; R329-P331 WeakPolarHBondContact O-CD 3.39Å | ||
| 330 | K | 71 | Confident | 73.2 | Confident | 163 Ų | 163 | 123.4 Ų | 123.4 | 71% | 0.709 | 67% | 0.665 | S | S | * | * | trans | -78.1 | 115.4 | 168.7 | -71.3 | -179.6 | -178.8 | 177.2 | 0 | 107.5 | S328 S332 | S328-K330 PolarHBondContact O-N 3.46Å; K330-S332 PolarHBondContact O-N 2.9Å | ||
| 331 | P | 70.7 | Confident | 72.5 | Confident | 75 Ų | 75 | 123.8 Ų | 123.8 | 49% | 0.487 | 66% | 0.657 | S | S | . | * | trans | -61.5 | 133.2 | 178.8 | 24.3 | -33.3 | 0 | 0 | 0 | 109.8 | R329 H335 R336 | R329-P331 WeakPolarHBondContact O-CD 3.39Å; P331-H335 HydrophobicContact CB-CB 4.28Å; P331-R336 PolarHBondContact O-NE 3.33Å | ||
| 332 | S | 74.7 | Confident | 71.6 | Confident | 49 Ų | 49 | 125.3 Ų | 125.3 | 34% | 0.343 | 65% | 0.651 | S | S | . | * | trans | -59 | 162 | -176 | 82.1 | 0 | 0 | 0 | 0 | 112.1 | K330 E334 H335 R336 | K330-S332 PolarHBondContact O-N 2.9Å; S332-E334 VanDerWaalsContact C-N 3.25Å; S332-E334 WeakPolarHBondContact CB-OE2 3.4Å; S332-E334 PolarHBondContact O-N 2.87Å; S332-E334 PolarHBondContact OG-N 3.43Å; S332-E334 PolarHBondContact OG-OE2 2.76Å; S332-H335 WeakPolarHBondContact O-CB 3.09Å; S332-H335 PolarHBondContact O-N 2.87Å; S332-H335 VanDerWaalsContact O-N 3.14Å; S332-H335 PolarHBondContact OG-N 3.29Å; S332-R336 WeakPolarHBondContact O-CG 3.47Å; S332-R336 PolarHBondContact O-N 3.29Å | ||
| 333 | I | 72.7 | Confident | 70.5 | Confident | 120 Ų | 120 | 125.2 Ų | 125.2 | 62% | 0.615 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -63.5 | -33.5 | -180 | -65.5 | 171.9 | 0 | 0 | 0 | 110.7 | R336 K337 | I333-R336 PolarHBondContact O-N 3.19Å; I333-K337 HydrophobicContact CG2-CD 4.43Å; I333-K337 WeakPolarHBondContact O-CG 3.48Å; I333-K337 PolarHBondContact O-N 3.48Å; I333-K337 VanDerWaalsContact O-N 3.16Å |
| 334 | E | 73 | Confident | 69.6 | Low | 125 Ų | 125 | 129 Ų | 129 | 58% | 0.584 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -65.3 | -43.5 | 172.9 | -50.4 | 89.7 | 174.9 | 0 | 0 | 111.7 | S332 R336 K337 N338 | S332-E334 VanDerWaalsContact C-N 3.25Å; S332-E334 WeakPolarHBondContact CB-OE2 3.4Å; S332-E334 PolarHBondContact O-N 2.87Å; S332-E334 PolarHBondContact OG-N 3.43Å; S332-E334 PolarHBondContact OG-OE2 2.76Å; E334-R336 VanDerWaalsContact C-N 3.28Å; E334-R336 PolarHBondContact O-N 2.84Å; E334-K337 PolarHBondContact O-N 3.05Å; E334-K337 VanDerWaalsContact O-N 3.14Å; E334-N338 PolarHBondContact O-N 3.08Å |
| 335 | H | 72.3 | Confident | 68.3 | Low | 125 Ų | 125 | 129.7 Ų | 129.7 | 58% | 0.579 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -58.2 | -41.6 | 176.8 | -113.6 | 89.2 | 0 | 0 | 0 | 111.6 | P331 S332 K337 V339 | P331-H335 HydrophobicContact CB-CB 4.28Å; S332-H335 WeakPolarHBondContact O-CB 3.09Å; S332-H335 PolarHBondContact O-N 2.87Å; S332-H335 VanDerWaalsContact O-N 3.14Å; S332-H335 PolarHBondContact OG-N 3.29Å; H335-K337 PolarHBondContact O-N 2.78Å; H335-V339 VanDerWaalsContact O-CG2 3.27Å; H335-V339 WeakPolarHBondContact O-CG2 3.38Å; H335-V339 PolarHBondContact O-N 3.11Å |
| 336 | R | 73.8 | Confident | 66.9 | Low | 161 Ų | 161 | 127.2 Ų | 127.2 | 61% | 0.608 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -64.9 | -37.2 | 177 | -66.4 | 176.8 | -174.5 | -144.7 | -4.7 | 112.9 | P331 S332 I333 E334 | P331-R336 PolarHBondContact O-NE 3.33Å; S332-R336 WeakPolarHBondContact O-CG 3.47Å; S332-R336 PolarHBondContact O-N 3.29Å; I333-R336 PolarHBondContact O-N 3.19Å; E334-R336 VanDerWaalsContact C-N 3.28Å; E334-R336 PolarHBondContact O-N 2.84Å |
| 337 | K | 74.7 | Confident | 65.7 | Low | 140 Ų | 140 | 130.5 Ų | 130.5 | 61% | 0.609 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -70 | -52.8 | 177.4 | -71 | 175.6 | 179.5 | -178.5 | 0 | 111.2 | I333 E334 H335 V339 S340 | I333-K337 HydrophobicContact CG2-CD 4.43Å; I333-K337 WeakPolarHBondContact O-CG 3.48Å; I333-K337 PolarHBondContact O-N 3.48Å; I333-K337 VanDerWaalsContact O-N 3.16Å; E334-K337 PolarHBondContact O-N 3.05Å; E334-K337 VanDerWaalsContact O-N 3.14Å; H335-K337 PolarHBondContact O-N 2.78Å; K337-V339 VanDerWaalsContact C-N 3.32Å; K337-V339 PolarHBondContact O-N 2.85Å; K337-S340 PolarHBondContact O-N 2.82Å; K337-S340 VanDerWaalsContact O-N 3.08Å; K337-S340 PolarHBondContact O-OG 3Å |
| 338 | N | 65.8 | Low | 64.4 | Low | 88 Ų | 88 | 130.5 Ų | 130.5 | 47% | 0.471 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -62 | -32.7 | -175.2 | -76.9 | -6.6 | 0 | 0 | 0 | 113.9 | E334 S340 E341 K342 | E334-N338 PolarHBondContact O-N 3.08Å; N338-S340 VanDerWaalsContact C-N 3.29Å; N338-S340 PolarHBondContact O-N 3.25Å; N338-E341 PolarHBondContact O-N 3.02Å; N338-K342 PolarHBondContact O-N 2.93Å |
| 339 | V | 67 | Low | 62.8 | Low | 78 Ų | 78 | 135.8 Ų | 135.8 | 47% | 0.473 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -61.9 | -38.5 | 176.2 | 172 | 0 | 0 | 0 | 0 | 111.3 | H335 K337 E341 F343 | H335-V339 VanDerWaalsContact O-CG2 3.27Å; H335-V339 WeakPolarHBondContact O-CG2 3.38Å; H335-V339 PolarHBondContact O-N 3.11Å; K337-V339 VanDerWaalsContact C-N 3.32Å; K337-V339 PolarHBondContact O-N 2.85Å; V339-E341 VanDerWaalsContact C-N 3.3Å; V339-E341 PolarHBondContact O-N 3.14Å; V339-F343 HydrophobicContact CG1-CD2 4.47Å; V339-F343 HydrophobicContact CG1-CE2 3.99Å; V339-F343 WeakPolarHBondContact O-CD2 3.4Å |
| 340 | S | 63.7 | Low | 61.5 | Low | 77 Ų | 77 | 128.2 Ų | 128.2 | 54% | 0.538 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -70.2 | -26.4 | -179.6 | 73.6 | 0 | 0 | 0 | 0 | 113.8 | K337 N338 | K337-S340 PolarHBondContact O-N 2.82Å; K337-S340 VanDerWaalsContact O-N 3.08Å; K337-S340 PolarHBondContact O-OG 3Å; N338-S340 VanDerWaalsContact C-N 3.29Å; N338-S340 PolarHBondContact O-N 3.25Å |
| 341 | E | 64.3 | Low | 59.9 | Low | 120 Ų | 120 | 126.5 Ų | 126.5 | 56% | 0.561 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -82.6 | -37.9 | -178.1 | -168.1 | 158.7 | -141.9 | 0 | 0 | 112.1 | N338 V339 F343 R344 | N338-E341 PolarHBondContact O-N 3.02Å; V339-E341 VanDerWaalsContact C-N 3.3Å; V339-E341 PolarHBondContact O-N 3.14Å; E341-F343 PolarHBondContact O-N 2.61Å; E341-F343 VanDerWaalsContact O-N 3.11Å; E341-R344 WeakPolarHBondContact O-CB 3.46Å; E341-R344 PolarHBondContact O-N 2.85Å |
| 342 | K | 60 | Low | 58.1 | Low | 156 Ų | 156 | 129.5 Ų | 129.5 | 68% | 0.678 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -60 | -22.1 | 176.1 | -71.5 | -175.7 | 179.7 | -170.8 | 0 | 114.4 | N338 T345 | N338-K342 PolarHBondContact O-N 2.93Å; K342-T345 PolarHBondContact O-OG1 3.14Å |
| 343 | F | 56.2 | Low | 56.3 | Low | 159 Ų | 159 | 136.4 Ų | 136.4 | 70% | 0.697 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.6 | -4 | 174.6 | -69.5 | -69 | 0 | 0 | 0 | 114.4 | V339 E341 | V339-F343 HydrophobicContact CG1-CD2 4.47Å; V339-F343 HydrophobicContact CG1-CE2 3.99Å; V339-F343 WeakPolarHBondContact O-CD2 3.4Å; E341-F343 PolarHBondContact O-N 2.61Å; E341-F343 VanDerWaalsContact O-N 3.11Å |
| 344 | R | 60.4 | Low | 54.6 | Low | 203 Ų | 203 | 139.7 Ų | 139.7 | 77% | 0.766 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | -21.2 | 176.3 | -82.4 | -178.9 | 166.4 | 163.7 | -5.3 | 114.1 | E341 | E341-R344 WeakPolarHBondContact O-CB 3.46Å; E341-R344 PolarHBondContact O-N 2.85Å |
| 345 | T | 49.6 | Very low | 52.6 | Low | 112 Ų | 112 | 140.8 Ų | 140.8 | 69% | 0.687 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -88.2 | -12.5 | -173.2 | 49.3 | 0 | 0 | 0 | 0 | 114.3 | K342 K347 | K342-T345 PolarHBondContact O-OG1 3.14Å; T345-K347 PolarHBondContact O-N 2.86Å |
| 346 | L | 43.9 | Very low | 50.7 | Low | 146 Ų | 146 | 142.9 Ų | 142.9 | 76% | 0.764 | 70% | 0.704 | S | S | * | * | trans | -77.5 | 68.6 | 168.1 | -64.3 | 178.5 | 0 | 0 | 0 | 110.5 | ||||
| 347 | K | 49.2 | Very low | 49.1 | Very low | 183 Ų | 183 | 143.6 Ų | 143.6 | 80% | 0.796 | 72% | 0.719 | S | S | * | * | trans | -65.4 | 130.6 | 161.7 | -77.4 | -171.8 | 175.5 | -177.8 | 0 | 108.2 | T345 Q349 | T345-K347 PolarHBondContact O-N 2.86Å; K347-Q349 PolarHBondContact O-N 3.31Å | ||
| 348 | P | 47.1 | Very low | 47.3 | Very low | 121 Ų | 121 | 140.8 Ų | 140.8 | 79% | 0.786 | 72% | 0.722 | S | S | * | * | trans | -63.2 | 118.5 | 166.6 | 25.9 | -31.4 | 0 | 0 | 0 | 109.1 | S350 | P348-S350 PolarHBondContact O-N 2.95Š| ||
| 349 | Q | 40 | Very low | 45.5 | Very low | 202 Ų | 202 | 145.1 Ų | 145.1 | 94% | 0.944 | 74% | 0.736 | S | S | * | * | trans | -75.2 | 109.7 | 163.2 | -90.3 | -171.9 | -38.2 | 0 | 0 | 108.2 | K347 | K347-Q349 PolarHBondContact O-N 3.31Š| ||
| 350 | S | 40.8 | Very low | 44.1 | Very low | 90 Ų | 90 | 147.9 Ų | 147.9 | 63% | 0.629 | 76% | 0.756 | S | S | * | * | trans | -150.6 | 96.2 | 162.4 | 60.8 | 0 | 0 | 0 | 0 | 110.4 | P348 | P348-S350 PolarHBondContact O-N 2.95Š| ||
| 351 | T | 37.1 | Very low | 42.5 | Very low | 127 Ų | 127 | 149 Ų | 149 | 78% | 0.779 | 76% | 0.76 | S | S | * | * | trans | 33.5 | 103.8 | 135.5 | 54 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 352 | V | 34.1 | Very low | 41.4 | Very low | 137 Ų | 137 | 149.2 Ų | 149.2 | 83% | 0.83 | 77% | 0.774 | S | S | * | * | 63.9 | 86.8 | 87.6 | -179.4 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 353 | Q | 36.6 | Very low | 40.1 | Very low | 194 Ų | 194 | 149.9 Ų | 149.9 | 91% | 0.907 | 78% | 0.777 | S | S | * | * | trans | -127.3 | 132 | 142.3 | -96.8 | -173.1 | -8.3 | 0 | 0 | 109.3 | ||||
| 354 | K | 37.2 | Very low | 39.1 | Very low | 189 Ų | 189 | 152.8 Ų | 152.8 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | trans | -49.2 | 130.3 | -175.5 | -58.6 | 157.3 | -179.6 | -179.7 | 0 | 110.4 | ||||
| 355 | Q | 30.7 | Very low | 37.8 | Very low | 149 Ų | 149 | 154.1 Ų | 154.1 | 70% | 0.696 | 79% | 0.79 | S | S | * | * | 68.6 | 132 | 57.8 | -155.2 | -177.5 | 8.6 | 0 | 0 | 112.8 | |||||
| 356 | F | 32.3 | Very low | 37.1 | Very low | 168 Ų | 168 | 154.7 Ų | 154.7 | 74% | 0.737 | 80% | 0.799 | S | S | * | * | trans | 86.8 | 91 | 171.5 | -52.1 | -71 | 0 | 0 | 0 | 119.5 | ||||
| 357 | L | 40.6 | Very low | 36.5 | Very low | 176 Ų | 176 | 152.8 Ų | 152.8 | 92% | 0.921 | 80% | 0.797 | S | S | * | * | -148.5 | 119.1 | 115.8 | -139.4 | 66.3 | 0 | 0 | 0 | 111.4 | |||||
| 358 | A | 37 | Very low | 35.7 | Very low | 82 Ų | 82 | 149.3 Ų | 149.3 | 68% | 0.678 | 80% | 0.796 | S | S | * | * | trans | 8.7 | 121.1 | 160 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 359 | K | 27.4 | Very low | 35.3 | Very low | 178 Ų | 178 | 148.4 Ų | 148.4 | 77% | 0.774 | 79% | 0.793 | S | S | * | * | 67.3 | 134.6 | 82.3 | -72.8 | -175.6 | 178.2 | 178.2 | 0 | 112.6 | T361 | K359-T361 HydrophobicContact CG-CG2 4.43Š| |||
| 360 | P | 37.2 | Very low | 35 | Very low | 136 Ų | 136 | 147.7 Ų | 147.7 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | -105.7 | 153.6 | 54.2 | 35.3 | -36.3 | 0 | 0 | 0 | 115.9 | |||||
| 361 | T | 31.1 | Very low | 34.8 | Very low | 101 Ų | 101 | 150.8 Ų | 150.8 | 62% | 0.62 | 80% | 0.799 | S | S | * | * | trans | -100.9 | 135.2 | 167.6 | 47.3 | 0 | 0 | 0 | 0 | 109.7 | K359 | K359-T361 HydrophobicContact CG-CG2 4.43Š| ||
| 362 | S | 40.2 | Very low | 34.8 | Very low | 124 Ų | 124 | 152.6 Ų | 152.6 | 87% | 0.867 | 80% | 0.803 | S | S | * | * | trans | -121.5 | 135.7 | 148.1 | -166.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 363 | K | 33.6 | Very low | 35 | Very low | 170 Ų | 170 | 152.2 Ų | 152.2 | 74% | 0.739 | 80% | 0.803 | S | S | * | * | trans | -104.4 | 178.4 | 179.9 | -66.6 | 178.1 | 179 | 176.3 | 0 | 108.7 | ||||
| 364 | Y | 35.2 | Very low | 34.9 | Very low | 221 Ų | 221 | 146.7 Ų | 146.7 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | trans | 73.2 | 120 | -171 | -60.8 | -95.7 | 0 | 0 | 0 | 111.6 | ||||
| 365 | R | 32.1 | Very low | 34.9 | Very low | 231 Ų | 231 | 146.4 Ų | 146.4 | 87% | 0.872 | 80% | 0.802 | S | S | * | * | cis | 59.1 | 82.9 | 26 | -163.1 | -167.6 | -174.4 | -170 | 2 | 113 | ||||
| 366 | S | 35.8 | Very low | 35.3 | Very low | 123 Ų | 123 | 142.7 Ų | 142.7 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | -156.4 | 164.3 | 121 | -101.2 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 367 | S | 31.8 | Very low | 36.1 | Very low | 106 Ų | 106 | 139.4 Ų | 139.4 | 74% | 0.741 | 79% | 0.788 | S | S | * | * | trans | -85.8 | 164.6 | -175.2 | -55.4 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 368 | S | 32.7 | Very low | 36.4 | Very low | 110 Ų | 110 | 138.2 Ų | 138.2 | 77% | 0.769 | 78% | 0.778 | S | S | * | * | trans | 67.3 | 147.1 | 161.7 | 39.2 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 369 | S | 37.9 | Very low | 37 | Very low | 102 Ų | 102 | 137.7 Ų | 137.7 | 71% | 0.713 | 77% | 0.774 | S | S | * | * | trans | 65.3 | 124.1 | 165.5 | 39.2 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 370 | E | 34.4 | Very low | 38.1 | Very low | 187 Ų | 187 | 133.8 Ų | 133.8 | 87% | 0.874 | 77% | 0.765 | S | S | * | * | trans | 83.8 | 135.5 | 144.3 | -66.8 | -179.8 | 120.6 | 0 | 0 | 121.6 | ||||
| 371 | N | 36.3 | Very low | 38.7 | Very low | 156 Ų | 156 | 133.1 Ų | 133.1 | 83% | 0.834 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 145.5 | -178 | -57.4 | -73.4 | 0 | 0 | 0 | 110.8 | P373 | N371-P373 WeakPolarHBondContact O-CD 3.46Š|
| 372 | L | 37.6 | Very low | 39.7 | Very low | 165 Ų | 165 | 131.6 Ų | 131.6 | 86% | 0.864 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 124 | 157.2 | -68.6 | 170.6 | 0 | 0 | 0 | 108.3 | ||
| 373 | P | 37.2 | Very low | 40.3 | Very low | 128 Ų | 128 | 128.5 Ų | 128.5 | 83% | 0.831 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -68.1 | 135.7 | 169.5 | 29.3 | -33 | 0 | 0 | 0 | 109 | N371 | N371-P373 WeakPolarHBondContact O-CD 3.46Š|
| 374 | G | 35.8 | Very low | 41.2 | Very low | 78 Ų | 78 | 123.9 Ų | 123.9 | 80% | 0.804 | 72% | 0.722 | S | S | * | * | trans | 147.4 | -10.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 375 | M | 35.4 | Very low | 42.1 | Very low | 184 Ų | 184 | 118.9 Ų | 118.9 | 91% | 0.906 | 71% | 0.71 | S | S | * | * | trans | -121.8 | 95.7 | 170.7 | -61.4 | -171.7 | 79.7 | 0 | 0 | 109.1 | ||||
| 376 | S | 39.5 | Very low | 43.2 | Very low | 70 Ų | 70 | 110.9 Ų | 110.9 | 49% | 0.49 | 69% | 0.694 | S | S | . | * | trans | -64.9 | 145.8 | 175 | 69.1 | 0 | 0 | 0 | 0 | 110 | E378 | S376-E378 PolarHBondContact O-N 3.28Š| ||
| 377 | P | 50.6 | Low | 44.3 | Very low | 100 Ų | 100 | 110 Ų | 110 | 65% | 0.649 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | -12.5 | -178.1 | 24.6 | -33.7 | 0 | 0 | 0 | 113.8 | A379 T380 | P377-A379 PolarHBondContact O-N 3.46Å; P377-T380 WeakPolarHBondContact O-CB 3.23Å; P377-T380 PolarHBondContact O-N 3.16Å; P377-T380 VanDerWaalsContact O-N 3.1Å; P377-T380 PolarHBondContact O-OG1 3.01Å |
| 378 | E | 45.2 | Very low | 45.4 | Very low | 150 Ų | 150 | 107.5 Ų | 107.5 | 70% | 0.701 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -61.8 | -37 | -177.6 | -149.2 | 169.5 | 176.4 | 0 | 0 | 113.1 | S376 T380 L381 A382 | S376-E378 PolarHBondContact O-N 3.28Å; E378-T380 PolarHBondContact O-N 2.96Å; E378-L381 PolarHBondContact O-N 3.02Å; E378-A382 PolarHBondContact O-N 3.38Å |
| 379 | A | 51.1 | Low | 46.4 | Very low | 72 Ų | 72 | 109.9 Ų | 109.9 | 60% | 0.595 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -62.6 | -27.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | P377 A383 | P377-A379 PolarHBondContact O-N 3.46Å; A379-A383 PolarHBondContact O-N 3.48Å |
| 380 | T | 50.5 | Low | 47.1 | Very low | 96 Ų | 96 | 107.7 Ų | 107.7 | 59% | 0.589 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -75.3 | -30.9 | 177.9 | -7.6 | 0 | 0 | 0 | 0 | 112.8 | P377 E378 S384 | P377-T380 WeakPolarHBondContact O-CB 3.23Å; P377-T380 PolarHBondContact O-N 3.16Å; P377-T380 VanDerWaalsContact O-N 3.1Å; P377-T380 PolarHBondContact O-OG1 3.01Å; E378-T380 PolarHBondContact O-N 2.96Å; T380-S384 PolarHBondContact O-N 2.97Å; T380-S384 PolarHBondContact O-OG 3.38Å |
| 381 | L | 49.8 | Very low | 48.3 | Very low | 122 Ų | 122 | 104.8 Ų | 104.8 | 64% | 0.639 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -73.1 | -43.8 | 176.3 | -83.9 | 134.9 | 0 | 0 | 0 | 111.2 | E378 A383 S384 D385 | E378-L381 PolarHBondContact O-N 3.02Å; L381-A383 VanDerWaalsContact C-N 3.29Å; L381-A383 PolarHBondContact O-N 2.89Å; L381-S384 WeakPolarHBondContact O-CA 3.47Å; L381-S384 VanDerWaalsContact O-CB 3.31Å; L381-S384 WeakPolarHBondContact O-CB 3.36Å; L381-S384 PolarHBondContact O-N 3.37Å; L381-D385 PolarHBondContact O-N 2.97Å |
| 382 | A | 51.6 | Low | 49.1 | Very low | 68 Ų | 68 | 103.4 Ų | 103.4 | 56% | 0.562 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -58.4 | -38.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113 | E378 S384 A386 | E378-A382 PolarHBondContact O-N 3.38Å; A382-S384 VanDerWaalsContact C-N 3.28Å; A382-S384 PolarHBondContact O-N 3.25Å; A382-A386 PolarHBondContact O-N 3.02Å |
| 383 | A | 51.9 | Low | 49.6 | Very low | 59 Ų | 59 | 101.8 Ų | 101.8 | 49% | 0.488 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -67.4 | -27.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | A379 L381 V387 | A379-A383 PolarHBondContact O-N 3.48Å; L381-A383 VanDerWaalsContact C-N 3.29Å; L381-A383 PolarHBondContact O-N 2.89Å; A383-V387 WeakPolarHBondContact O-CG2 3.36Å |
| 384 | S | 52.8 | Low | 50 | Low | 74 Ų | 74 | 101 Ų | 101 | 52% | 0.517 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -73.9 | -43.2 | 179.7 | -58 | 0 | 0 | 0 | 0 | 111.7 | T380 L381 A382 A386 V387 A388 | T380-S384 PolarHBondContact O-N 2.97Å; T380-S384 PolarHBondContact O-OG 3.38Å; L381-S384 WeakPolarHBondContact O-CA 3.47Å; L381-S384 VanDerWaalsContact O-CB 3.31Å; L381-S384 WeakPolarHBondContact O-CB 3.36Å; L381-S384 PolarHBondContact O-N 3.37Å; A382-S384 VanDerWaalsContact C-N 3.28Å; A382-S384 PolarHBondContact O-N 3.25Å; S384-A386 PolarHBondContact O-N 3.18Å; S384-V387 PolarHBondContact O-N 2.85Å; S384-A388 PolarHBondContact O-N 2.94Å; S384-A388 VanDerWaalsContact O-N 3.11Å |
| 385 | D | 54 | Low | 50.7 | Low | 115 Ų | 115 | 105.7 Ų | 105.7 | 62% | 0.615 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.4 | -34.7 | 178.5 | -89.6 | -18.2 | 0 | 0 | 0 | 113.4 | L381 V387 A388 K389 | L381-D385 PolarHBondContact O-N 2.97Å; D385-V387 VanDerWaalsContact C-N 3.32Å; D385-V387 PolarHBondContact O-N 2.73Å; D385-A388 PolarHBondContact O-N 3.1Å; D385-K389 PolarHBondContact O-N 3.42Å |
| 386 | A | 54.7 | Low | 51.4 | Low | 64 Ų | 64 | 101.3 Ų | 101.3 | 53% | 0.529 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -62.1 | -39.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | A382 S384 A390 | A382-A386 PolarHBondContact O-N 3.02Å; S384-A386 PolarHBondContact O-N 3.18Å; A386-A390 WeakPolarHBondContact O-CB 3.47Å; A386-A390 PolarHBondContact O-N 3.34Å; A386-A390 VanDerWaalsContact O-N 3.1Å |
| 387 | V | 58.8 | Low | 51.6 | Low | 104 Ų | 104 | 103.6 Ų | 103.6 | 63% | 0.63 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -69.8 | -38.1 | 176.4 | 175.7 | 0 | 0 | 0 | 0 | 111.3 | A383 S384 D385 A390 L391 | A383-V387 WeakPolarHBondContact O-CG2 3.36Å; S384-V387 PolarHBondContact O-N 2.85Å; D385-V387 VanDerWaalsContact C-N 3.32Å; D385-V387 PolarHBondContact O-N 2.73Å; V387-A390 PolarHBondContact O-N 2.82Å; V387-L391 PolarHBondContact O-N 3.24Å |
| 388 | A | 56 | Low | 51.5 | Low | 53 Ų | 53 | 105.7 Ų | 105.7 | 44% | 0.438 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.4 | -45 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S384 D385 L391 M392 | S384-A388 PolarHBondContact O-N 2.94Å; S384-A388 VanDerWaalsContact O-N 3.11Å; D385-A388 PolarHBondContact O-N 3.1Å; A388-L391 PolarHBondContact O-N 3.4Å; A388-M392 PolarHBondContact O-N 3.28Å |
| 389 | K | 52.8 | Low | 51.6 | Low | 161 Ų | 161 | 103.2 Ų | 103.2 | 70% | 0.7 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -63.1 | -40.6 | 175.3 | -79.1 | -180 | 175.2 | 174.4 | 0 | 112.6 | D385 L391 M392 N393 | D385-K389 PolarHBondContact O-N 3.42Å; K389-L391 VanDerWaalsContact C-N 3.26Å; K389-L391 PolarHBondContact O-N 2.87Å; K389-M392 PolarHBondContact O-N 3.25Å; K389-N393 PolarHBondContact O-N 2.96Å |
| 390 | A | 54 | Low | 51.5 | Low | 56 Ų | 56 | 104.6 Ų | 104.6 | 46% | 0.463 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -63.6 | -30.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | A386 V387 N394 | A386-A390 WeakPolarHBondContact O-CB 3.47Å; A386-A390 PolarHBondContact O-N 3.34Å; A386-A390 VanDerWaalsContact O-N 3.1Å; V387-A390 PolarHBondContact O-N 2.82Å; A390-N394 PolarHBondContact O-ND2 3.25Å |
| 391 | L | 58.8 | Low | 50.9 | Low | 126 Ų | 126 | 110.5 Ų | 110.5 | 66% | 0.66 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -76.7 | -32.2 | 179.2 | -165.2 | 69 | 0 | 0 | 0 | 113 | V387 A388 K389 | V387-L391 PolarHBondContact O-N 3.24Å; A388-L391 PolarHBondContact O-N 3.4Å; K389-L391 VanDerWaalsContact C-N 3.26Å; K389-L391 PolarHBondContact O-N 2.87Å |
| 392 | M | 53.7 | Low | 50.2 | Low | 127 Ų | 127 | 108.1 Ų | 108.1 | 63% | 0.626 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -70.7 | -40.7 | 179.6 | -74.1 | -69.6 | 107.5 | 0 | 0 | 112.8 | A388 K389 N394 | A388-M392 PolarHBondContact O-N 3.28Å; K389-M392 PolarHBondContact O-N 3.25Å; M392-N394 VanDerWaalsContact C-N 3.29Å; M392-N394 PolarHBondContact O-N 3.3Å |
| 393 | N | 48.2 | Very low | 49.4 | Very low | 130 Ų | 130 | 114 Ų | 114 | 70% | 0.695 | 66% | 0.656 | S | S | * | * | G | 310 helix | trans | -76.5 | -8.5 | -176.2 | -73.4 | 5.2 | 0 | 0 | 0 | 114.6 | K389 K395 | K389-N393 PolarHBondContact O-N 2.96Å; N393-K395 VanDerWaalsContact C-N 3.35Å; N393-K395 PolarHBondContact O-N 3.43Å |
| 394 | N | 44.9 | Very low | 48.6 | Very low | 111 Ų | 111 | 119.3 Ų | 119.3 | 59% | 0.594 | 67% | 0.671 | S | S | * | * | G | 310 helix | trans | -87.1 | 9.2 | -175.2 | -95.2 | -78.6 | 0 | 0 | 0 | 115.2 | A390 M392 | A390-N394 PolarHBondContact O-ND2 3.25Å; M392-N394 VanDerWaalsContact C-N 3.29Å; M392-N394 PolarHBondContact O-N 3.3Å |
| 395 | K | 50.1 | Low | 47.8 | Very low | 177 Ų | 177 | 126.6 Ų | 126.6 | 77% | 0.77 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -85.5 | -16 | -179.7 | -81.6 | -175 | 175 | 178.9 | 0 | 115.3 | N393 | N393-K395 VanDerWaalsContact C-N 3.35Å; N393-K395 PolarHBondContact O-N 3.43Å |
| 396 | S | 51.1 | Low | 47.1 | Very low | 93 Ų | 93 | 127 Ų | 127 | 65% | 0.65 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -94.8 | -24.1 | -172.3 | 41.7 | 0 | 0 | 0 | 0 | 115.7 | ||
| 397 | D | 43.6 | Very low | 46.2 | Very low | 118 Ų | 118 | 131 Ų | 131 | 63% | 0.631 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -102 | 4.1 | -169.5 | -85.2 | -76.1 | 0 | 0 | 0 | 116.1 | A399 | D397-A399 PolarHBondContact O-N 3.14Š|
| 398 | I | 48.6 | Very low | 45.7 | Very low | 144 Ų | 144 | 131.5 Ų | 131.5 | 74% | 0.738 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | -20.3 | -178.7 | -61.5 | 174.8 | 0 | 0 | 0 | 112.1 | ||
| 399 | A | 47.1 | Very low | 44.9 | Very low | 98 Ų | 98 | 137.5 Ų | 137.5 | 81% | 0.81 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.9 | -21.5 | -176 | 0 | 0 | 0 | 0 | 0 | 115.1 | D397 | D397-A399 PolarHBondContact O-N 3.14Š|
| 400 | S | 49.3 | Very low | 44.5 | Very low | 101 Ų | 101 | 140.4 Ų | 140.4 | 71% | 0.706 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -123.1 | 4.1 | -161.9 | -61.3 | 0 | 0 | 0 | 0 | 116.4 | ||
| 401 | R | 37.6 | Very low | 44 | Very low | 220 Ų | 220 | 143.7 Ų | 143.7 | 83% | 0.83 | 75% | 0.751 | S | S | * | * | trans | -130.5 | 80.1 | 172.6 | -75.7 | -169.9 | 178.3 | 177.6 | 1.9 | 113.6 | ||||
| 402 | G | 34.8 | Very low | 43.2 | Very low | 72 Ų | 72 | 143.8 Ų | 143.8 | 74% | 0.742 | 76% | 0.756 | S | S | * | * | trans | -61.5 | 138.2 | 151.6 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 403 | M | 35.3 | Very low | 42.9 | Very low | 191 Ų | 191 | 144.9 Ų | 144.9 | 94% | 0.941 | 76% | 0.763 | S | S | * | * | trans | 58.6 | 66.8 | 162.3 | -51.2 | -142.9 | 79.2 | 0 | 0 | 118.2 | ||||
| 404 | Q | 33.7 | Very low | 42.5 | Very low | 171 Ų | 171 | 143.8 Ų | 143.8 | 80% | 0.799 | 77% | 0.766 | S | S | * | * | trans | -132 | 134.5 | 139 | -129.1 | 178 | 13 | 0 | 0 | 112.3 | V406 | Q404-V406 PolarHBondContact O-N 2.9Š| ||
| 405 | R | 37 | Very low | 42.7 | Very low | 227 Ų | 227 | 145.2 Ų | 145.2 | 86% | 0.857 | 77% | 0.772 | S | S | * | * | trans | -84.1 | 77.4 | -163.7 | -171 | -174.1 | -171.9 | -152.3 | 6.7 | 110.3 | Q407 | R405-Q407 PolarHBondContact O-N 2.99Š| ||
| 406 | V | 39.5 | Very low | 42.9 | Very low | 123 Ų | 123 | 142.7 Ų | 142.7 | 75% | 0.745 | 77% | 0.774 | S | S | * | * | trans | -64.4 | 99.6 | 177.3 | -176.1 | 0 | 0 | 0 | 0 | 109.7 | Q404 S408 | Q404-V406 PolarHBondContact O-N 2.9Å; V406-S408 PolarHBondContact O-N 3.03Å | ||
| 407 | Q | 35.7 | Very low | 43.2 | Very low | 149 Ų | 149 | 144.9 Ų | 144.9 | 70% | 0.696 | 78% | 0.783 | S | S | * | * | trans | -62.4 | 120 | 164.6 | -69.6 | 177 | -18.9 | 0 | 0 | 107.6 | R405 H409 | R405-Q407 PolarHBondContact O-N 2.99Å; Q407-H409 PolarHBondContact O-N 2.94Å; Q407-H409 VanDerWaalsContact O-N 3.14Å | ||
| 408 | S | 47.1 | Very low | 43.7 | Very low | 114 Ų | 114 | 141.7 Ų | 141.7 | 80% | 0.797 | 78% | 0.779 | S | S | * | * | trans | -65.6 | 116.8 | 177.8 | 41.6 | 0 | 0 | 0 | 0 | 110.3 | V406 R410 | V406-S408 PolarHBondContact O-N 3.03Å; S408-R410 PolarHBondContact O-N 3.36Å; S408-R410 VanDerWaalsContact O-N 3.11Å | ||
| 409 | H | 39.2 | Very low | 44 | Very low | 179 Ų | 179 | 141.3 Ų | 141.3 | 83% | 0.829 | 79% | 0.785 | S | S | * | * | trans | -61 | 111.6 | -175.7 | -58.2 | -88.9 | 0 | 0 | 0 | 111.3 | Q407 | Q407-H409 PolarHBondContact O-N 2.94Å; Q407-H409 VanDerWaalsContact O-N 3.14Å | ||
| 410 | R | 45.5 | Very low | 44.6 | Very low | 222 Ų | 222 | 147.5 Ų | 147.5 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | trans | -89.6 | 137.8 | 148.2 | -87.6 | -172.3 | 168.2 | -160.6 | -4.6 | 107.8 | S408 V412 | S408-R410 PolarHBondContact O-N 3.36Å; S408-R410 VanDerWaalsContact O-N 3.11Å; R410-V412 PolarHBondContact O-N 3.47Å | ||
| 411 | P | 43.9 | Very low | 45 | Very low | 125 Ų | 125 | 148.2 Ų | 148.2 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | trans | -63.9 | 112.3 | 173.2 | 26.4 | -32.8 | 0 | 0 | 0 | 109 | I413 | P411-I413 PolarHBondContact O-N 3.43Š| ||
| 412 | V | 41.6 | Very low | 46.6 | Very low | 127 Ų | 127 | 144 Ų | 144 | 77% | 0.77 | 79% | 0.789 | S | S | * | * | trans | -84.7 | 108.4 | 171.5 | 177.7 | 0 | 0 | 0 | 0 | 106.8 | R410 S414 | R410-V412 PolarHBondContact O-N 3.47Å; V412-S414 PolarHBondContact O-N 3.34Å | ||
| 413 | I | 46.4 | Very low | 48.1 | Very low | 150 Ų | 150 | 145.7 Ų | 145.7 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | trans | -68.6 | 100.3 | 168.9 | -61.1 | 172.6 | 0 | 0 | 0 | 106.8 | P411 L415 | P411-I413 PolarHBondContact O-N 3.43Å; I413-L415 PolarHBondContact O-N 2.85Å; I413-L415 VanDerWaalsContact O-N 3.08Å | ||
| 414 | S | 40.4 | Very low | 49.6 | Very low | 108 Ų | 108 | 142.1 Ų | 142.1 | 76% | 0.755 | 78% | 0.778 | S | S | * | * | trans | -75.2 | 90.7 | 179.5 | 51.8 | 0 | 0 | 0 | 0 | 110.5 | V412 | V412-S414 PolarHBondContact O-N 3.34Š| ||
| 415 | L | 49.2 | Very low | 51.4 | Low | 140 Ų | 140 | 139.9 Ų | 139.9 | 73% | 0.733 | 78% | 0.778 | S | S | * | * | trans | -73.5 | 140.7 | 162.7 | -68.7 | 172 | 0 | 0 | 0 | 109.2 | I413 V417 | I413-L415 PolarHBondContact O-N 2.85Å; I413-L415 VanDerWaalsContact O-N 3.08Å; L415-V417 PolarHBondContact O-N 3.36Å | ||
| 416 | P | 53.3 | Low | 52.8 | Low | 125 Ų | 125 | 140.5 Ų | 140.5 | 81% | 0.812 | 78% | 0.781 | S | S | * | * | trans | -65.3 | 120.4 | -175.9 | 25.4 | -33.7 | 0 | 0 | 0 | 111.1 | G418 | P416-G418 PolarHBondContact O-N 3.07Š| ||
| 417 | V | 58.6 | Low | 54.4 | Low | 138 Ų | 138 | 140 Ų | 140 | 84% | 0.836 | 78% | 0.779 | S | S | * | * | trans | -81.1 | 97.6 | 174.2 | -178.8 | 0 | 0 | 0 | 0 | 108 | L415 | L415-V417 PolarHBondContact O-N 3.36Š| ||
| 418 | G | 53.3 | Low | 55.7 | Low | 52 Ų | 52 | 140.4 Ų | 140.4 | 54% | 0.536 | 79% | 0.787 | S | S | . | * | P | Polyproline II helix | trans | -60.7 | 162.1 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | P416 R420 | P416-G418 PolarHBondContact O-N 3.07Å; G418-R420 PolarHBondContact O-N 2.81Å; G418-R420 VanDerWaalsContact O-N 3.13Å |
| 419 | P | 55.8 | Low | 56.8 | Low | 135 Ų | 135 | 141.2 Ų | 141.2 | 88% | 0.877 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 119 | -173.2 | 23.9 | -33.9 | 0 | 0 | 0 | 111.2 | P421 | P419-P421 WeakPolarHBondContact O-CD 3.24Š|
| 420 | R | 59.1 | Low | 58.4 | Low | 228 Ų | 228 | 136.2 Ų | 136.2 | 86% | 0.86 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -81.9 | 121.1 | -177.2 | -169.1 | 179.8 | -171.4 | -143.7 | 1.9 | 109.3 | G418 T422 | G418-R420 PolarHBondContact O-N 2.81Å; G418-R420 VanDerWaalsContact O-N 3.13Å; R420-T422 PolarHBondContact O-N 2.69Å |
| 421 | P | 58.2 | Low | 59.8 | Low | 117 Ų | 117 | 130.8 Ų | 130.8 | 76% | 0.76 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 131.5 | 179 | -24.7 | 34.3 | 0 | 0 | 0 | 111.8 | P419 | P419-P421 WeakPolarHBondContact O-CD 3.24Š|
| 422 | T | 70.4 | Confident | 61.2 | Low | 131 Ų | 131 | 130.4 Ų | 130.4 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 131.6 | 175.2 | -37.3 | 0 | 0 | 0 | 0 | 109.3 | R420 | R420-T422 PolarHBondContact O-N 2.69Š|
| 423 | P | 67.3 | Low | 62.8 | Low | 107 Ų | 107 | 130 Ų | 130 | 70% | 0.695 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 144.7 | 178.2 | 27.2 | -34.5 | 0 | 0 | 0 | 110.9 | ||
| 424 | P | 66.4 | Low | 63.9 | Low | 116 Ų | 116 | 128.3 Ų | 128.3 | 75% | 0.753 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 150.1 | 178.6 | 27.3 | -34.7 | 0 | 0 | 0 | 111.5 | ||
| 425 | P | 72.2 | Confident | 65.3 | Low | 125 Ų | 125 | 128.6 Ų | 128.6 | 81% | 0.812 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 139.6 | 179.7 | 25.8 | -33.8 | 0 | 0 | 0 | 111.2 | ||
| 426 | R | 66.4 | Low | 66 | Low | 240 Ų | 240 | 127.7 Ų | 127.7 | 91% | 0.906 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -70.7 | 139.4 | 172.1 | -87.9 | -177.6 | 168.5 | -178.2 | -4.7 | 109.8 | ||
| 427 | P | 71.5 | Confident | 66.2 | Low | 111 Ų | 111 | 127.6 Ų | 127.6 | 72% | 0.721 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 143.4 | 162.7 | -22 | 33.5 | 0 | 0 | 0 | 110.5 | V429 | P427-V429 PolarHBondContact O-N 3.04Š|
| 428 | D | 64.9 | Low | 66 | Low | 158 Ų | 158 | 125.6 Ų | 125.6 | 85% | 0.845 | 77% | 0.765 | S | S | * | * | trans | -72.6 | 89.7 | -176.6 | -162.7 | 1.4 | 0 | 0 | 0 | 110.6 | A430 | D428-A430 PolarHBondContact O-N 3.17Å; D428-A430 VanDerWaalsContact O-N 3.1Å | ||
| 429 | V | 69.4 | Low | 65.6 | Low | 131 Ų | 131 | 127.7 Ų | 127.7 | 79% | 0.794 | 78% | 0.778 | S | S | * | * | trans | -77.8 | 95 | 172.1 | -179.3 | 0 | 0 | 0 | 0 | 107.1 | P427 | P427-V429 PolarHBondContact O-N 3.04Š| ||
| 430 | A | 72 | Confident | 64.7 | Low | 74 Ų | 74 | 126.5 Ų | 126.5 | 61% | 0.612 | 77% | 0.773 | S | S | * | * | trans | -45.8 | 137.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | D428 | D428-A430 PolarHBondContact O-N 3.17Å; D428-A430 VanDerWaalsContact O-N 3.1Å | ||
| 431 | P | 76.5 | Confident | 63.6 | Low | 109 Ų | 109 | 121.3 Ų | 121.3 | 71% | 0.708 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 145.9 | -176.5 | 25.1 | -34 | 0 | 0 | 0 | 111.3 | ||
| 432 | P | 72.5 | Confident | 62.7 | Low | 117 Ų | 117 | 119.8 Ų | 119.8 | 76% | 0.76 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -62 | 145.6 | -179.1 | 26.5 | -34.8 | 0 | 0 | 0 | 111.3 | ||
| 433 | P | 74.3 | Confident | 60.8 | Low | 119 Ų | 119 | 122.1 Ų | 122.1 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 149.1 | -175.6 | 25.9 | -34.8 | 0 | 0 | 0 | 112.1 | ||
| 434 | P | 71.1 | Confident | 59.4 | Low | 114 Ų | 114 | 121.7 Ų | 121.7 | 74% | 0.74 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -65 | 148.3 | 179.3 | 27.6 | -34.7 | 0 | 0 | 0 | 111.5 | ||
| 435 | P | 68.5 | Low | 57.8 | Low | 114 Ų | 114 | 124.7 Ų | 124.7 | 74% | 0.74 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -64 | 146.6 | 175.3 | 28.2 | -34.5 | 0 | 0 | 0 | 110.7 | ||
| 436 | P | 64.4 | Low | 56 | Low | 120 Ų | 120 | 127.8 Ų | 127.8 | 78% | 0.779 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 139.4 | 179.1 | 25.6 | -34 | 0 | 0 | 0 | 110.5 | A438 | P436-A438 PolarHBondContact O-N 2.94Š|
| 437 | P | 58 | Low | 54.8 | Low | 123 Ų | 123 | 123 Ų | 123 | 80% | 0.799 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63 | 127.7 | 177.6 | 26.1 | -33.1 | 0 | 0 | 0 | 109.5 | A439 | P437-A439 PolarHBondContact O-N 3.38Š|
| 438 | A | 54.5 | Low | 53.5 | Low | 96 Ų | 96 | 127.2 Ų | 127.2 | 79% | 0.793 | 78% | 0.776 | S | S | * | * | trans | -62.4 | 108.7 | 169 | 0 | 0 | 0 | 0 | 0 | 108 | P436 S440 | P436-A438 PolarHBondContact O-N 2.94Å; A438-S440 PolarHBondContact O-N 3.3Å | ||
| 439 | A | 45.1 | Very low | 52.1 | Low | 97 Ų | 97 | 123 Ų | 123 | 80% | 0.802 | 77% | 0.77 | S | S | * | * | trans | -62.4 | 107.5 | -178 | 0 | 0 | 0 | 0 | 0 | 110.1 | P437 | P437-A439 PolarHBondContact O-N 3.38Š| ||
| 440 | S | 37 | Very low | 50.6 | Low | 110 Ų | 110 | 121.8 Ų | 121.8 | 77% | 0.769 | 77% | 0.767 | S | S | * | * | trans | -73.6 | 134.5 | 166.1 | -71.4 | 0 | 0 | 0 | 0 | 109.7 | A438 | A438-S440 PolarHBondContact O-N 3.3Š| ||
| 441 | S | 35.3 | Very low | 49.2 | Very low | 118 Ų | 118 | 127.5 Ų | 127.5 | 83% | 0.825 | 78% | 0.778 | S | S | * | * | trans | 79.5 | 171 | 169.6 | 85.2 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 442 | A | 38.1 | Very low | 47.7 | Very low | 86 Ų | 86 | 127.7 Ų | 127.7 | 71% | 0.711 | 78% | 0.782 | S | S | * | * | trans | 78.6 | 62.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 443 | L | 30.5 | Very low | 46.5 | Very low | 179 Ų | 179 | 127.7 Ų | 127.7 | 94% | 0.937 | 79% | 0.785 | S | S | * | * | -77.1 | 124.4 | 126.1 | -99.8 | 166 | 0 | 0 | 0 | 108 | |||||
| 444 | P | 38.8 | Very low | 45.3 | Very low | 99 Ų | 99 | 127.9 Ų | 127.9 | 64% | 0.643 | 78% | 0.784 | S | S | * | * | trans | -115.5 | 159.9 | 169.3 | 40.2 | -31.2 | 0 | 0 | 0 | 112.9 | ||||
| 445 | Q | 32.6 | Very low | 44.4 | Very low | 179 Ų | 179 | 126.3 Ų | 126.3 | 84% | 0.836 | 78% | 0.78 | S | S | * | * | trans | 75.6 | 115.7 | 161 | -48 | -151.6 | 0.7 | 0 | 0 | 120.7 | ||||
| 446 | K | 34.1 | Very low | 43.8 | Very low | 189 Ų | 189 | 126.7 Ų | 126.7 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | 16.6 | 108.5 | 126.1 | -58.5 | 176.3 | 178.7 | 179.8 | 0 | 117.1 | |||||
| 447 | L | 42.3 | Very low | 43.4 | Very low | 140 Ų | 140 | 125.9 Ų | 125.9 | 73% | 0.733 | 78% | 0.775 | S | S | * | * | 174.7 | 149.2 | 111.3 | -108.9 | 109.2 | 0 | 0 | 0 | 108 | |||||
| 448 | F | 43 | Very low | 43.6 | Very low | 199 Ų | 199 | 125.4 Ų | 125.4 | 87% | 0.873 | 77% | 0.772 | S | S | * | * | trans | 62.4 | 112.4 | -173.3 | -45.5 | -77.3 | 0 | 0 | 0 | 113.5 | ||||
| 449 | G | 36.2 | Very low | 43.8 | Very low | 69 Ų | 69 | 126.3 Ų | 126.3 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | cis | 99.3 | 80.5 | 20.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 450 | S | 37.7 | Very low | 44.6 | Very low | 106 Ų | 106 | 127 Ų | 127 | 74% | 0.741 | 77% | 0.766 | S | S | * | * | trans | 68.2 | 115.1 | 156.1 | -67.2 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 451 | K | 42.2 | Very low | 46.1 | Very low | 195 Ų | 195 | 127.1 Ų | 127.1 | 85% | 0.848 | 76% | 0.764 | S | S | * | * | trans | 75.1 | 92.1 | 136.6 | -57.1 | 169.8 | -172.2 | -178.7 | 0 | 118.8 | ||||
| 452 | S | 44.8 | Very low | 47.3 | Very low | 113 Ų | 113 | 132.9 Ų | 132.9 | 79% | 0.79 | 77% | 0.767 | S | S | * | * | -173.7 | 78.2 | 118.6 | 38.5 | 0 | 0 | 0 | 0 | 111.3 | V454 | S452-V454 VanDerWaalsContact C-N 3.3Å; S452-V454 PolarHBondContact O-N 3.5Å | |||
| 453 | S | 47.7 | Very low | 48.2 | Very low | 116 Ų | 116 | 132.5 Ų | 132.5 | 81% | 0.811 | 76% | 0.756 | S | S | * | * | trans | -72.3 | 90.5 | 165.4 | -174.4 | 0 | 0 | 0 | 0 | 108.7 | A455 | S453-A455 PolarHBondContact O-N 3.44Š| ||
| 454 | V | 49.5 | Very low | 49.7 | Very low | 124 Ų | 124 | 130 Ų | 130 | 75% | 0.752 | 74% | 0.744 | S | S | * | * | trans | -71 | 89 | 161.2 | 179.8 | 0 | 0 | 0 | 0 | 106.1 | S452 V456 | S452-V454 VanDerWaalsContact C-N 3.3Å; S452-V454 PolarHBondContact O-N 3.5Å; V454-V456 VanDerWaalsContact C-N 3.31Å; V454-V456 PolarHBondContact O-N 3.11Å | ||
| 455 | A | 52.3 | Low | 50.8 | Low | 80 Ų | 80 | 129.2 Ų | 129.2 | 66% | 0.661 | 74% | 0.741 | S | S | * | * | trans | -64.3 | 92 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | S453 P457 | S453-A455 PolarHBondContact O-N 3.44Å; A455-P457 VanDerWaalsContact O-CD 3.28Å; A455-P457 WeakPolarHBondContact O-CD 3.28Å; A455-P457 VanDerWaalsContact O-N 3.13Å | ||
| 456 | V | 55.1 | Low | 52.3 | Low | 123 Ų | 123 | 127.2 Ų | 127.2 | 75% | 0.745 | 74% | 0.735 | S | S | * | * | trans | -59.7 | 114.9 | 168.3 | 179 | 0 | 0 | 0 | 0 | 106.5 | V454 | V454-V456 VanDerWaalsContact C-N 3.31Å; V454-V456 PolarHBondContact O-N 3.11Å | ||
| 457 | P | 57.3 | Low | 53.7 | Low | 103 Ų | 103 | 120.8 Ų | 120.8 | 67% | 0.669 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 139.5 | -178.3 | 25.4 | -33.2 | 0 | 0 | 0 | 109 | A455 | A455-P457 VanDerWaalsContact O-CD 3.28Å; A455-P457 WeakPolarHBondContact O-CD 3.28Å; A455-P457 VanDerWaalsContact O-N 3.13Å |
| 458 | P | 62.1 | Low | 54.8 | Low | 113 Ų | 113 | 118.1 Ų | 118.1 | 73% | 0.734 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -58 | 141.3 | 178 | 24.8 | -33.7 | 0 | 0 | 0 | 109.6 | ||
| 459 | P | 59 | Low | 56.1 | Low | 115 Ų | 115 | 112.8 Ų | 112.8 | 75% | 0.747 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 139.6 | 178 | 25 | -33.9 | 0 | 0 | 0 | 109.4 | ||
| 460 | P | 61.4 | Low | 57.8 | Low | 111 Ų | 111 | 113.8 Ų | 113.8 | 72% | 0.721 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 140.9 | -177 | 23.1 | -33.5 | 0 | 0 | 0 | 110 | R462 | P460-R462 PolarHBondContact O-N 3.31Š|
| 461 | P | 69.3 | Low | 59.3 | Low | 112 Ų | 112 | 114.7 Ų | 114.7 | 73% | 0.727 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 130.7 | 178.7 | 22.7 | -32.7 | 0 | 0 | 0 | 108.8 | V463 | P461-V463 PolarHBondContact O-N 3.1Š|
| 462 | R | 59.8 | Low | 60.5 | Low | 239 Ų | 239 | 115 Ų | 115 | 90% | 0.902 | 66% | 0.655 | S | S | * | * | trans | -68.5 | 80.2 | 175.2 | -72.6 | -176.8 | -179.4 | 147.4 | 1 | 109.2 | P460 D464 | P460-R462 PolarHBondContact O-N 3.31Å; R462-D464 PolarHBondContact O-N 3.18Å; R462-D464 VanDerWaalsContact O-N 3.1Å | ||
| 463 | V | 55.9 | Low | 61.7 | Low | 79 Ų | 79 | 117.9 Ų | 117.9 | 48% | 0.479 | 65% | 0.649 | S | S | . | * | trans | -60.2 | 108.2 | 157.4 | -76.9 | 0 | 0 | 0 | 0 | 106.7 | P461 S465 | P461-V463 PolarHBondContact O-N 3.1Å; V463-S465 VanDerWaalsContact C-N 3.26Å; V463-S465 PolarHBondContact O-N 3.21Å; V463-S465 PolarHBondContact O-OG 3.18Å | ||
| 464 | D | 62.9 | Low | 62.7 | Low | 127 Ų | 127 | 118 Ų | 118 | 68% | 0.679 | 64% | 0.635 | S | S | * | * | trans | -58.3 | 95.1 | 168.5 | -78.8 | -44.9 | 0 | 0 | 0 | 107.1 | R462 L466 A467 H468 | R462-D464 PolarHBondContact O-N 3.18Å; R462-D464 VanDerWaalsContact O-N 3.1Å; D464-L466 PolarHBondContact O-N 3.24Å; D464-A467 HydrophobicContact CB-CB 4.28Å; D464-A467 WeakPolarHBondContact O-CB 3.43Å; D464-A467 PolarHBondContact O-N 3.26Å; D464-H468 PolarHBondContact O-N 3.42Å | ||
| 465 | S | 62.2 | Low | 63.6 | Low | 82 Ų | 82 | 121.6 Ų | 121.6 | 57% | 0.573 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -58.6 | -28.6 | -165.2 | -50.1 | 0 | 0 | 0 | 0 | 112.3 | V463 E469 | V463-S465 VanDerWaalsContact C-N 3.26Å; V463-S465 PolarHBondContact O-N 3.21Å; V463-S465 PolarHBondContact O-OG 3.18Å; S465-E469 WeakPolarHBondContact O-CB 3.47Å; S465-E469 PolarHBondContact O-N 2.99Å |
| 466 | L | 63.1 | Low | 64.4 | Low | 137 Ų | 137 | 125 Ų | 125 | 72% | 0.717 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -63.8 | -36.3 | 173.9 | -68.1 | 172 | 0 | 0 | 0 | 113.5 | D464 L470 | D464-L466 PolarHBondContact O-N 3.24Å; L466-L470 WeakPolarHBondContact O-CB 3.36Å; L466-L470 WeakPolarHBondContact O-CD1 3.36Å; L466-L470 WeakPolarHBondContact O-CG 3.35Å; L466-L470 PolarHBondContact O-N 3.1Å; L466-L470 VanDerWaalsContact O-N 3.07Å |
| 467 | A | 65 | Low | 65 | Low | 54 Ų | 54 | 126.4 Ų | 126.4 | 45% | 0.446 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -70 | -52.8 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | D464 E469 L470 E471 | D464-A467 HydrophobicContact CB-CB 4.28Å; D464-A467 WeakPolarHBondContact O-CB 3.43Å; D464-A467 PolarHBondContact O-N 3.26Å; A467-E469 VanDerWaalsContact C-N 3.34Å; A467-E469 PolarHBondContact O-N 3.02Å; A467-L470 PolarHBondContact O-N 3.25Å; A467-E471 WeakPolarHBondContact O-CB 3.39Å; A467-E471 PolarHBondContact O-N 2.98Å |
| 468 | H | 64.1 | Low | 65.6 | Low | 83 Ų | 83 | 124.8 Ų | 124.8 | 38% | 0.384 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -64.7 | -33.9 | 177.3 | -78.1 | 6.9 | 0 | 0 | 0 | 113.2 | D464 E471 R472 | D464-H468 PolarHBondContact O-N 3.42Å; H468-E471 IonicContact ND1-OE2 2.93Å; H468-E471 PolarHBondContact O-N 3.45Å; H468-R472 WeakPolarHBondContact O-CG 3.36Å; H468-R472 PolarHBondContact O-N 2.86Å |
| 469 | E | 71.5 | Confident | 66.1 | Low | 87 Ų | 87 | 123.1 Ų | 123.1 | 41% | 0.407 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -72.8 | -34.3 | 176.8 | -177.1 | 154.4 | -163.6 | 0 | 0 | 112.4 | S465 A467 R473 | S465-E469 WeakPolarHBondContact O-CB 3.47Å; S465-E469 PolarHBondContact O-N 2.99Å; A467-E469 VanDerWaalsContact C-N 3.34Å; A467-E469 PolarHBondContact O-N 3.02Å; E469-R473 HydrophobicContact CG-CG 4.3Å; E469-R473 VanDerWaalsContact O-CB 3.27Å; E469-R473 WeakPolarHBondContact O-CB 3.46Å; E469-R473 WeakPolarHBondContact O-CD 3.47Å; E469-R473 WeakPolarHBondContact O-CG 3.31Å; E469-R473 PolarHBondContact O-N 3.31Å; E469-R473 IonicContact OE1-CZ 3.18Å; E469-R473 IonicContact OE1-NE 2.69Å; E469-R473 PolarHBondContact OE1-NE 3.13Å; E469-R473 IonicContact OE1-NH2 2.65Å; E469-R473 PolarHBondContact OE1-NH2 3.5Å |
| 470 | L | 70.4 | Confident | 66.8 | Low | 90 Ų | 90 | 126.7 Ų | 126.7 | 47% | 0.471 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -65.9 | -41.7 | 169.7 | -73.1 | 171.5 | 0 | 0 | 0 | 111.6 | L466 A467 R472 R473 F474 | L466-L470 WeakPolarHBondContact O-CB 3.36Å; L466-L470 WeakPolarHBondContact O-CD1 3.36Å; L466-L470 WeakPolarHBondContact O-CG 3.35Å; L466-L470 PolarHBondContact O-N 3.1Å; L466-L470 VanDerWaalsContact O-N 3.07Å; A467-L470 PolarHBondContact O-N 3.25Å; L470-R472 PolarHBondContact O-N 3.42Å; L470-R473 PolarHBondContact O-N 3.3Å; L470-F474 HydrophobicContact CD2-CD2 4.07Å; L470-F474 HydrophobicContact CD2-CE2 3.87Å; L470-F474 WeakPolarHBondContact O-CB 3.44Å; L470-F474 WeakPolarHBondContact O-CD2 3.47Å; L470-F474 PolarHBondContact O-N 3.35Å |
| 471 | E | 69.5 | Low | 67.3 | Low | 126 Ų | 126 | 129.3 Ų | 129.3 | 59% | 0.589 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -67.3 | -31.4 | 179.3 | -168.9 | 167.5 | -149.1 | 0 | 0 | 113.4 | A467 H468 | A467-E471 WeakPolarHBondContact O-CB 3.39Å; A467-E471 PolarHBondContact O-N 2.98Å; H468-E471 IonicContact ND1-OE2 2.93Å; H468-E471 PolarHBondContact O-N 3.45Å |
| 472 | R | 68.7 | Low | 67.5 | Low | 201 Ų | 201 | 128.7 Ų | 128.7 | 76% | 0.758 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -76.8 | -36.6 | 169.9 | -70.5 | -174 | -160.3 | 143 | 1.9 | 113.7 | H468 L470 | H468-R472 WeakPolarHBondContact O-CG 3.36Å; H468-R472 PolarHBondContact O-N 2.86Å; L470-R472 PolarHBondContact O-N 3.42Å |
| 473 | R | 68.7 | Low | 68.2 | Low | 174 Ų | 174 | 121.9 Ų | 121.9 | 66% | 0.657 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -77 | -29.1 | -178.3 | -74.5 | 173.2 | 178.7 | -136 | 8 | 112.6 | E469 L470 | E469-R473 HydrophobicContact CG-CG 4.3Å; E469-R473 VanDerWaalsContact O-CB 3.27Å; E469-R473 WeakPolarHBondContact O-CB 3.46Å; E469-R473 WeakPolarHBondContact O-CD 3.47Å; E469-R473 WeakPolarHBondContact O-CG 3.31Å; E469-R473 PolarHBondContact O-N 3.31Å; E469-R473 IonicContact OE1-CZ 3.18Å; E469-R473 IonicContact OE1-NE 2.69Å; E469-R473 PolarHBondContact OE1-NE 3.13Å; E469-R473 IonicContact OE1-NH2 2.65Å; E469-R473 PolarHBondContact OE1-NH2 3.5Å; L470-R473 PolarHBondContact O-N 3.3Å |
| 474 | F | 68.2 | Low | 69.1 | Low | 117 Ų | 117 | 121 Ų | 121 | 51% | 0.513 | 59% | 0.588 | S | S | . | * | S | Bend | trans | -123.2 | 112.6 | 179 | -61.6 | -82.4 | 0 | 0 | 0 | 109 | L470 F476 | L470-F474 HydrophobicContact CD2-CD2 4.07Å; L470-F474 HydrophobicContact CD2-CE2 3.87Å; L470-F474 WeakPolarHBondContact O-CB 3.44Å; L470-F474 WeakPolarHBondContact O-CD2 3.47Å; L470-F474 PolarHBondContact O-N 3.35Å; F474-F476 HydrophobicContact CB-CD2 4.01Å; F474-F476 HydrophobicContact CB-CE1 4.49Å; F474-F476 HydrophobicContact CB-CE2 3.57Å; F474-F476 HydrophobicContact CB-CZ 3.84Å; F474-F476 HydrophobicContact CG-CE2 4.4Å; F474-F476 HydrophobicContact CG-CZ 4.37Å; F474-F476 VanDerWaalsContact O-CD2 3.23Å; F474-F476 WeakPolarHBondContact O-CD2 3.4Å; F474-F476 PolarHBondContact O-N 3.34Å |
| 475 | F | 70.2 | Confident | 69.8 | Low | 200 Ų | 200 | 118.1 Ų | 118.1 | 88% | 0.877 | 58% | 0.576 | S | S | * | * | trans | -65 | 82.6 | 168.4 | -74.8 | -83.7 | 0 | 0 | 0 | 110 | K477 | F475-K477 PolarHBondContact O-N 3.28Š| ||
| 476 | F | 68.4 | Low | 70.3 | Confident | 153 Ų | 153 | 118.3 Ų | 118.3 | 67% | 0.671 | 58% | 0.575 | S | S | * | * | trans | -68.3 | 96.3 | 168.1 | -67.9 | -73.5 | 0 | 0 | 0 | 108 | F474 D478 | F474-F476 HydrophobicContact CB-CD2 4.01Å; F474-F476 HydrophobicContact CB-CE1 4.49Å; F474-F476 HydrophobicContact CB-CE2 3.57Å; F474-F476 HydrophobicContact CB-CZ 3.84Å; F474-F476 HydrophobicContact CG-CE2 4.4Å; F474-F476 HydrophobicContact CG-CZ 4.37Å; F474-F476 VanDerWaalsContact O-CD2 3.23Å; F474-F476 WeakPolarHBondContact O-CD2 3.4Å; F474-F476 PolarHBondContact O-N 3.34Å; F476-D478 PolarHBondContact O-N 3.35Å | ||
| 477 | K | 68.1 | Low | 70.8 | Confident | 151 Ų | 151 | 116.6 Ų | 116.6 | 66% | 0.657 | 56% | 0.564 | S | S | * | * | trans | -57.9 | 126.3 | 164.9 | -65.6 | -173.4 | 177.2 | -174.6 | 0 | 107.6 | F475 A479 L482 | F475-K477 PolarHBondContact O-N 3.28Å; K477-A479 PolarHBondContact O-N 3.26Å; K477-L482 HydrophobicContact CB-CD2 3.92Å; K477-L482 HydrophobicContact CB-CG 4.41Å; K477-L482 HydrophobicContact CD-CD2 4.39Å | ||
| 478 | D | 70 | Confident | 71.2 | Confident | 70 Ų | 70 | 119.4 Ų | 119.4 | 37% | 0.374 | 57% | 0.566 | S | S | . | * | trans | -50 | 133.5 | 172.7 | 168 | 9.4 | 0 | 0 | 0 | 108.9 | F476 R480 Y481 | F476-D478 PolarHBondContact O-N 3.35Å; D478-R480 PolarHBondContact O-N 3.21Å; D478-R480 PolarHBondContact OD1-N 3.36Å; D478-R480 IonicContact OD1-NE 2.81Å; D478-R480 IonicContact OD2-CZ 3.88Å; D478-R480 IonicContact OD2-NE 3.17Å; D478-R480 PolarHBondContact OD2-NE 2.88Å; D478-R480 IonicContact OD2-NH2 3.63Å; D478-R480 PolarHBondContact OD2-NH2 2.75Å; D478-Y481 HydrophobicContact CB-CD2 3.94Å; D478-Y481 HydrophobicContact CB-CE2 4.23Å; D478-Y481 PolarHBondContact O-N 2.88Å | ||
| 479 | A | 71.8 | Confident | 71.3 | Confident | 77 Ų | 77 | 123.2 Ų | 123.2 | 64% | 0.636 | 58% | 0.577 | S | S | * | * | G | 310 helix | trans | -56.8 | -21.1 | -169.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | K477 Y481 L482 | K477-A479 PolarHBondContact O-N 3.26Å; A479-Y481 VanDerWaalsContact C-N 3.27Å; A479-Y481 PolarHBondContact O-N 3.31Å; A479-L482 PolarHBondContact O-N 3.38Å |
| 480 | R | 73.3 | Confident | 71.2 | Confident | 191 Ų | 191 | 127.5 Ų | 127.5 | 72% | 0.721 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -66.1 | -23.4 | 173.5 | -61.3 | -177.7 | -66.9 | 160 | 1.6 | 114.2 | D478 | D478-R480 PolarHBondContact O-N 3.21Å; D478-R480 PolarHBondContact OD1-N 3.36Å; D478-R480 IonicContact OD1-NE 2.81Å; D478-R480 IonicContact OD2-CZ 3.88Å; D478-R480 IonicContact OD2-NE 3.17Å; D478-R480 PolarHBondContact OD2-NE 2.88Å; D478-R480 IonicContact OD2-NH2 3.63Å; D478-R480 PolarHBondContact OD2-NH2 2.75Å |
| 481 | Y | 72.4 | Confident | 71.1 | Confident | 165 Ų | 165 | 128.5 Ų | 128.5 | 65% | 0.647 | 60% | 0.602 | S | S | * | * | G | 310 helix | trans | -106 | 1.2 | -179.7 | -55.1 | -83.5 | 0 | 0 | 0 | 113.4 | D478 A479 | D478-Y481 HydrophobicContact CB-CD2 3.94Å; D478-Y481 HydrophobicContact CB-CE2 4.23Å; D478-Y481 PolarHBondContact O-N 2.88Å; A479-Y481 VanDerWaalsContact C-N 3.27Å; A479-Y481 PolarHBondContact O-N 3.31Å |
| 482 | L | 74.1 | Confident | 71 | Confident | 99 Ų | 99 | 133.2 Ų | 133.2 | 52% | 0.518 | 62% | 0.615 | S | S | . | * | S | Bend | trans | -77.6 | 132.6 | 169.2 | -67.6 | 176.6 | 0 | 0 | 0 | 108.7 | K477 A479 | K477-L482 HydrophobicContact CB-CD2 3.92Å; K477-L482 HydrophobicContact CB-CG 4.41Å; K477-L482 HydrophobicContact CD-CD2 4.39Å; A479-L482 PolarHBondContact O-N 3.38Å |
| 483 | P | 74 | Confident | 70.8 | Confident | 96 Ų | 96 | 129.5 Ų | 129.5 | 62% | 0.623 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 143.8 | 174.9 | 27.1 | -34.3 | 0 | 0 | 0 | 109.5 | ||
| 484 | S | 74.5 | Confident | 70.5 | Confident | 60 Ų | 60 | 128.7 Ų | 128.7 | 42% | 0.42 | 62% | 0.624 | S | S | . | * | P | Polyproline II helix | trans | -56.6 | 133.5 | 175.6 | 47.8 | 0 | 0 | 0 | 0 | 110 | R489 | S484-R489 PolarHBondContact O-NE 2.92Å; S484-R489 VanDerWaalsContact O-NE 3.13Å |
| 485 | P | 77 | Confident | 69.9 | Low | 67 Ų | 67 | 132 Ų | 132 | 44% | 0.435 | 64% | 0.638 | S | S | . | * | P | Polyproline II helix | trans | -57.1 | 150.6 | 176.8 | -22.8 | 33.1 | 0 | 0 | 0 | 110.5 | E487 F488 R489 | P485-E487 WeakPolarHBondContact CB-OE2 3.06Å; P485-E487 PolarHBondContact O-N 3.29Å; P485-F488 HydrophobicContact CB-CD2 4.01Å; P485-F488 HydrophobicContact CG-CD2 4.16Å; P485-F488 PolarHBondContact O-N 3.42Å; P485-R489 PolarHBondContact O-N 3.16Å |
| 486 | P | 73.5 | Confident | 69.4 | Low | 86 Ų | 86 | 133.9 Ų | 133.9 | 56% | 0.558 | 64% | 0.639 | S | S | * | * | G | 310 helix | trans | -49.6 | -36.9 | -171.8 | -28.2 | 36 | 0 | 0 | 0 | 114.2 | F488 R489 | P486-F488 VanDerWaalsContact C-N 3.28Å; P486-F488 PolarHBondContact O-N 2.93Å; P486-R489 PolarHBondContact O-N 2.92Å |
| 487 | E | 74.3 | Confident | 68.6 | Low | 101 Ų | 101 | 133 Ų | 133 | 47% | 0.472 | 65% | 0.646 | S | S | . | * | G | 310 helix | trans | -64.9 | -31.4 | -179.6 | -47 | 75.3 | -162.8 | 0 | 0 | 112.1 | P485 | P485-E487 WeakPolarHBondContact CB-OE2 3.06Å; P485-E487 PolarHBondContact O-N 3.29Å |
| 488 | F | 71.7 | Confident | 67.8 | Low | 113 Ų | 113 | 129.3 Ų | 129.3 | 50% | 0.496 | 64% | 0.644 | S | S | . | * | G | 310 helix | trans | -93.9 | -8.7 | -178.5 | -63.9 | -95.5 | 0 | 0 | 0 | 113.1 | P485 P486 Q490 L491 | P485-F488 HydrophobicContact CB-CD2 4.01Å; P485-F488 HydrophobicContact CG-CD2 4.16Å; P485-F488 PolarHBondContact O-N 3.42Å; P486-F488 VanDerWaalsContact C-N 3.28Å; P486-F488 PolarHBondContact O-N 2.93Å; F488-Q490 PolarHBondContact O-N 2.95Å; F488-L491 HydrophobicContact CD1-CD1 3.74Å; F488-L491 HydrophobicContact CE1-CD1 4.3Å; F488-L491 HydrophobicContact CG-CD1 4.47Å; F488-L491 PolarHBondContact O-N 2.92Å |
| 489 | R | 67.3 | Low | 66.9 | Low | 164 Ų | 164 | 131.9 Ų | 131.9 | 62% | 0.619 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -27.1 | 177.6 | -66.8 | -178.3 | -176.4 | -171.3 | 0.2 | 113.2 | S484 P485 P486 | S484-R489 PolarHBondContact O-NE 2.92Å; S484-R489 VanDerWaalsContact O-NE 3.13Å; P485-R489 PolarHBondContact O-N 3.16Å; P486-R489 PolarHBondContact O-N 2.92Å |
| 490 | Q | 69.6 | Low | 66 | Low | 177 Ų | 177 | 137.6 Ų | 137.6 | 83% | 0.827 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | -22.4 | 176.6 | -60.5 | -175.8 | 3 | 0 | 0 | 112.8 | F488 R492 | F488-Q490 PolarHBondContact O-N 2.95Å; Q490-R492 PolarHBondContact O-N 2.82Å; Q490-R492 VanDerWaalsContact O-N 3.11Å |
| 491 | L | 68 | Low | 64.8 | Low | 110 Ų | 110 | 133.5 Ų | 133.5 | 58% | 0.576 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -75.7 | 104 | 176.6 | -62.6 | 176.1 | 0 | 0 | 0 | 108.1 | F488 | F488-L491 HydrophobicContact CD1-CD1 3.74Å; F488-L491 HydrophobicContact CE1-CD1 4.3Å; F488-L491 HydrophobicContact CG-CD1 4.47Å; F488-L491 PolarHBondContact O-N 2.92Å |
| 492 | R | 67.1 | Low | 64.1 | Low | 225 Ų | 225 | 131.2 Ų | 131.2 | 85% | 0.849 | 68% | 0.678 | S | S | * | * | trans | -44.9 | 133.4 | 173.5 | -63.9 | -175 | -171.5 | 178.4 | 3.5 | 108.5 | Q490 I494 | Q490-R492 PolarHBondContact O-N 2.82Å; Q490-R492 VanDerWaalsContact O-N 3.11Å; R492-I494 PolarHBondContact O-N 3.32Å | ||
| 493 | P | 64.6 | Low | 63.1 | Low | 124 Ų | 124 | 132.4 Ų | 132.4 | 81% | 0.805 | 69% | 0.69 | S | S | * | * | trans | -52.3 | 112.2 | 178.1 | -26.6 | 34.1 | 0 | 0 | 0 | 109.3 | K495 | P493-K495 PolarHBondContact O-N 3.32Š| ||
| 494 | I | 62.3 | Low | 61.8 | Low | 156 Ų | 156 | 135 Ų | 135 | 80% | 0.8 | 70% | 0.699 | S | S | * | * | trans | -67.4 | 94.7 | 175.9 | -58.2 | 175.5 | 0 | 0 | 0 | 105 | R492 R496 | R492-I494 PolarHBondContact O-N 3.32Å; I494-R496 PolarHBondContact O-N 3.42Å | ||
| 495 | K | 56.5 | Low | 60.7 | Low | 187 Ų | 187 | 140.5 Ų | 140.5 | 81% | 0.813 | 72% | 0.718 | S | S | * | * | trans | -51.7 | 112 | 165.5 | -79.3 | -172.8 | 175.8 | -177.5 | 0 | 105 | P493 V497 | P493-K495 PolarHBondContact O-N 3.32Å; K495-V497 PolarHBondContact O-N 3.28Å | ||
| 496 | R | 58.4 | Low | 59.3 | Low | 240 Ų | 240 | 147.9 Ų | 147.9 | 91% | 0.906 | 74% | 0.737 | S | S | * | * | trans | -67.2 | 84.8 | 174.9 | -68.3 | -177 | -179.8 | -176.8 | 0.1 | 106.8 | I494 A498 | I494-R496 PolarHBondContact O-N 3.42Å; R496-A498 PolarHBondContact O-N 3.11Å | ||
| 497 | V | 51.2 | Low | 58 | Low | 133 Ų | 133 | 151.1 Ų | 151.1 | 81% | 0.806 | 75% | 0.748 | S | S | * | * | trans | -64.8 | 97.9 | 161.5 | -177.6 | 0 | 0 | 0 | 0 | 104.1 | K495 | K495-V497 PolarHBondContact O-N 3.28Š| ||
| 498 | A | 53.2 | Low | 56.6 | Low | 75 Ų | 75 | 152.4 Ų | 152.4 | 62% | 0.62 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -55 | 136 | 171.5 | 0 | 0 | 0 | 0 | 0 | 107.3 | R496 K500 | R496-A498 PolarHBondContact O-N 3.11Å; A498-K500 PolarHBondContact O-N 2.78Å; A498-K500 VanDerWaalsContact O-N 3.16Å |
| 499 | P | 50.8 | Low | 55.2 | Low | 123 Ų | 123 | 151.3 Ų | 151.3 | 80% | 0.799 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 126.6 | 178.8 | 23.8 | -32.7 | 0 | 0 | 0 | 108.3 | ||
| 500 | K | 52.2 | Low | 54.2 | Low | 198 Ų | 198 | 155 Ų | 155 | 86% | 0.861 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 133 | 169.6 | -97.3 | -175.8 | 171.8 | -176.4 | 0 | 107.3 | A498 | A498-K500 PolarHBondContact O-N 2.78Å; A498-K500 VanDerWaalsContact O-N 3.16Å |
| 501 | P | 48.7 | Very low | 53.5 | Low | 104 Ų | 104 | 154 Ų | 154 | 68% | 0.675 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 149.5 | 172.8 | 26.9 | -33.7 | 0 | 0 | 0 | 109.2 | T503 | P501-T503 PolarHBondContact O-N 3.31Š|
| 502 | P | 56.2 | Low | 52.7 | Low | 118 Ų | 118 | 156.3 Ų | 156.3 | 77% | 0.766 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 129 | 175.9 | 26.2 | -33.5 | 0 | 0 | 0 | 109.1 | D504 | P502-D504 PolarHBondContact O-N 3.26Š|
| 503 | T | 53.1 | Low | 51.9 | Low | 124 Ų | 124 | 152.4 Ų | 152.4 | 76% | 0.761 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 122.8 | 168.2 | -44 | 0 | 0 | 0 | 0 | 107.4 | P501 E505 | P501-T503 PolarHBondContact O-N 3.31Å; T503-E505 VanDerWaalsContact C-N 3.31Å; T503-E505 PolarHBondContact O-N 2.97Å |
| 504 | D | 47.8 | Very low | 51.1 | Low | 151 Ų | 151 | 154.1 Ų | 154.1 | 81% | 0.807 | 81% | 0.81 | S | S | * | * | trans | -66.9 | 94.1 | 166.9 | -78.3 | -45.1 | 0 | 0 | 0 | 108.5 | P502 R506 | P502-D504 PolarHBondContact O-N 3.26Å; D504-R506 PolarHBondContact O-N 2.98Å | ||
| 505 | E | 51.4 | Low | 50.4 | Low | 175 Ų | 175 | 154 Ų | 154 | 82% | 0.818 | 81% | 0.811 | S | S | * | * | trans | -69.5 | 80.3 | 163.5 | -72.2 | -168 | 177.1 | 0 | 0 | 108.3 | T503 I507 | T503-E505 VanDerWaalsContact C-N 3.31Å; T503-E505 PolarHBondContact O-N 2.97Å; E505-I507 PolarHBondContact O-N 3.22Å | ||
| 506 | R | 47 | Very low | 50 | Low | 221 Ų | 221 | 151.8 Ų | 151.8 | 83% | 0.834 | 81% | 0.811 | S | S | * | * | trans | -63.4 | 100.1 | 173.2 | -171.2 | -179.1 | -169.4 | -173.8 | 3.3 | 108 | D504 T508 | D504-R506 PolarHBondContact O-N 2.98Å; R506-T508 PolarHBondContact O-N 3.17Å | ||
| 507 | I | 46.7 | Very low | 49.4 | Very low | 154 Ų | 154 | 145.5 Ų | 145.5 | 79% | 0.79 | 80% | 0.804 | S | S | * | * | trans | -53.5 | 104 | 174.1 | -58.6 | 166.2 | 0 | 0 | 0 | 108.7 | E505 | E505-I507 PolarHBondContact O-N 3.22Š| ||
| 508 | T | 45.3 | Very low | 49.3 | Very low | 128 Ų | 128 | 146.5 Ų | 146.5 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -95.5 | 89.5 | 161 | 50.2 | 0 | 0 | 0 | 0 | 107.6 | R506 | R506-T508 PolarHBondContact O-N 3.17Š| ||
| 509 | S | 41.9 | Very low | 49 | Very low | 91 Ų | 91 | 152.4 Ų | 152.4 | 64% | 0.636 | 82% | 0.819 | S | S | * | * | trans | -82.5 | 113 | 161.9 | 59.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 510 | N | 46.8 | Very low | 48.8 | Very low | 242 Ų | 242 | 155.1 Ų | 155.1 | 100% | 1.294 | 82% | 0.821 | S | S | * | * | trans | -179.6 | 0 | 139.5 | -89.1 | -14.5 | 0 | 0 | 0 | 108.3 |
Retrieved 510 of 510 residues in 125.8 ms
(Link to these results)