| 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 | 40.8 | Very low | 52.8 | Low | 241 Ų | 241 | 142.3 Ų | 142.3 | 100% | 1.187 | 83% | 0.828 | S | S | * | * | 0 | 90.7 | 0 | -72.7 | 172 | 159 | 0 | 0 | 107.6 | |||||
| 2 | S | 43.6 | Very low | 52.5 | Low | 130 Ų | 130 | 140.6 Ų | 140.6 | 91% | 0.909 | 83% | 0.825 | S | S | * | * | trans | -83.4 | 115.1 | 177.4 | -77.3 | 0 | 0 | 0 | 0 | 109.3 | R4 | S2-R4 PolarHBondContact O-N 3.19Š| ||
| 3 | I | 50.5 | Low | 51.7 | Low | 165 Ų | 165 | 133.9 Ų | 133.9 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | trans | -84.8 | 110 | 174.2 | -58.6 | -177.5 | 0 | 0 | 0 | 107.4 | ||||
| 4 | R | 57.8 | Low | 51.4 | Low | 206 Ų | 206 | 130.1 Ų | 130.1 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 130.9 | 171.8 | -157.7 | 179.4 | -161 | -178.7 | 2.7 | 108.1 | S2 E8 | S2-R4 PolarHBondContact O-N 3.19Å; R4-E8 IonicContact NH2-OE2 3.28Å |
| 5 | P | 59.4 | Low | 51 | Low | 109 Ų | 109 | 126.7 Ų | 126.7 | 71% | 0.708 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 146.6 | 174.2 | 28.3 | -32 | 0 | 0 | 0 | 110.9 | ||
| 6 | P | 50.3 | Low | 50.6 | Low | 137 Ų | 137 | 123.3 Ų | 123.3 | 89% | 0.89 | 78% | 0.784 | S | S | * | * | S | Bend | trans | -84 | 121 | -178.6 | 32.5 | -29.8 | 0 | 0 | 0 | 110 | ||
| 7 | G | 57.8 | Low | 50.1 | Low | 74 Ų | 74 | 124.2 Ų | 124.2 | 76% | 0.763 | 78% | 0.778 | S | S | * | * | trans | 155 | 3.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 118.7 | P9 | G7-P9 WeakPolarHBondContact O-CD 3.32Š| ||
| 8 | E | 51.9 | Low | 50 | Low | 160 Ų | 160 | 121.3 Ų | 121.3 | 75% | 0.748 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 122.9 | 175.1 | -92.1 | -170.9 | 142.7 | 0 | 0 | 111.7 | R4 | R4-E8 IonicContact NH2-OE2 3.28Š|
| 9 | P | 61.3 | Low | 49.8 | Very low | 108 Ų | 108 | 122.6 Ų | 122.6 | 70% | 0.701 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 152.1 | 165.8 | 28.9 | -32.6 | 0 | 0 | 0 | 110.4 | G7 S11 | G7-P9 WeakPolarHBondContact O-CD 3.32Å; P9-S11 PolarHBondContact O-N 3.09Å |
| 10 | P | 52.9 | Low | 49.7 | Very low | 121 Ų | 121 | 122.4 Ų | 122.4 | 79% | 0.786 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -61 | 128.6 | -179.1 | 25.5 | -33.5 | 0 | 0 | 0 | 110.7 | P12 | P10-P12 VanDerWaalsContact O-CD 3.3Å; P10-P12 WeakPolarHBondContact O-CD 3.33Å |
| 11 | S | 54.7 | Low | 49.8 | Very low | 114 Ų | 114 | 125.1 Ų | 125.1 | 80% | 0.797 | 76% | 0.757 | S | S | * | * | trans | -57.4 | 115.4 | 172.8 | -157.9 | 0 | 0 | 0 | 0 | 109.3 | P9 G13 | P9-S11 PolarHBondContact O-N 3.09Å; S11-G13 PolarHBondContact O-N 3.46Å; S11-G13 VanDerWaalsContact O-N 3.14Å | ||
| 12 | P | 48.6 | Very low | 50.1 | Low | 122 Ų | 122 | 118 Ų | 118 | 79% | 0.792 | 73% | 0.731 | S | S | * | * | trans | -68.4 | 116.9 | 174 | 26.4 | -29.1 | 0 | 0 | 0 | 107.7 | P10 | P10-P12 VanDerWaalsContact O-CD 3.3Å; P10-P12 WeakPolarHBondContact O-CD 3.33Å | ||
| 13 | G | 42.3 | Very low | 50.5 | Low | 54 Ų | 54 | 117 Ų | 117 | 56% | 0.557 | 72% | 0.715 | S | S | * | * | trans | -53.2 | 159.7 | -173.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | S11 A15 | S11-G13 PolarHBondContact O-N 3.46Å; S11-G13 VanDerWaalsContact O-N 3.14Å; G13-A15 PolarHBondContact O-N 2.87Å | ||
| 14 | G | 47.5 | Very low | 51 | Low | 80 Ų | 80 | 113.6 Ų | 113.6 | 83% | 0.825 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.3 | 30 | 177.9 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 15 | A | 46.2 | Very low | 51 | Low | 79 Ų | 79 | 105.8 Ų | 105.8 | 65% | 0.653 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.3 | -25.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | G13 M17 | G13-A15 PolarHBondContact O-N 2.87Å; A15-M17 PolarHBondContact O-N 2.77Å |
| 16 | A | 44.1 | Very low | 50.8 | Low | 73 Ų | 73 | 106.4 Ų | 106.4 | 60% | 0.603 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -79.4 | -16.7 | -176.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 17 | M | 42.8 | Very low | 51.2 | Low | 138 Ų | 138 | 102.8 Ų | 102.8 | 68% | 0.68 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -88.6 | -9.3 | -179.4 | -69.9 | -66 | -124.7 | 0 | 0 | 113.8 | A15 | A15-M17 PolarHBondContact O-N 2.77Å |
| 18 | A | 47.5 | Very low | 51.1 | Low | 72 Ų | 72 | 104.6 Ų | 104.6 | 60% | 0.595 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -80.9 | -36 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 19 | E | 45.5 | Very low | 51.7 | Low | 147 Ų | 147 | 101.8 Ų | 101.8 | 69% | 0.687 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -72.3 | -29.8 | -178.5 | -80.8 | -85.9 | 132.8 | 0 | 0 | 113.3 | K21 L23 | E19-K21 VanDerWaalsContact C-N 3.31Å; E19-K21 PolarHBondContact O-N 2.74Å; E19-L23 WeakPolarHBondContact O-CD1 3.42Å |
| 20 | L | 49.3 | Very low | 52 | Low | 117 Ų | 117 | 99.9 Ų | 99.9 | 61% | 0.613 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -18.8 | -179.3 | -77 | 164.4 | 0 | 0 | 0 | 114.1 | ||
| 21 | K | 51.5 | Low | 52.6 | Low | 181 Ų | 181 | 99.7 Ų | 99.7 | 79% | 0.787 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.8 | -21.1 | -179 | -77.1 | 174.3 | 178 | 166.4 | 0 | 113.3 | E19 | E19-K21 VanDerWaalsContact C-N 3.31Å; E19-K21 PolarHBondContact O-N 2.74Å |
| 22 | S | 47.2 | Very low | 52.9 | Low | 91 Ų | 91 | 96.9 Ų | 96.9 | 64% | 0.636 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | -20.4 | -179.5 | -156.6 | 0 | 0 | 0 | 0 | 113.5 | S24 | S22-S24 PolarHBondContact O-N 2.78Š|
| 23 | L | 52.1 | Low | 53.5 | Low | 109 Ų | 109 | 97.6 Ų | 97.6 | 57% | 0.571 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -82.3 | -8.5 | -173.5 | -74 | 157.3 | 0 | 0 | 0 | 114.4 | E19 A27 | E19-L23 WeakPolarHBondContact O-CD1 3.42Å; L23-A27 WeakPolarHBondContact O-CB 3.35Å |
| 24 | S | 61.2 | Low | 54.4 | Low | 93 Ų | 93 | 97.2 Ų | 97.2 | 65% | 0.65 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -84.1 | -21.9 | -170.4 | -173.7 | 0 | 0 | 0 | 0 | 114.7 | S22 | S22-S24 PolarHBondContact O-N 2.78Å |
| 25 | G | 56.2 | Low | 54.9 | Low | 42 Ų | 42 | 101.7 Ų | 101.7 | 43% | 0.433 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -87.7 | -51.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113 | A27 Y28 L29 | G25-A27 PolarHBondContact O-N 3.23Å; G25-Y28 PolarHBondContact O-N 3.04Å; G25-L29 PolarHBondContact O-N 3.13Å |
| 26 | D | 55.1 | Low | 55.3 | Low | 123 Ų | 123 | 101.2 Ų | 101.2 | 66% | 0.658 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -72.1 | -33.2 | -173.9 | -63 | -27.8 | 0 | 0 | 0 | 112.5 | Y28 L29 A30 | D26-Y28 VanDerWaalsContact C-N 3.28Å; D26-Y28 PolarHBondContact O-N 3.4Å; D26-L29 PolarHBondContact O-N 3.03Å; D26-A30 WeakPolarHBondContact O-CB 3.43Å; D26-A30 PolarHBondContact O-N 2.9Å |
| 27 | A | 59.2 | Low | 55.7 | Low | 61 Ų | 61 | 101.2 Ų | 101.2 | 50% | 0.504 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64.2 | -33.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L23 G25 L31 | L23-A27 WeakPolarHBondContact O-CB 3.35Å; G25-A27 PolarHBondContact O-N 3.23Å; A27-L31 PolarHBondContact O-N 3.4Å |
| 28 | Y | 55.5 | Low | 56.2 | Low | 111 Ų | 111 | 97.9 Ų | 97.9 | 44% | 0.435 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -72.7 | -41.5 | 178.4 | -172 | -96.8 | 0 | 0 | 0 | 112 | G25 D26 L31 S32 L168 | G25-Y28 PolarHBondContact O-N 3.04Å; D26-Y28 VanDerWaalsContact C-N 3.28Å; D26-Y28 PolarHBondContact O-N 3.4Å; Y28-L31 PolarHBondContact O-N 3.06Å; Y28-S32 PolarHBondContact O-N 3.49Å; Y28-S32 VanDerWaalsContact O-N 3.08Å; Y28-L168 HydrophobicContact CE1-CD2 3.83Å; Y28-L168 WeakPolarHBondContact OH-CD2 3.41Å |
| 29 | L | 65.3 | Low | 56.6 | Low | 102 Ų | 102 | 98 Ų | 98 | 53% | 0.534 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -67.1 | -38.7 | 175.1 | -71.1 | 172.5 | 0 | 0 | 0 | 111.8 | G25 D26 L31 S32 H33 | G25-L29 PolarHBondContact O-N 3.13Å; D26-L29 PolarHBondContact O-N 3.03Å; L29-L31 VanDerWaalsContact C-N 3.32Å; L29-L31 PolarHBondContact O-N 3.29Å; L29-S32 PolarHBondContact O-N 3.31Å; L29-S32 PolarHBondContact O-OG 3.43Å; L29-H33 PolarHBondContact O-CD2 3.22Å; L29-H33 PolarHBondContact O-N 3.36Å |
| 30 | A | 67.7 | Low | 57 | Low | 67 Ų | 67 | 95 Ų | 95 | 55% | 0.554 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -61.9 | -40.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | D26 G34 | D26-A30 WeakPolarHBondContact O-CB 3.43Å; D26-A30 PolarHBondContact O-N 2.9Å; A30-G34 PolarHBondContact O-N 3.19Å |
| 31 | L | 64.4 | Low | 56.9 | Low | 117 Ų | 117 | 92.5 Ų | 92.5 | 61% | 0.613 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.6 | -39.3 | 178 | -138.5 | 79.6 | 0 | 0 | 0 | 111.8 | A27 Y28 L29 H33 G34 Y35 | A27-L31 PolarHBondContact O-N 3.4Å; Y28-L31 PolarHBondContact O-N 3.06Å; L29-L31 VanDerWaalsContact C-N 3.32Å; L29-L31 PolarHBondContact O-N 3.29Å; L31-H33 PolarHBondContact O-N 2.9Å; L31-G34 PolarHBondContact O-N 3.35Å; L31-Y35 WeakPolarHBondContact O-CD2 3.27Å; L31-Y35 PolarHBondContact O-N 2.97Å |
| 32 | S | 62.4 | Low | 56.6 | Low | 56 Ų | 56 | 91.1 Ų | 91.1 | 39% | 0.392 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.1 | -37.9 | -179.1 | 73.8 | 0 | 0 | 0 | 0 | 112.6 | Y28 L29 Y35 A36 | Y28-S32 PolarHBondContact O-N 3.49Å; Y28-S32 VanDerWaalsContact O-N 3.08Å; L29-S32 PolarHBondContact O-N 3.31Å; L29-S32 PolarHBondContact O-OG 3.43Å; S32-Y35 PolarHBondContact O-N 3.14Å; S32-A36 PolarHBondContact O-N 3.43Å |
| 33 | H | 61.6 | Low | 56.4 | Low | 137 Ų | 137 | 91.5 Ų | 91.5 | 63% | 0.634 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -68 | -36.7 | 177.2 | -81.1 | -112.6 | 0 | 0 | 0 | 112.8 | L29 L31 Y35 A36 A37 | L29-H33 PolarHBondContact O-CD2 3.22Å; L29-H33 PolarHBondContact O-N 3.36Å; L31-H33 PolarHBondContact O-N 2.9Å; H33-Y35 VanDerWaalsContact C-N 3.34Å; H33-Y35 PolarHBondContact O-N 2.72Å; H33-A36 PolarHBondContact O-N 2.9Å; H33-A37 PolarHBondContact O-N 2.93Å |
| 34 | G | 61.1 | Low | 56 | Low | 46 Ų | 46 | 97.7 Ų | 97.7 | 47% | 0.474 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -62.9 | -36.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | A30 L31 A38 | A30-G34 PolarHBondContact O-N 3.19Å; L31-G34 PolarHBondContact O-N 3.35Å; G34-A38 PolarHBondContact O-N 2.92Å |
| 35 | Y | 57.6 | Low | 54.9 | Low | 174 Ų | 174 | 96.7 Ų | 96.7 | 68% | 0.682 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -71.5 | -32.1 | 176 | -85.8 | -83 | 0 | 0 | 0 | 113.3 | L31 S32 H33 A39 | L31-Y35 WeakPolarHBondContact O-CD2 3.27Å; L31-Y35 PolarHBondContact O-N 2.97Å; S32-Y35 PolarHBondContact O-N 3.14Å; H33-Y35 VanDerWaalsContact C-N 3.34Å; H33-Y35 PolarHBondContact O-N 2.72Å; Y35-A39 PolarHBondContact O-N 2.95Å |
| 36 | A | 53.5 | Low | 53.8 | Low | 68 Ų | 68 | 99.5 Ų | 99.5 | 56% | 0.562 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -69.8 | -39.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | S32 H33 A39 | S32-A36 PolarHBondContact O-N 3.43Å; H33-A36 PolarHBondContact O-N 2.9Å; A36-A39 PolarHBondContact O-N 3.44Å |
| 37 | A | 52.5 | Low | 53 | Low | 74 Ų | 74 | 98.6 Ų | 98.6 | 61% | 0.612 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -67.8 | -36.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113 | H33 A39 A40 | H33-A37 PolarHBondContact O-N 2.93Å; A37-A39 VanDerWaalsContact C-N 3.33Å; A37-A39 PolarHBondContact O-N 2.99Å; A37-A40 PolarHBondContact O-N 3.31Å |
| 38 | A | 55 | Low | 52 | Low | 68 Ų | 68 | 107.6 Ų | 107.6 | 56% | 0.562 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -69.5 | -28.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | G34 | G34-A38 PolarHBondContact O-N 2.92Å |
| 39 | A | 53.9 | Low | 51 | Low | 73 Ų | 73 | 110.4 Ų | 110.4 | 60% | 0.603 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -75.4 | -28.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | Y35 A36 A37 G41 | Y35-A39 PolarHBondContact O-N 2.95Å; A36-A39 PolarHBondContact O-N 3.44Å; A37-A39 VanDerWaalsContact C-N 3.33Å; A37-A39 PolarHBondContact O-N 2.99Å; A39-G41 VanDerWaalsContact C-N 3.26Å; A39-G41 PolarHBondContact O-N 2.9Å |
| 40 | A | 53.9 | Low | 50.6 | Low | 85 Ų | 85 | 110.7 Ų | 110.7 | 70% | 0.702 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -72 | -17.8 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | A37 | A37-A40 PolarHBondContact O-N 3.31Å |
| 41 | G | 47.9 | Very low | 48.9 | Very low | 65 Ų | 65 | 116.5 Ų | 116.5 | 67% | 0.67 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -3.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | A39 | A39-G41 VanDerWaalsContact C-N 3.26Å; A39-G41 PolarHBondContact O-N 2.9Å |
| 42 | L | 45 | Very low | 47.3 | Very low | 152 Ų | 152 | 115.2 Ų | 115.2 | 80% | 0.796 | 71% | 0.711 | S | S | * | * | trans | -102.2 | 45.5 | -177 | -73.2 | 166.8 | 0 | 0 | 0 | 112.6 | Y44 | L42-Y44 PolarHBondContact O-N 3.47Å; L42-Y44 VanDerWaalsContact O-N 3.15Å | ||
| 43 | A | 43.7 | Very low | 46.3 | Very low | 98 Ų | 98 | 117.6 Ų | 117.6 | 81% | 0.81 | 74% | 0.735 | S | S | * | * | trans | -76.5 | 93.6 | 163.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | G45 | A43-G45 PolarHBondContact O-N 3.17Š| ||
| 44 | Y | 43 | Very low | 45.1 | Very low | 240 Ų | 240 | 122.7 Ų | 122.7 | 94% | 0.941 | 75% | 0.748 | S | S | * | * | trans | -68.3 | 110.6 | 177 | -163.4 | -92 | 0 | 0 | 0 | 110.5 | L42 | L42-Y44 PolarHBondContact O-N 3.47Å; L42-Y44 VanDerWaalsContact O-N 3.15Å | ||
| 45 | G | 37.9 | Very low | 43.9 | Very low | 71 Ų | 71 | 123.6 Ų | 123.6 | 73% | 0.732 | 76% | 0.757 | S | S | * | * | trans | 91.1 | 87.9 | 146.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | A43 | A43-G45 PolarHBondContact O-N 3.17Š| ||
| 46 | A | 34.2 | Very low | 42.8 | Very low | 101 Ų | 101 | 126.6 Ų | 126.6 | 84% | 0.835 | 77% | 0.769 | S | S | * | * | trans | -114.9 | 124.1 | 157 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 47 | A | 38.8 | Very low | 41.8 | Very low | 105 Ų | 105 | 127.1 Ų | 127.1 | 87% | 0.868 | 78% | 0.781 | S | S | * | * | trans | 72.1 | 119.6 | 159 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 48 | R | 37.3 | Very low | 41.1 | Very low | 250 Ų | 250 | 130.2 Ų | 130.2 | 94% | 0.943 | 79% | 0.792 | S | S | * | * | -176.5 | 124.7 | 98.1 | -158.2 | 171.4 | 166.6 | 161.3 | -3.2 | 112.9 | |||||
| 49 | E | 33.6 | Very low | 40.9 | Very low | 169 Ų | 169 | 133.2 Ų | 133.2 | 79% | 0.79 | 81% | 0.806 | S | S | * | * | trans | -80.6 | -173.1 | 169.4 | -76.8 | -88.2 | 128.2 | 0 | 0 | 112.1 | ||||
| 50 | P | 58.2 | Low | 39.9 | Very low | 108 Ų | 108 | 133.1 Ų | 133.1 | 70% | 0.701 | 81% | 0.813 | S | S | * | * | -129.4 | -168.2 | -56.2 | 36.8 | -18.7 | 0 | 0 | 0 | 112.7 | |||||
| 51 | E | 31.3 | Very low | 39.8 | Very low | 189 Ų | 189 | 135.8 Ų | 135.8 | 88% | 0.883 | 82% | 0.822 | S | S | * | * | trans | 98.6 | 112.2 | 158.4 | -148 | -154.9 | 135 | 0 | 0 | 119 | ||||
| 52 | A | 32 | Very low | 39.1 | Very low | 90 Ų | 90 | 136.5 Ų | 136.5 | 74% | 0.744 | 83% | 0.83 | S | S | * | * | 176 | 98 | 119.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | R54 | A52-R54 PolarHBondContact O-N 2.93Š| |||
| 53 | A | 40.8 | Very low | 38.7 | Very low | 107 Ų | 107 | 132.3 Ų | 132.3 | 88% | 0.884 | 82% | 0.824 | S | S | * | * | trans | -71.7 | 121 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 54 | R | 37.1 | Very low | 38.5 | Very low | 244 Ų | 244 | 135.7 Ų | 135.7 | 92% | 0.921 | 83% | 0.828 | S | S | * | * | trans | -132.7 | 102.3 | 161.4 | -118.2 | -177.1 | 177.5 | -160.7 | -0.6 | 108.3 | A52 | A52-R54 PolarHBondContact O-N 2.93Š| ||
| 55 | G | 35.1 | Very low | 38.5 | Very low | 64 Ų | 64 | 132.5 Ų | 132.5 | 66% | 0.66 | 83% | 0.827 | S | S | * | * | trans | -82.2 | 155 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 56 | Y | 34.3 | Very low | 38.8 | Very low | 238 Ų | 238 | 135.3 Ų | 135.3 | 93% | 0.933 | 83% | 0.832 | S | S | * | * | trans | -167.4 | 109.7 | 147.1 | -83.4 | -73.7 | 0 | 0 | 0 | 102.9 | ||||
| 57 | G | 33.3 | Very low | 39 | Very low | 78 Ų | 78 | 135.2 Ų | 135.2 | 80% | 0.804 | 83% | 0.831 | S | S | * | * | 114.4 | 103.1 | 70.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 58 | T | 37.8 | Very low | 39.2 | Very low | 140 Ų | 140 | 134.7 Ų | 134.7 | 86% | 0.859 | 83% | 0.827 | S | S | * | * | trans | -73.6 | 161.6 | 155.8 | 15.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 59 | P | 49.7 | Very low | 39.4 | Very low | 130 Ų | 130 | 128.9 Ų | 128.9 | 84% | 0.844 | 82% | 0.821 | S | S | * | * | cis | -146.9 | 169.7 | 36.1 | 39.1 | -18 | 0 | 0 | 0 | 117.4 | ||||
| 60 | G | 33 | Very low | 40 | Very low | 72 Ų | 72 | 125.1 Ų | 125.1 | 74% | 0.742 | 82% | 0.819 | S | S | * | * | trans | 148.6 | 139.8 | 150.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 61 | P | 52.1 | Low | 39.3 | Very low | 140 Ų | 140 | 126.3 Ų | 126.3 | 91% | 0.909 | 83% | 0.827 | S | S | * | * | trans | -108.1 | 160.9 | -156.2 | 39.6 | -28.8 | 0 | 0 | 0 | 114.9 | ||||
| 62 | G | 33.8 | Very low | 39.8 | Very low | 81 Ų | 81 | 129.2 Ų | 129.2 | 84% | 0.835 | 83% | 0.83 | S | S | * | * | trans | 142.3 | 113.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 63 | G | 36.6 | Very low | 40.2 | Very low | 64 Ų | 64 | 129.4 Ų | 129.4 | 66% | 0.66 | 83% | 0.831 | S | S | * | * | 133.9 | 118.7 | 50.9 | 0 | 0 | 0 | 0 | 0 | 104 | |||||
| 64 | D | 39.1 | Very low | 40.5 | Very low | 168 Ų | 168 | 130.5 Ų | 130.5 | 90% | 0.898 | 83% | 0.829 | S | S | * | * | trans | 70.9 | 102.9 | 159.4 | -47.2 | -40 | 0 | 0 | 0 | 119.4 | ||||
| 65 | L | 42.9 | Very low | 40.6 | Very low | 174 Ų | 174 | 123.7 Ų | 123.7 | 91% | 0.911 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 134.7 | 163.4 | -63.7 | 163.8 | 0 | 0 | 0 | 110.5 | A67 | L65-A67 PolarHBondContact O-N 3.41Š|
| 66 | P | 44.9 | Very low | 41 | Very low | 129 Ų | 129 | 130 Ų | 130 | 84% | 0.838 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 126.8 | 167.6 | 28 | -30.1 | 0 | 0 | 0 | 111.1 | ||
| 67 | A | 37.7 | Very low | 41.1 | Very low | 99 Ų | 99 | 123.3 Ų | 123.3 | 82% | 0.818 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 136.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | L65 | L65-A67 PolarHBondContact O-N 3.41Š|
| 68 | A | 42.4 | Very low | 41.5 | Very low | 95 Ų | 95 | 124.4 Ų | 124.4 | 79% | 0.785 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 140.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 69 | P | 42.6 | Very low | 41.8 | Very low | 128 Ų | 128 | 127.1 Ų | 127.1 | 83% | 0.831 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 134.5 | 169.8 | 30.6 | -29.5 | 0 | 0 | 0 | 111.5 | ||
| 70 | A | 45.7 | Very low | 41.5 | Very low | 90 Ų | 90 | 126.6 Ų | 126.6 | 74% | 0.744 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 154.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 71 | P | 43.4 | Very low | 42.4 | Very low | 133 Ų | 133 | 129 Ų | 129 | 86% | 0.864 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 132.2 | 179.5 | 32.5 | -31.2 | 0 | 0 | 0 | 111.6 | ||
| 72 | R | 41.9 | Very low | 42 | Very low | 250 Ų | 250 | 125.5 Ų | 125.5 | 94% | 0.943 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 134.8 | 168.8 | -77.3 | -176.5 | 166.3 | -147.6 | -2.4 | 110.4 | ||
| 73 | A | 40.4 | Very low | 42.7 | Very low | 94 Ų | 94 | 131.3 Ų | 131.3 | 78% | 0.777 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 158.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||
| 74 | P | 45.9 | Very low | 43.4 | Very low | 129 Ų | 129 | 137.4 Ų | 137.4 | 84% | 0.838 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -88 | 136.8 | -169.3 | 34.2 | -31 | 0 | 0 | 0 | 112.5 | ||
| 75 | A | 39.9 | Very low | 43.7 | Very low | 102 Ų | 102 | 133.6 Ų | 133.6 | 84% | 0.843 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -86.7 | 128.9 | 166.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 76 | Q | 43.8 | Very low | 43.9 | Very low | 197 Ų | 197 | 128.6 Ų | 128.6 | 92% | 0.921 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 134.6 | 169.9 | -65 | 179.2 | -27.7 | 0 | 0 | 109.9 | ||
| 77 | A | 36 | Very low | 44.4 | Very low | 97 Ų | 97 | 127.9 Ų | 127.9 | 80% | 0.802 | 81% | 0.813 | S | S | * | * | trans | -156.1 | 120 | 158.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 78 | A | 41.6 | Very low | 45.1 | Very low | 100 Ų | 100 | 131.1 Ų | 131.1 | 83% | 0.826 | 81% | 0.811 | S | S | * | * | trans | 61.2 | 111.2 | 139.9 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 79 | E | 44.8 | Very low | 45.7 | Very low | 197 Ų | 197 | 131 Ų | 131 | 92% | 0.921 | 80% | 0.798 | S | S | * | * | trans | -56.5 | 137.1 | 158.2 | -46.4 | -168.5 | 116.4 | 0 | 0 | 110.6 | ||||
| 80 | S | 42.6 | Very low | 46.3 | Very low | 119 Ų | 119 | 129.6 Ų | 129.6 | 83% | 0.832 | 78% | 0.783 | S | S | * | * | trans | -146.1 | 103.8 | 162.9 | -173.2 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 81 | S | 53 | Low | 47.1 | Very low | 124 Ų | 124 | 128.2 Ų | 128.2 | 87% | 0.867 | 77% | 0.772 | S | S | * | * | trans | -63.8 | 128.6 | 170.2 | -51.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 82 | G | 42.3 | Very low | 47.8 | Very low | 66 Ų | 66 | 128 Ų | 128 | 68% | 0.68 | 76% | 0.758 | S | S | * | * | trans | -156.2 | 87.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | Q84 | G82-Q84 PolarHBondContact O-N 3.36Š| ||
| 83 | E | 49.8 | Very low | 48.8 | Very low | 202 Ų | 202 | 120.7 Ų | 120.7 | 94% | 0.944 | 73% | 0.734 | S | S | * | * | trans | -61.2 | 112.3 | 162.9 | -59.7 | 180 | 112.8 | 0 | 0 | 107.7 | ||||
| 84 | Q | 50.4 | Low | 49.7 | Very low | 192 Ų | 192 | 121.8 Ų | 121.8 | 90% | 0.897 | 72% | 0.723 | S | S | * | * | trans | -128 | 111.4 | 167.6 | -88 | 179.2 | 5.1 | 0 | 0 | 109.9 | G82 | G82-Q84 PolarHBondContact O-N 3.36Š| ||
| 85 | S | 46.6 | Very low | 50.5 | Low | 88 Ų | 88 | 125 Ų | 125 | 62% | 0.615 | 72% | 0.718 | S | S | * | * | trans | -45.9 | 136.9 | 177.6 | -170.1 | 0 | 0 | 0 | 0 | 113.1 | D87 | S85-D87 PolarHBondContact O-N 3.49Å; S85-D87 PolarHBondContact OG-OD2 2.95Å | ||
| 86 | G | 47.3 | Very low | 51.4 | Low | 70 Ų | 70 | 125.4 Ų | 125.4 | 72% | 0.722 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.8 | 27.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 87 | D | 53.8 | Low | 52.3 | Low | 113 Ų | 113 | 126.6 Ų | 126.6 | 60% | 0.604 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.6 | -11.7 | -174.3 | -102.4 | -57 | 0 | 0 | 0 | 114.6 | S85 | S85-D87 PolarHBondContact O-N 3.49Å; S85-D87 PolarHBondContact OG-OD2 2.95Å |
| 88 | E | 54 | Low | 53.4 | Low | 168 Ų | 168 | 132.2 Ų | 132.2 | 79% | 0.785 | 70% | 0.695 | S | S | * | * | H | α-helix | trans | -80.6 | -23.6 | -172 | -51.6 | -151.3 | 133.2 | 0 | 0 | 113.8 | ||
| 89 | D | 53.6 | Low | 54.1 | Low | 92 Ų | 92 | 137.9 Ų | 137.9 | 49% | 0.492 | 70% | 0.695 | S | S | . | * | H | α-helix | trans | -71.9 | -34.7 | 179 | -87.3 | -21.2 | 0 | 0 | 0 | 111.5 | R127 | D89-R127 IonicContact OD2-CZ 3.98Å; D89-R127 VanDerWaalsContact OD2-CZ 3.28Å; D89-R127 IonicContact OD2-NH1 2.85Å; D89-R127 PolarHBondContact OD2-NH1 3.39Å; D89-R127 IonicContact OD2-NH2 3.79Å; D89-R127 PolarHBondContact OD2-NH2 2.99Å |
| 90 | D | 54.8 | Low | 54.5 | Low | 99 Ų | 99 | 131.3 Ų | 131.3 | 53% | 0.529 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -73.8 | -33.4 | -179.2 | -79.6 | -58.6 | 0 | 0 | 0 | 113 | F92 E93 Q94 | D90-F92 VanDerWaalsContact C-N 3.28Å; D90-F92 PolarHBondContact O-N 3.19Å; D90-E93 PolarHBondContact O-N 3.38Å; D90-Q94 PolarHBondContact O-N 2.94Å |
| 91 | A | 62.4 | Low | 55.2 | Low | 61 Ų | 61 | 132.8 Ų | 132.8 | 50% | 0.504 | 69% | 0.686 | S | S | . | * | H | α-helix | trans | -63.9 | -34.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | R95 | A91-R95 WeakPolarHBondContact O-CB 3.41Å; A91-R95 PolarHBondContact O-N 2.98Å |
| 92 | F | 59.5 | Low | 55.2 | Low | 129 Ų | 129 | 130.3 Ų | 130.3 | 57% | 0.566 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -74.8 | -38.3 | -178.7 | -156.1 | -95.5 | 0 | 0 | 0 | 112.5 | D90 R95 R96 | D90-F92 VanDerWaalsContact C-N 3.28Å; D90-F92 PolarHBondContact O-N 3.19Å; F92-R95 PolarHBondContact O-N 2.88Å; F92-R96 PolarHBondContact O-N 3.02Å |
| 93 | E | 61.7 | Low | 55.9 | Low | 96 Ų | 96 | 132.2 Ų | 132.2 | 45% | 0.449 | 68% | 0.683 | S | S | . | * | H | α-helix | trans | -69.6 | -40 | 175 | -78.8 | -64.5 | 158.7 | 0 | 0 | 112.1 | D90 R95 R96 R97 | D90-E93 PolarHBondContact O-N 3.38Å; E93-R95 VanDerWaalsContact C-N 3.29Å; E93-R95 PolarHBondContact O-N 3.48Å; E93-R96 PolarHBondContact O-N 3.23Å; E93-R97 PolarHBondContact O-N 3.38Å |
| 94 | Q | 61 | Low | 56.2 | Low | 117 Ų | 117 | 127.9 Ų | 127.9 | 55% | 0.547 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -61.5 | -36.4 | 173.5 | -78.9 | -174.9 | 31.5 | 0 | 0 | 112.5 | D90 R96 R97 R98 | D90-Q94 PolarHBondContact O-N 2.94Å; Q94-R96 VanDerWaalsContact C-N 3.32Å; Q94-R96 PolarHBondContact O-N 3.46Å; Q94-R97 PolarHBondContact O-N 3.45Å; Q94-R98 PolarHBondContact O-N 3.45Å |
| 95 | R | 60.9 | Low | 56.3 | Low | 195 Ų | 195 | 122.4 Ų | 122.4 | 74% | 0.736 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -68.6 | -29.3 | 178.2 | -162.9 | 170.5 | -173.2 | -112.5 | 2.2 | 112.9 | A91 F92 E93 | A91-R95 WeakPolarHBondContact O-CB 3.41Å; A91-R95 PolarHBondContact O-N 2.98Å; F92-R95 PolarHBondContact O-N 2.88Å; E93-R95 VanDerWaalsContact C-N 3.29Å; E93-R95 PolarHBondContact O-N 3.48Å |
| 96 | R | 60.6 | Low | 56.5 | Low | 111 Ų | 111 | 123 Ų | 123 | 42% | 0.419 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -72.6 | -35.1 | 172.5 | -72.9 | -122.6 | 178.8 | -152.2 | 2.1 | 112.2 | F92 E93 Q94 R98 R99 E113 | F92-R96 PolarHBondContact O-N 3.02Å; E93-R96 PolarHBondContact O-N 3.23Å; Q94-R96 VanDerWaalsContact C-N 3.32Å; Q94-R96 PolarHBondContact O-N 3.46Å; R96-R98 VanDerWaalsContact C-N 3.33Å; R96-R98 PolarHBondContact O-N 3.26Å; R96-R99 PolarHBondContact O-N 2.96Å; R96-E113 IonicContact CZ-OE2 3.59Å; R96-E113 IonicContact NH1-OE2 2.96Å; R96-E113 PolarHBondContact NH1-OE2 2.96Å; R96-E113 IonicContact NH2-OE2 3.2Å; R96-E113 PolarHBondContact NH2-OE2 3.4Å |
| 97 | R | 61.5 | Low | 57 | Low | 222 Ų | 222 | 124.3 Ų | 124.3 | 84% | 0.838 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -70.7 | -23.8 | 176.1 | -65.5 | -163.6 | 179.6 | -155.3 | 2 | 114.2 | E93 Q94 | E93-R97 PolarHBondContact O-N 3.38Å; Q94-R97 PolarHBondContact O-N 3.45Å |
| 98 | R | 60.2 | Low | 57.2 | Low | 216 Ų | 216 | 128.1 Ų | 128.1 | 82% | 0.815 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -9 | 175.3 | -68.9 | -170 | -177.7 | -153.4 | 3 | 114.4 | Q94 R96 G100 | Q94-R98 PolarHBondContact O-N 3.45Å; R96-R98 VanDerWaalsContact C-N 3.33Å; R96-R98 PolarHBondContact O-N 3.26Å; R98-G100 PolarHBondContact O-N 3.26Å |
| 99 | R | 55.7 | Low | 57.5 | Low | 219 Ų | 219 | 128.2 Ų | 128.2 | 83% | 0.826 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -88 | 99.8 | 176.5 | -146.8 | 168.9 | -173.1 | -173.7 | -0.1 | 107.9 | R96 | R96-R99 PolarHBondContact O-N 2.96Š|
| 100 | G | 52.9 | Low | 58.5 | Low | 58 Ų | 58 | 131.9 Ų | 131.9 | 60% | 0.598 | 69% | 0.686 | S | S | * | * | trans | -57.1 | 174 | -169.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | R98 G102 | R98-G100 PolarHBondContact O-N 3.26Å; G100-G102 PolarHBondContact O-N 3.32Å | ||
| 101 | P | 56.8 | Low | 59.7 | Low | 150 Ų | 150 | 132.2 Ų | 132.2 | 97% | 0.974 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -76.3 | 87.5 | -173.8 | 31.8 | -32 | 0 | 0 | 0 | 110 | ||
| 102 | G | 53.8 | Low | 60.5 | Low | 73 Ų | 73 | 139.8 Ų | 139.8 | 75% | 0.753 | 71% | 0.709 | S | S | * | * | trans | -162.6 | 44.1 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114 | G100 | G100-G102 PolarHBondContact O-N 3.32Š| ||
| 103 | S | 55.9 | Low | 61.7 | Low | 105 Ų | 105 | 136.9 Ų | 136.9 | 73% | 0.734 | 70% | 0.697 | S | S | * | * | trans | -146.6 | 63.9 | 164.9 | -168.3 | 0 | 0 | 0 | 0 | 110.2 | A105 | S103-A105 PolarHBondContact O-N 3.49Š| ||
| 104 | A | 57.4 | Low | 63.1 | Low | 112 Ų | 112 | 136.8 Ų | 136.8 | 93% | 0.926 | 70% | 0.696 | S | S | * | * | trans | -73.3 | 76.9 | 156.9 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 105 | A | 52.5 | Low | 64.6 | Low | 76 Ų | 76 | 139.8 Ų | 139.8 | 63% | 0.628 | 70% | 0.703 | S | S | * | * | trans | 178.3 | 119.6 | 160.5 | 0 | 0 | 0 | 0 | 0 | 106.6 | S103 | S103-A105 PolarHBondContact O-N 3.49Š| ||
| 106 | D | 50.3 | Low | 66 | Low | 100 Ų | 100 | 132.9 Ų | 132.9 | 54% | 0.535 | 68% | 0.684 | S | S | . | * | trans | 154.3 | 99.4 | 130.3 | -164.4 | 17.8 | 0 | 0 | 0 | 107.1 | R108 | D106-R108 PolarHBondContact O-N 3.02Å; D106-R108 WeakPolarHBondContact OD1-CB 3.31Å | ||
| 107 | G | 57.1 | Low | 67.7 | Low | 98 Ų | 98 | 130.7 Ų | 130.7 | 100% | 1.01 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -63.5 | 23.7 | 169.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 108 | R | 58.8 | Low | 69.3 | Low | 194 Ų | 194 | 127.8 Ų | 127.8 | 73% | 0.732 | 67% | 0.669 | S | S | * | * | trans | -137.4 | 50.2 | -173.5 | -152.2 | -178 | -120.5 | -113 | 2.1 | 108.9 | D106 R110 | D106-R108 PolarHBondContact O-N 3.02Å; D106-R108 WeakPolarHBondContact OD1-CB 3.31Å; R108-R110 PolarHBondContact O-N 3.44Å | ||
| 109 | R | 61 | Low | 71.1 | Confident | 169 Ų | 169 | 122.2 Ų | 122.2 | 64% | 0.638 | 66% | 0.656 | S | S | * | * | trans | -39.9 | 113.7 | 164.8 | -78.1 | -171.3 | -180 | -124.2 | 2.6 | 107.4 | ||||
| 110 | R | 74.4 | Confident | 73 | Confident | 170 Ų | 170 | 114 Ų | 114 | 64% | 0.642 | 63% | 0.632 | S | S | * | * | trans | -49.8 | 132.1 | -172.2 | -65 | -81.6 | 177.6 | 166.3 | -2.7 | 107.6 | R108 R112 E113 Q114 | R108-R110 PolarHBondContact O-N 3.44Å; R110-R112 PolarHBondContact O-N 2.86Å; R110-E113 HydrophobicContact CB-CG 4.4Å; R110-E113 PolarHBondContact O-N 3.44Å; R110-Q114 PolarHBondContact O-N 3.22Å | ||
| 111 | P | 78.3 | Confident | 75.1 | Confident | 106 Ų | 106 | 115.3 Ų | 115.3 | 69% | 0.688 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -50.3 | -27.7 | -178.4 | -30.8 | 34.9 | 0 | 0 | 0 | 113.9 | R115 | P111-R115 WeakPolarHBondContact O-CB 3.46Å; P111-R115 PolarHBondContact O-N 3.2Å |
| 112 | R | 81.1 | Confident | 77.1 | Confident | 220 Ų | 220 | 112.3 Ų | 112.3 | 83% | 0.83 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -65.8 | -42.4 | 173.4 | -65.8 | -176.2 | 177.4 | 170.9 | -1.4 | 113.8 | R110 R115 S116 | R110-R112 PolarHBondContact O-N 2.86Å; R112-R115 PolarHBondContact O-N 3.37Å; R112-S116 PolarHBondContact O-N 3.27Å; R112-S116 PolarHBondContact O-OG 3.03Å |
| 113 | E | 84.1 | Confident | 79.2 | Confident | 68 Ų | 68 | 110.5 Ų | 110.5 | 32% | 0.318 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -70.1 | -35.6 | 176.7 | -69.1 | -169.6 | -133.5 | 0 | 0 | 111.7 | R96 R110 R115 S116 L117 | R96-E113 IonicContact CZ-OE2 3.59Å; R96-E113 IonicContact NH1-OE2 2.96Å; R96-E113 PolarHBondContact NH1-OE2 2.96Å; R96-E113 IonicContact NH2-OE2 3.2Å; R96-E113 PolarHBondContact NH2-OE2 3.4Å; R110-E113 HydrophobicContact CB-CG 4.4Å; R110-E113 PolarHBondContact O-N 3.44Å; E113-R115 VanDerWaalsContact C-N 3.35Å; E113-S116 WeakPolarHBondContact CA-OG 3.24Å; E113-S116 PolarHBondContact O-N 3.28Å; E113-S116 PolarHBondContact O-OG 3.29Å; E113-L117 VanDerWaalsContact O-CG 3.25Å; E113-L117 WeakPolarHBondContact O-CG 3.38Å; E113-L117 PolarHBondContact O-N 3.26Å |
| 114 | Q | 90 | Very high | 81.3 | Confident | 94 Ų | 94 | 111.9 Ų | 111.9 | 44% | 0.439 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -68.3 | -37.4 | 174.3 | -163.7 | 168.8 | 16.8 | 0 | 0 | 111.6 | R110 R118 | R110-Q114 PolarHBondContact O-N 3.22Å; Q114-R118 WeakPolarHBondContact O-CG 3.3Å; Q114-R118 PolarHBondContact O-N 3.47Å; Q114-R118 VanDerWaalsContact O-N 3.07Å |
| 115 | R | 92.4 | Very high | 83.2 | Confident | 180 Ų | 180 | 110.3 Ų | 110.3 | 68% | 0.679 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.7 | -44.3 | 172.3 | -174 | 178.9 | 179.6 | -160.2 | -0.3 | 111.8 | P111 R112 E113 L117 R118 L119 | P111-R115 WeakPolarHBondContact O-CB 3.46Å; P111-R115 PolarHBondContact O-N 3.2Å; R112-R115 PolarHBondContact O-N 3.37Å; E113-R115 VanDerWaalsContact C-N 3.35Å; R115-L117 VanDerWaalsContact C-N 3.35Å; R115-L117 PolarHBondContact O-N 2.89Å; R115-R118 PolarHBondContact O-N 3.44Å; R115-L119 HydrophobicContact CG-CD1 4.29Å; R115-L119 WeakPolarHBondContact O-CG 3.47Å; R115-L119 PolarHBondContact O-N 3.41Å |
| 116 | S | 92 | Very high | 85.4 | Confident | 50 Ų | 50 | 114.7 Ų | 114.7 | 35% | 0.35 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.1 | -39.7 | 178.4 | 64.6 | 0 | 0 | 0 | 0 | 112.1 | R112 E113 L119 S120 | R112-S116 PolarHBondContact O-N 3.27Å; R112-S116 PolarHBondContact O-OG 3.03Å; E113-S116 WeakPolarHBondContact CA-OG 3.24Å; E113-S116 PolarHBondContact O-N 3.28Å; E113-S116 PolarHBondContact O-OG 3.29Å; S116-L119 PolarHBondContact O-N 3.19Å; S116-S120 WeakPolarHBondContact O-CB 3.25Å; S116-S120 PolarHBondContact O-N 3.3Å |
| 117 | L | 95.1 | Very high | 87.7 | Confident | 64 Ų | 64 | 115.4 Ų | 115.4 | 34% | 0.335 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.3 | -44.7 | 174.6 | -71.4 | 170.2 | 0 | 0 | 0 | 111.8 | E113 R115 L119 S120 I121 | E113-L117 VanDerWaalsContact O-CG 3.25Å; E113-L117 WeakPolarHBondContact O-CG 3.38Å; E113-L117 PolarHBondContact O-N 3.26Å; R115-L117 VanDerWaalsContact C-N 3.35Å; R115-L117 PolarHBondContact O-N 2.89Å; L117-L119 VanDerWaalsContact C-N 3.33Å; L117-L119 PolarHBondContact O-N 3.41Å; L117-S120 PolarHBondContact O-N 3Å; L117-I121 VanDerWaalsContact O-CG1 3.25Å; L117-I121 WeakPolarHBondContact O-CG1 3.35Å; L117-I121 PolarHBondContact O-N 3.34Å |
| 118 | R | 96.4 | Very high | 89.7 | Confident | 161 Ų | 161 | 118 Ų | 118 | 61% | 0.608 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.2 | -43.3 | 175.4 | -72 | 176.3 | -174.6 | -139.2 | 4.2 | 111.8 | Q114 R115 I121 N122 | Q114-R118 WeakPolarHBondContact O-CG 3.3Å; Q114-R118 PolarHBondContact O-N 3.47Å; Q114-R118 VanDerWaalsContact O-N 3.07Å; R115-R118 PolarHBondContact O-N 3.44Å; R118-I121 PolarHBondContact O-N 3.13Å; R118-N122 WeakPolarHBondContact O-CB 3.48Å; R118-N122 VanDerWaalsContact O-CG 3.23Å; R118-N122 PolarHBondContact O-N 3.32Å; R118-N122 PolarHBondContact O-ND2 3.02Å |
| 119 | L | 96.9 | Very high | 91.6 | Very high | 100 Ų | 100 | 112 Ų | 112 | 52% | 0.524 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.4 | -43.8 | 178.2 | -69.7 | 172.7 | 0 | 0 | 0 | 112.2 | R115 S116 L117 N122 A123 | R115-L119 HydrophobicContact CG-CD1 4.29Å; R115-L119 WeakPolarHBondContact O-CG 3.47Å; R115-L119 PolarHBondContact O-N 3.41Å; S116-L119 PolarHBondContact O-N 3.19Å; L117-L119 VanDerWaalsContact C-N 3.33Å; L117-L119 PolarHBondContact O-N 3.41Å; L119-N122 PolarHBondContact O-N 2.97Å; L119-A123 WeakPolarHBondContact O-CB 3.37Å; L119-A123 PolarHBondContact O-N 3.13Å |
| 120 | S | 96.3 | Very high | 93.4 | Very high | 47 Ų | 47 | 109.2 Ų | 109.2 | 33% | 0.329 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -61.3 | -43.2 | 175.5 | 167.8 | 0 | 0 | 0 | 0 | 112 | S116 L117 N122 A123 R124 | S116-S120 WeakPolarHBondContact O-CB 3.25Å; S116-S120 PolarHBondContact O-N 3.3Å; L117-S120 PolarHBondContact O-N 3Å; S120-N122 PolarHBondContact O-N 3.5Å; S120-A123 PolarHBondContact O-N 3.17Å; S120-R124 PolarHBondContact O-N 3.46Å |
| 121 | I | 97.4 | Very high | 94.5 | Very high | 85 Ų | 85 | 106.3 Ų | 106.3 | 44% | 0.436 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.2 | -45.9 | 175 | -68.7 | 165.8 | 0 | 0 | 0 | 110.7 | L117 R118 A123 R124 E125 | L117-I121 VanDerWaalsContact O-CG1 3.25Å; L117-I121 WeakPolarHBondContact O-CG1 3.35Å; L117-I121 PolarHBondContact O-N 3.34Å; R118-I121 PolarHBondContact O-N 3.13Å; I121-A123 PolarHBondContact O-N 3.47Å; I121-R124 PolarHBondContact O-N 3.35Å; I121-E125 PolarHBondContact O-N 3.04Å |
| 122 | N | 98.4 | Very high | 95.4 | Very high | 86 Ų | 86 | 105.6 Ų | 105.6 | 46% | 0.46 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.3 | -39.3 | 178.4 | -72.6 | -13.3 | 0 | 0 | 0 | 112.3 | R118 L119 S120 E125 R126 | R118-N122 WeakPolarHBondContact O-CB 3.48Å; R118-N122 VanDerWaalsContact O-CG 3.23Å; R118-N122 PolarHBondContact O-N 3.32Å; R118-N122 PolarHBondContact O-ND2 3.02Å; L119-N122 PolarHBondContact O-N 2.97Å; S120-N122 PolarHBondContact O-N 3.5Å; N122-E125 PolarHBondContact O-N 3.4Å; N122-R126 WeakPolarHBondContact O-CG 3.46Å; N122-R126 PolarHBondContact O-N 3.49Å |
| 123 | A | 98.1 | Very high | 96.2 | Very high | 36 Ų | 36 | 97.4 Ų | 97.4 | 30% | 0.298 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -62 | -44.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111 | L119 S120 I121 E125 R126 R127 | L119-A123 WeakPolarHBondContact O-CB 3.37Å; L119-A123 PolarHBondContact O-N 3.13Å; S120-A123 PolarHBondContact O-N 3.17Å; I121-A123 PolarHBondContact O-N 3.47Å; A123-E125 PolarHBondContact O-N 3.26Å; A123-R126 PolarHBondContact O-N 3.29Å; A123-R127 PolarHBondContact O-N 2.96Å; A123-R127 VanDerWaalsContact O-N 3.09Å |
| 124 | R | 98.4 | Very high | 96.8 | Very high | 134 Ų | 134 | 98.9 Ų | 98.9 | 51% | 0.506 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.9 | -41.9 | 175.7 | -171.6 | 175.5 | 68.6 | -106.5 | 2.2 | 112.5 | S120 I121 R126 R127 R128 | S120-R124 PolarHBondContact O-N 3.46Å; I121-R124 PolarHBondContact O-N 3.35Å; R124-R126 VanDerWaalsContact C-N 3.34Å; R124-R126 PolarHBondContact O-N 2.98Å; R124-R127 WeakPolarHBondContact O-CB 3.42Å; R124-R127 PolarHBondContact O-N 3.01Å; R124-R128 PolarHBondContact O-N 2.96Å |
| 125 | E | 98.4 | Very high | 97.1 | Very high | 78 Ų | 78 | 97.6 Ų | 97.6 | 36% | 0.364 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -67.6 | -35.2 | 178.4 | -172 | 57.9 | -156.6 | 0 | 0 | 112.2 | I121 N122 A123 R128 M129 | I121-E125 PolarHBondContact O-N 3.04Å; N122-E125 PolarHBondContact O-N 3.4Å; A123-E125 PolarHBondContact O-N 3.26Å; E125-R128 PolarHBondContact O-N 2.85Å; E125-R128 IonicContact OE1-CZ 2.95Å; E125-R128 IonicContact OE1-NH1 2.65Å; E125-R128 PolarHBondContact OE1-NH1 3.11Å; E125-R128 IonicContact OE2-NH1 3.67Å; E125-M129 WeakPolarHBondContact O-CB 3.32Å; E125-M129 PolarHBondContact O-N 3.07Å |
| 126 | R | 98.6 | Very high | 97.3 | Very high | 169 Ų | 169 | 90 Ų | 90 | 64% | 0.638 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -60 | -47.4 | 171.3 | -71 | 178.4 | -155.1 | -86.9 | 2.2 | 111 | N122 A123 R124 R128 M129 H130 | N122-R126 WeakPolarHBondContact O-CG 3.46Å; N122-R126 PolarHBondContact O-N 3.49Å; A123-R126 PolarHBondContact O-N 3.29Å; R124-R126 VanDerWaalsContact C-N 3.34Å; R124-R126 PolarHBondContact O-N 2.98Å; R126-R128 PolarHBondContact O-N 2.84Å; R126-M129 WeakPolarHBondContact O-CB 3.46Å; R126-M129 PolarHBondContact O-N 3.49Å; R126-M129 VanDerWaalsContact O-N 3.11Å; R126-H130 PolarHBondContact O-CD2 3.49Å; R126-H130 PolarHBondContact O-N 3.03Å |
| 127 | R | 98.4 | Very high | 97.4 | Very high | 114 Ų | 114 | 91 Ų | 91 | 43% | 0.43 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -56.6 | -50.8 | 176.2 | -71.2 | -171.9 | -76.3 | -109.8 | 14.6 | 111.6 | D89 A123 R124 M129 H130 D131 | D89-R127 IonicContact OD2-CZ 3.98Å; D89-R127 VanDerWaalsContact OD2-CZ 3.28Å; D89-R127 IonicContact OD2-NH1 2.85Å; D89-R127 PolarHBondContact OD2-NH1 3.39Å; D89-R127 IonicContact OD2-NH2 3.79Å; D89-R127 PolarHBondContact OD2-NH2 2.99Å; A123-R127 PolarHBondContact O-N 2.96Å; A123-R127 VanDerWaalsContact O-N 3.09Å; R124-R127 WeakPolarHBondContact O-CB 3.42Å; R124-R127 PolarHBondContact O-N 3.01Å; R127-M129 PolarHBondContact O-N 3.02Å; R127-H130 WeakPolarHBondContact O-CA 3.4Å; R127-H130 WeakPolarHBondContact O-CB 3.44Å; R127-H130 PolarHBondContact O-N 3.45Å; R127-D131 PolarHBondContact O-N 3.35Å |
| 128 | R | 98.6 | Very high | 97.3 | Very high | 153 Ų | 153 | 89.9 Ų | 89.9 | 58% | 0.577 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -54.7 | -39.7 | 174.9 | -179.1 | -178.7 | 173.6 | -102.4 | -4 | 112.8 | R124 E125 R126 L132 | R124-R128 PolarHBondContact O-N 2.96Å; E125-R128 PolarHBondContact O-N 2.85Å; E125-R128 IonicContact OE1-CZ 2.95Å; E125-R128 IonicContact OE1-NH1 2.65Å; E125-R128 PolarHBondContact OE1-NH1 3.11Å; E125-R128 IonicContact OE2-NH1 3.67Å; R126-R128 PolarHBondContact O-N 2.84Å; R128-L132 WeakPolarHBondContact O-CB 3.41Å; R128-L132 PolarHBondContact O-N 3.48Å; R128-L132 VanDerWaalsContact O-N 3.11Å |
| 129 | M | 98.6 | Very high | 97.3 | Very high | 69 Ų | 69 | 84.7 Ų | 84.7 | 34% | 0.34 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -71.3 | -34.3 | 178.3 | -163.8 | 61.7 | 52.5 | 0 | 0 | 112.5 | E125 R126 R127 L132 N133 | E125-M129 WeakPolarHBondContact O-CB 3.32Å; E125-M129 PolarHBondContact O-N 3.07Å; R126-M129 WeakPolarHBondContact O-CB 3.46Å; R126-M129 PolarHBondContact O-N 3.49Å; R126-M129 VanDerWaalsContact O-N 3.11Å; R127-M129 PolarHBondContact O-N 3.02Å; M129-L132 HydrophobicContact SD-CD2 3.99Å; M129-N133 WeakPolarHBondContact O-CB 3.4Å; M129-N133 PolarHBondContact O-N 3.46Å; M129-N133 PolarHBondContact O-ND2 2.65Å; M129-N133 VanDerWaalsContact O-ND2 3.09Å |
| 130 | H | 98.4 | Very high | 97.2 | Very high | 110 Ų | 110 | 81.2 Ų | 81.2 | 51% | 0.509 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.3 | -51.3 | 172 | -72.2 | -63.5 | 0 | 0 | 0 | 110.5 | R126 R127 L132 N133 D134 | R126-H130 PolarHBondContact O-CD2 3.49Å; R126-H130 PolarHBondContact O-N 3.03Å; R127-H130 WeakPolarHBondContact O-CA 3.4Å; R127-H130 WeakPolarHBondContact O-CB 3.44Å; R127-H130 PolarHBondContact O-N 3.45Å; H130-L132 VanDerWaalsContact C-N 3.26Å; H130-L132 PolarHBondContact O-N 2.98Å; H130-N133 PolarHBondContact O-N 3.33Å; H130-D134 VanDerWaalsContact O-CG 3.31Å; H130-D134 PolarHBondContact O-N 3.03Å |
| 131 | D | 98.3 | Very high | 97 | Very high | 108 Ų | 108 | 81.9 Ų | 81.9 | 58% | 0.578 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -55.9 | -41.8 | 177.9 | -56.4 | -22.5 | 0 | 0 | 0 | 112 | R127 D134 A135 | R127-D131 PolarHBondContact O-N 3.35Å; D131-D134 PolarHBondContact O-N 3.01Å; D131-A135 PolarHBondContact O-N 3.49Å |
| 132 | L | 98.1 | Very high | 96.9 | Very high | 92 Ų | 92 | 82.3 Ų | 82.3 | 48% | 0.482 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.6 | -42 | 175.9 | 174.6 | 63.1 | 0 | 0 | 0 | 112.3 | R128 M129 H130 L136 | R128-L132 WeakPolarHBondContact O-CB 3.41Å; R128-L132 PolarHBondContact O-N 3.48Å; R128-L132 VanDerWaalsContact O-N 3.11Å; M129-L132 HydrophobicContact SD-CD2 3.99Å; H130-L132 VanDerWaalsContact C-N 3.26Å; H130-L132 PolarHBondContact O-N 2.98Å; L132-L136 PolarHBondContact O-N 3.4Å |
| 133 | N | 96.8 | Very high | 96.6 | Very high | 47 Ų | 47 | 78.5 Ų | 78.5 | 25% | 0.251 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -69.9 | -38.2 | 179.5 | -69.2 | -29.7 | 0 | 0 | 0 | 110.9 | M129 H130 A135 L136 D137 K156 | M129-N133 WeakPolarHBondContact O-CB 3.4Å; M129-N133 PolarHBondContact O-N 3.46Å; M129-N133 PolarHBondContact O-ND2 2.65Å; M129-N133 VanDerWaalsContact O-ND2 3.09Å; H130-N133 PolarHBondContact O-N 3.33Å; N133-A135 VanDerWaalsContact C-N 3.35Å; N133-A135 PolarHBondContact O-N 2.93Å; N133-L136 CarbonylContact O-C 3.58Å; N133-L136 WeakPolarHBondContact O-CB 3.4Å; N133-L136 PolarHBondContact O-N 2.96Å; N133-L136 VanDerWaalsContact O-N 3.11Å; N133-D137 PolarHBondContact O-N 3.09Å; N133-K156 WeakPolarHBondContact OD1-CE 3.46Å; N133-K156 PolarHBondContact OD1-NZ 3.49Å |
| 134 | D | 96.3 | Very high | 96.2 | Very high | 100 Ų | 100 | 79.1 Ų | 79.1 | 54% | 0.535 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.8 | -42.5 | 176.1 | -67 | -9.9 | 0 | 0 | 0 | 110.8 | H130 D131 L136 D137 G138 | H130-D134 VanDerWaalsContact O-CG 3.31Å; H130-D134 PolarHBondContact O-N 3.03Å; D131-D134 PolarHBondContact O-N 3.01Å; D134-L136 VanDerWaalsContact C-N 3.33Å; D134-L136 PolarHBondContact O-N 3.18Å; D134-D137 PolarHBondContact O-N 3.43Å; D134-G138 PolarHBondContact O-N 3.37Å |
| 135 | A | 96.9 | Very high | 95.3 | Very high | 67 Ų | 67 | 82.8 Ų | 82.8 | 55% | 0.554 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -62.1 | -38.8 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | D131 N133 G138 L139 | D131-A135 PolarHBondContact O-N 3.49Å; N133-A135 VanDerWaalsContact C-N 3.35Å; N133-A135 PolarHBondContact O-N 2.93Å; A135-G138 PolarHBondContact O-N 2.79Å; A135-L139 PolarHBondContact O-N 3.48Å |
| 136 | L | 96.4 | Very high | 94.4 | Very high | 19 Ų | 19 | 79.3 Ų | 79.3 | 10% | 0.099 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -68.1 | -36 | 176.5 | -172.1 | 70.5 | 0 | 0 | 0 | 111.9 | L132 N133 D134 L139 R140 K156 T159 L160 | L132-L136 PolarHBondContact O-N 3.4Å; N133-L136 CarbonylContact O-C 3.58Å; N133-L136 WeakPolarHBondContact O-CB 3.4Å; N133-L136 PolarHBondContact O-N 2.96Å; N133-L136 VanDerWaalsContact O-N 3.11Å; D134-L136 VanDerWaalsContact C-N 3.33Å; D134-L136 PolarHBondContact O-N 3.18Å; L136-L139 HydrophobicContact CD1-CD2 4.3Å; L136-L139 WeakPolarHBondContact O-CB 3.35Å; L136-L139 PolarHBondContact O-N 3.27Å; L136-R140 WeakPolarHBondContact O-CG 3.19Å; L136-R140 PolarHBondContact O-N 3.07Å; L136-K156 HydrophobicContact CD2-CB 4.08Å; L136-K156 HydrophobicContact CD2-CD 4.06Å; L136-K156 HydrophobicContact CD2-CG 3.63Å; L136-T159 HydrophobicContact CD1-CG2 3.94Å; L136-T159 HydrophobicContact CG-CG2 4.42Å; L136-L160 HydrophobicContact CD1-CD2 4.38Å |
| 137 | D | 93.8 | Very high | 93.4 | Very high | 71 Ų | 71 | 77.8 Ų | 77.8 | 38% | 0.38 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -69.2 | -37.9 | 173.3 | -75.6 | -29.3 | 0 | 0 | 0 | 111.8 | N133 D134 L139 R140 A141 | N133-D137 PolarHBondContact O-N 3.09Å; D134-D137 PolarHBondContact O-N 3.43Å; D137-L139 VanDerWaalsContact C-N 3.28Å; D137-L139 PolarHBondContact O-N 3.45Å; D137-R140 WeakPolarHBondContact O-CB 3.44Å; D137-R140 PolarHBondContact O-N 3.34Å; D137-R140 VanDerWaalsContact O-N 3.13Å; D137-R140 IonicContact OD1-CZ 2.97Å; D137-R140 IonicContact OD1-NH1 2.79Å; D137-R140 PolarHBondContact OD1-NH1 2.87Å; D137-A141 PolarHBondContact O-N 3.21Å |
| 138 | G | 94.6 | Very high | 92.5 | Very high | 41 Ų | 41 | 75.2 Ų | 75.2 | 42% | 0.423 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -56.9 | -41 | 167.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | D134 A135 A141 | D134-G138 PolarHBondContact O-N 3.37Å; A135-G138 PolarHBondContact O-N 2.79Å; G138-A141 WeakPolarHBondContact O-CB 3.41Å; G138-A141 PolarHBondContact O-N 3.23Å |
| 139 | L | 95.6 | Very high | 91.5 | Very high | 53 Ų | 53 | 72.4 Ų | 72.4 | 28% | 0.277 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -63.8 | -41.7 | 173.7 | 179.4 | 62 | 0 | 0 | 0 | 112.1 | A135 L136 D137 A141 V142 I143 T159 L160 A163 | A135-L139 PolarHBondContact O-N 3.48Å; L136-L139 HydrophobicContact CD1-CD2 4.3Å; L136-L139 WeakPolarHBondContact O-CB 3.35Å; L136-L139 PolarHBondContact O-N 3.27Å; D137-L139 VanDerWaalsContact C-N 3.28Å; D137-L139 PolarHBondContact O-N 3.45Å; L139-A141 PolarHBondContact O-N 3.43Å; L139-V142 HydrophobicContact CD1-CG2 4.1Å; L139-V142 WeakPolarHBondContact O-CG2 3.14Å; L139-V142 PolarHBondContact O-N 3.18Å; L139-I143 HydrophobicContact CG-CD1 4.23Å; L139-I143 WeakPolarHBondContact O-CG1 3.48Å; L139-I143 PolarHBondContact O-N 3.36Å; L139-T159 HydrophobicContact CD2-CG2 4.21Å; L139-T159 HydrophobicContact CG-CG2 4.39Å; L139-L160 HydrophobicContact CD2-CD2 4.18Å; L139-A163 HydrophobicContact CD1-CB 3.93Å; L139-A163 HydrophobicContact CD2-CB 3.93Å; L139-A163 HydrophobicContact CG-CB 4.22Å |
| 140 | R | 95.3 | Very high | 90.4 | Very high | 26 Ų | 26 | 73.2 Ų | 73.2 | 10% | 0.098 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -60.9 | -32.3 | 174.8 | -68.6 | 178.3 | -179.6 | 105.5 | -3.5 | 112 | L136 D137 V142 A146 L154 T159 | L136-R140 WeakPolarHBondContact O-CG 3.19Å; L136-R140 PolarHBondContact O-N 3.07Å; D137-R140 WeakPolarHBondContact O-CB 3.44Å; D137-R140 PolarHBondContact O-N 3.34Å; D137-R140 VanDerWaalsContact O-N 3.13Å; D137-R140 IonicContact OD1-CZ 2.97Å; D137-R140 IonicContact OD1-NH1 2.79Å; D137-R140 PolarHBondContact OD1-NH1 2.87Å; R140-V142 PolarHBondContact O-N 3.38Å; R140-A146 WeakPolarHBondContact O-CB 3.12Å; R140-L154 PolarHBondContact NH2-O 3.05Å; R140-T159 HydrophobicContact CG-CG2 3.55Å; R140-T159 PolarHBondContact NE-OG1 3.2Å; R140-T159 PolarHBondContact NH2-OG1 2.92Å |
| 141 | A | 92.4 | Very high | 89.1 | Confident | 62 Ų | 62 | 68.8 Ų | 68.8 | 51% | 0.512 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -68.9 | -18.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114 | D137 G138 L139 H147 | D137-A141 PolarHBondContact O-N 3.21Å; G138-A141 WeakPolarHBondContact O-CB 3.41Å; G138-A141 PolarHBondContact O-N 3.23Å; L139-A141 PolarHBondContact O-N 3.43Å; A141-H147 PolarHBondContact O-CE1 3.47Å |
| 142 | V | 94.1 | Very high | 88 | Confident | 93 Ų | 93 | 73 Ų | 73 | 56% | 0.564 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -105.8 | -9.2 | 179.8 | -60.1 | 0 | 0 | 0 | 0 | 113.9 | L139 R140 Y166 | L139-V142 HydrophobicContact CD1-CG2 4.1Å; L139-V142 WeakPolarHBondContact O-CG2 3.14Å; L139-V142 PolarHBondContact O-N 3.18Å; R140-V142 PolarHBondContact O-N 3.38Å; V142-Y166 WeakPolarHBondContact O-CE1 3.44Å |
| 143 | I | 93.1 | Very high | 87.2 | Confident | 6 Ų | 6 | 77.3 Ų | 77.3 | 3% | 0.031 | 42% | 0.42 | C | S | . | . | S | Bend | trans | -76.2 | 132.9 | 176.7 | -66.6 | 167.3 | 0 | 0 | 0 | 108.9 | L139 Y145 A146 H147 T159 L162 A163 | L139-I143 HydrophobicContact CG-CD1 4.23Å; L139-I143 WeakPolarHBondContact O-CG1 3.48Å; L139-I143 PolarHBondContact O-N 3.36Å; I143-Y145 PolarHBondContact O-N 3.19Å; I143-A146 HydrophobicContact CB-CB 3.57Å; I143-A146 HydrophobicContact CG2-CB 3.75Å; I143-A146 WeakPolarHBondContact O-CB 3.15Å; I143-A146 PolarHBondContact O-N 2.95Å; I143-A146 VanDerWaalsContact O-N 3.17Å; I143-H147 PolarHBondContact O-CE1 3.32Å; I143-T159 HydrophobicContact CD1-CG2 3.99Å; I143-L162 HydrophobicContact CD1-CB 4.18Å; I143-L162 HydrophobicContact CG2-CB 4.04Å; I143-L162 HydrophobicContact CG2-CD2 4.09Å; I143-A163 HydrophobicContact CD1-CB 4.02Å; I143-A163 HydrophobicContact CG1-CB 4.42Å |
| 144 | P | 90.1 | Very high | 86.7 | Confident | 49 Ų | 49 | 77.5 Ų | 77.5 | 32% | 0.318 | 42% | 0.421 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.4 | 139.9 | 175.6 | -24.9 | 33.4 | 0 | 0 | 0 | 111.8 | A146 Y166 | P144-A146 PolarHBondContact O-N 3.42Å; P144-Y166 HydrophobicContact CG-CD1 4.37Å; P144-Y166 HydrophobicContact CG-CD2 3.48Å; P144-Y166 VanDerWaalsContact CG-CD2 3.48Å; P144-Y166 HydrophobicContact CG-CE1 4.12Å; P144-Y166 HydrophobicContact CG-CE2 3.21Å; P144-Y166 HydrophobicContact CG-CG 4.07Å |
| 145 | Y | 79.8 | Confident | 86.6 | Confident | 211 Ų | 211 | 75.7 Ų | 75.7 | 83% | 0.827 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.1 | 2 | -179.2 | -45.2 | -70.1 | 0 | 0 | 0 | 115.1 | I143 H147 | I143-Y145 PolarHBondContact O-N 3.19Å; Y145-H147 VanDerWaalsContact C-N 3.26Å; Y145-H147 PolarHBondContact O-N 3.08Å |
| 146 | A | 77.7 | Confident | 86.5 | Confident | 6 Ų | 6 | 77.3 Ų | 77.3 | 5% | 0.05 | 41% | 0.411 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81.1 | 0.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | R140 I143 P144 S148 V151 | R140-A146 WeakPolarHBondContact O-CB 3.12Å; I143-A146 HydrophobicContact CB-CB 3.57Å; I143-A146 HydrophobicContact CG2-CB 3.75Å; I143-A146 WeakPolarHBondContact O-CB 3.15Å; I143-A146 PolarHBondContact O-N 2.95Å; I143-A146 VanDerWaalsContact O-N 3.17Å; P144-A146 PolarHBondContact O-N 3.42Å; A146-S148 PolarHBondContact O-N 3.39Å; A146-V151 VanDerWaalsContact CA-CG1 3.43Å; A146-V151 HydrophobicContact CB-CB 4.29Å; A146-V151 HydrophobicContact CB-CG1 3.42Å; A146-V151 VanDerWaalsContact CB-CG1 3.42Å; A146-V151 WeakPolarHBondContact O-CB 3.18Å; A146-V151 WeakPolarHBondContact O-CG1 3.4Å |
| 147 | H | 78 | Confident | 86.6 | Confident | 136 Ų | 136 | 81.7 Ų | 81.7 | 63% | 0.63 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.3 | -8.2 | -179.2 | -47.7 | -14.2 | 0 | 0 | 0 | 112.1 | A141 I143 Y145 | A141-H147 PolarHBondContact O-CE1 3.47Å; I143-H147 PolarHBondContact O-CE1 3.32Å; Y145-H147 VanDerWaalsContact C-N 3.26Å; Y145-H147 PolarHBondContact O-N 3.08Å |
| 148 | S | 79.8 | Confident | 86.6 | Confident | 61 Ų | 61 | 79.3 Ų | 79.3 | 43% | 0.427 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -62.4 | 142.3 | 175.4 | -65.6 | 0 | 0 | 0 | 0 | 110.6 | A146 S150 V151 | A146-S148 PolarHBondContact O-N 3.39Å; S148-S150 PolarHBondContact O-N 3.41Å; S148-V151 WeakPolarHBondContact O-CB 3.42Å; S148-V151 PolarHBondContact O-N 3.16Å |
| 149 | P | 77.9 | Confident | 86.6 | Confident | 94 Ų | 94 | 77.4 Ų | 77.4 | 61% | 0.61 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.3 | -27.3 | 175 | -24 | 31.9 | 0 | 0 | 0 | 113.5 | V151 | P149-V151 PolarHBondContact O-N 2.9Š|
| 150 | S | 75.4 | Confident | 86.7 | Confident | 85 Ų | 85 | 79.5 Ų | 79.5 | 59% | 0.594 | 41% | 0.414 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.4 | -30.5 | 172.5 | -170.4 | 0 | 0 | 0 | 0 | 112.6 | S148 K153 | S148-S150 PolarHBondContact O-N 3.41Å; S150-K153 WeakPolarHBondContact O-CA 3.49Å; S150-K153 VanDerWaalsContact O-CB 3.27Å; S150-K153 WeakPolarHBondContact O-CB 3.1Å; S150-K153 PolarHBondContact O-N 2.97Å; S150-K153 VanDerWaalsContact O-N 3.09Å |
| 151 | V | 71.3 | Confident | 86.8 | Confident | 18 Ų | 18 | 82.5 Ų | 82.5 | 11% | 0.109 | 43% | 0.432 | C | S | . | . | G | 310 helix | trans | -84.8 | -27.2 | -173.8 | 173.3 | 0 | 0 | 0 | 0 | 113.3 | A146 S148 P149 K153 L154 | A146-V151 VanDerWaalsContact CA-CG1 3.43Å; A146-V151 HydrophobicContact CB-CB 4.29Å; A146-V151 HydrophobicContact CB-CG1 3.42Å; A146-V151 VanDerWaalsContact CB-CG1 3.42Å; A146-V151 WeakPolarHBondContact O-CB 3.18Å; A146-V151 WeakPolarHBondContact O-CG1 3.4Å; S148-V151 WeakPolarHBondContact O-CB 3.42Å; S148-V151 PolarHBondContact O-N 3.16Å; P149-V151 PolarHBondContact O-N 2.9Å; V151-K153 PolarHBondContact O-N 2.79Å; V151-K153 VanDerWaalsContact O-N 3.07Å; V151-L154 HydrophobicContact CB-CD1 4.21Å; V151-L154 HydrophobicContact CB-CG 4.33Å; V151-L154 HydrophobicContact CG1-CD1 3.58Å; V151-L154 HydrophobicContact CG1-CG 4.04Å; V151-L154 HydrophobicContact CG2-CD1 4.1Å; V151-L154 HydrophobicContact CG2-CG 4.39Å; V151-L154 VanDerWaalsContact O-CB 3.32Å; V151-L154 WeakPolarHBondContact O-CB 3.39Å; V151-L154 PolarHBondContact O-N 3.22Å |
| 152 | R | 75.2 | Confident | 86.9 | Confident | 195 Ų | 195 | 82.9 Ų | 82.9 | 74% | 0.736 | 43% | 0.425 | S | S | * | . | G | 310 helix | trans | -59.1 | -15.3 | 161.5 | -80.4 | -168.5 | -79.7 | -178.1 | -5.8 | 112.8 | ||
| 153 | K | 80.8 | Confident | 87 | Confident | 183 Ų | 183 | 79 Ų | 79 | 80% | 0.796 | 40% | 0.402 | S | S | * | . | G | 310 helix | trans | -96 | 0.4 | 171.7 | -52.5 | 178 | 178.5 | 178.8 | 0 | 113.6 | S150 V151 | S150-K153 WeakPolarHBondContact O-CA 3.49Å; S150-K153 VanDerWaalsContact O-CB 3.27Å; S150-K153 WeakPolarHBondContact O-CB 3.1Å; S150-K153 PolarHBondContact O-N 2.97Å; S150-K153 VanDerWaalsContact O-N 3.09Å; V151-K153 PolarHBondContact O-N 2.79Å; V151-K153 VanDerWaalsContact O-N 3.07Å |
| 154 | L | 86.1 | Confident | 87.3 | Confident | 52 Ų | 52 | 84.1 Ų | 84.1 | 27% | 0.272 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -68.6 | 137.6 | 173.8 | -74.1 | -176.6 | 0 | 0 | 0 | 111 | R140 V151 A158 L162 | R140-L154 PolarHBondContact NH2-O 3.05Å; V151-L154 HydrophobicContact CB-CD1 4.21Å; V151-L154 HydrophobicContact CB-CG 4.33Å; V151-L154 HydrophobicContact CG1-CD1 3.58Å; V151-L154 HydrophobicContact CG1-CG 4.04Å; V151-L154 HydrophobicContact CG2-CD1 4.1Å; V151-L154 HydrophobicContact CG2-CG 4.39Å; V151-L154 VanDerWaalsContact O-CB 3.32Å; V151-L154 WeakPolarHBondContact O-CB 3.39Å; V151-L154 PolarHBondContact O-N 3.22Å; L154-A158 HydrophobicContact CB-CB 4.32Å; L154-A158 HydrophobicContact CD2-CB 4.27Å; L154-L162 HydrophobicContact CD1-CD2 3.97Å |
| 155 | S | 94.4 | Very high | 87.6 | Confident | 62 Ų | 62 | 86.4 Ų | 86.4 | 43% | 0.434 | 43% | 0.434 | S | S | . | . | trans | -61.4 | 160.1 | 174.5 | 68.6 | 0 | 0 | 0 | 0 | 112 | I157 A158 T159 | S155-I157 VanDerWaalsContact C-N 3.27Å; S155-I157 PolarHBondContact O-N 2.96Å; S155-I157 VanDerWaalsContact OG-CG2 3.3Å; S155-I157 WeakPolarHBondContact OG-CG2 3.32Å; S155-A158 PolarHBondContact O-N 3.41Å; S155-A158 WeakPolarHBondContact OG-CB 3.47Å; S155-A158 PolarHBondContact OG-N 3.26Å; S155-T159 PolarHBondContact O-N 3.09Å; S155-T159 PolarHBondContact O-OG1 3.11Å | ||
| 156 | K | 95.8 | Very high | 88.4 | Confident | 100 Ų | 100 | 79.4 Ų | 79.4 | 44% | 0.435 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -56.7 | -43.9 | 176.7 | -59.8 | -164.2 | 170.2 | -170.9 | 0 | 111.1 | N133 L136 T159 L160 | N133-K156 WeakPolarHBondContact OD1-CE 3.46Å; N133-K156 PolarHBondContact OD1-NZ 3.49Å; L136-K156 HydrophobicContact CD2-CB 4.08Å; L136-K156 HydrophobicContact CD2-CD 4.06Å; L136-K156 HydrophobicContact CD2-CG 3.63Å; K156-T159 PolarHBondContact O-N 3.5Å; K156-L160 WeakPolarHBondContact O-CG 3.27Å; K156-L160 PolarHBondContact O-N 3Å; K156-L160 VanDerWaalsContact O-N 3.13Å |
| 157 | I | 96.8 | Very high | 89.4 | Confident | 112 Ų | 112 | 83.7 Ų | 83.7 | 57% | 0.574 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -65.6 | -42.8 | 179.3 | -171.5 | 63 | 0 | 0 | 0 | 112.4 | S155 T159 L160 L161 | S155-I157 VanDerWaalsContact C-N 3.27Å; S155-I157 PolarHBondContact O-N 2.96Å; S155-I157 VanDerWaalsContact OG-CG2 3.3Å; S155-I157 WeakPolarHBondContact OG-CG2 3.32Å; I157-T159 VanDerWaalsContact C-N 3.33Å; I157-T159 PolarHBondContact O-N 3.11Å; I157-L160 PolarHBondContact O-N 2.99Å; I157-L161 HydrophobicContact CG1-CD1 4.32Å; I157-L161 WeakPolarHBondContact O-CG 3.1Å; I157-L161 PolarHBondContact O-N 3.09Å |
| 158 | A | 94.6 | Very high | 90.4 | Very high | 21 Ų | 21 | 80.1 Ų | 80.1 | 17% | 0.174 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -61.7 | -44.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | L154 S155 L160 L161 L162 | L154-A158 HydrophobicContact CB-CB 4.32Å; L154-A158 HydrophobicContact CD2-CB 4.27Å; S155-A158 PolarHBondContact O-N 3.41Å; S155-A158 WeakPolarHBondContact OG-CB 3.47Å; S155-A158 PolarHBondContact OG-N 3.26Å; A158-L160 VanDerWaalsContact C-N 3.34Å; A158-L160 PolarHBondContact O-N 2.89Å; A158-L161 PolarHBondContact O-N 3.04Å; A158-L162 WeakPolarHBondContact O-CD1 3.49Å; A158-L162 PolarHBondContact O-N 3.39Å |
| 159 | T | 95.6 | Very high | 91.2 | Very high | 1 Ų | 1 | 81.8 Ų | 81.8 | 1% | 0.006 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -57.6 | -45.8 | 177.7 | -54 | 0 | 0 | 0 | 0 | 111.6 | L136 L139 R140 I143 S155 K156 I157 L161 L162 A163 | L136-T159 HydrophobicContact CD1-CG2 3.94Å; L136-T159 HydrophobicContact CG-CG2 4.42Å; L139-T159 HydrophobicContact CD2-CG2 4.21Å; L139-T159 HydrophobicContact CG-CG2 4.39Å; R140-T159 HydrophobicContact CG-CG2 3.55Å; R140-T159 PolarHBondContact NE-OG1 3.2Å; R140-T159 PolarHBondContact NH2-OG1 2.92Å; I143-T159 HydrophobicContact CD1-CG2 3.99Å; S155-T159 PolarHBondContact O-N 3.09Å; S155-T159 PolarHBondContact O-OG1 3.11Å; K156-T159 PolarHBondContact O-N 3.5Å; I157-T159 VanDerWaalsContact C-N 3.33Å; I157-T159 PolarHBondContact O-N 3.11Å; T159-L161 PolarHBondContact O-N 2.82Å; T159-L162 PolarHBondContact O-N 3.22Å; T159-A163 WeakPolarHBondContact O-CB 3.42Å; T159-A163 PolarHBondContact O-N 3.3Å |
| 160 | L | 97.4 | Very high | 92.2 | Very high | 96 Ų | 96 | 81.2 Ų | 81.2 | 50% | 0.503 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -65.8 | -37.8 | 179 | -65.9 | 175.5 | 0 | 0 | 0 | 112.7 | L136 L139 K156 I157 A158 A163 K164 | L136-L160 HydrophobicContact CD1-CD2 4.38Å; L139-L160 HydrophobicContact CD2-CD2 4.18Å; K156-L160 WeakPolarHBondContact O-CG 3.27Å; K156-L160 PolarHBondContact O-N 3Å; K156-L160 VanDerWaalsContact O-N 3.13Å; I157-L160 PolarHBondContact O-N 2.99Å; A158-L160 VanDerWaalsContact C-N 3.34Å; A158-L160 PolarHBondContact O-N 2.89Å; L160-A163 PolarHBondContact O-N 3.13Å; L160-K164 PolarHBondContact O-N 3.02Å |
| 161 | L | 96.3 | Very high | 93.3 | Very high | 90 Ų | 90 | 79.3 Ų | 79.3 | 47% | 0.471 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -65.7 | -44.7 | 175.7 | -71.6 | 173.3 | 0 | 0 | 0 | 111.9 | I157 A158 T159 A163 K164 N165 | I157-L161 HydrophobicContact CG1-CD1 4.32Å; I157-L161 WeakPolarHBondContact O-CG 3.1Å; I157-L161 PolarHBondContact O-N 3.09Å; A158-L161 PolarHBondContact O-N 3.04Å; T159-L161 PolarHBondContact O-N 2.82Å; L161-A163 VanDerWaalsContact C-N 3.34Å; L161-A163 PolarHBondContact O-N 3.22Å; L161-K164 PolarHBondContact O-N 3.49Å; L161-N165 PolarHBondContact O-N 3.44Å |
| 162 | L | 95 | Very high | 94.5 | Very high | 69 Ų | 69 | 84.5 Ų | 84.5 | 36% | 0.361 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.4 | -43.9 | 176.2 | -90.4 | 74.2 | 0 | 0 | 0 | 111.1 | I143 L154 A158 T159 K164 N165 Y166 | I143-L162 HydrophobicContact CD1-CB 4.18Å; I143-L162 HydrophobicContact CG2-CB 4.04Å; I143-L162 HydrophobicContact CG2-CD2 4.09Å; L154-L162 HydrophobicContact CD1-CD2 3.97Å; A158-L162 WeakPolarHBondContact O-CD1 3.49Å; A158-L162 PolarHBondContact O-N 3.39Å; T159-L162 PolarHBondContact O-N 3.22Å; L162-K164 PolarHBondContact O-N 2.95Å; L162-N165 PolarHBondContact O-N 3.4Å; L162-Y166 WeakPolarHBondContact O-CB 3.5Å; L162-Y166 PolarHBondContact O-N 3.28Å |
| 163 | A | 97 | Very high | 95.6 | Very high | 11 Ų | 11 | 76.8 Ų | 76.8 | 9% | 0.091 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -59.4 | -46.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L139 I143 T159 L160 L161 N165 Y166 I167 | L139-A163 HydrophobicContact CD1-CB 3.93Å; L139-A163 HydrophobicContact CD2-CB 3.93Å; L139-A163 HydrophobicContact CG-CB 4.22Å; I143-A163 HydrophobicContact CD1-CB 4.02Å; I143-A163 HydrophobicContact CG1-CB 4.42Å; T159-A163 WeakPolarHBondContact O-CB 3.42Å; T159-A163 PolarHBondContact O-N 3.3Å; L160-A163 PolarHBondContact O-N 3.13Å; L161-A163 VanDerWaalsContact C-N 3.34Å; L161-A163 PolarHBondContact O-N 3.22Å; A163-N165 PolarHBondContact O-N 3.03Å; A163-Y166 PolarHBondContact O-N 3.22Å; A163-I167 WeakPolarHBondContact O-CG1 3.47Å; A163-I167 PolarHBondContact O-N 3.35Å |
| 164 | K | 97.6 | Very high | 96.4 | Very high | 114 Ų | 114 | 72.3 Ų | 72.3 | 50% | 0.496 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -56.7 | -50.4 | 176.2 | 177.5 | -171.9 | 172.2 | -174.4 | 0 | 111.3 | L160 L161 L162 Y166 I167 L168 | L160-K164 PolarHBondContact O-N 3.02Å; L161-K164 PolarHBondContact O-N 3.49Å; L162-K164 PolarHBondContact O-N 2.95Å; K164-Y166 VanDerWaalsContact C-N 3.27Å; K164-Y166 PolarHBondContact O-N 3.37Å; K164-I167 PolarHBondContact O-N 3.38Å; K164-L168 HydrophobicContact CG-CD1 4.43Å; K164-L168 PolarHBondContact O-N 3.48Å; K164-L168 VanDerWaalsContact O-N 3.13Å |
| 165 | N | 97.1 | Very high | 97 | Very high | 97 Ų | 97 | 74 Ų | 74 | 52% | 0.519 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.2 | -36.6 | -178.6 | -69.6 | -12.7 | 0 | 0 | 0 | 111.5 | L161 L162 A163 L168 M169 | L161-N165 PolarHBondContact O-N 3.44Å; L162-N165 PolarHBondContact O-N 3.4Å; A163-N165 PolarHBondContact O-N 3.03Å; N165-L168 PolarHBondContact O-N 3.43Å; N165-M169 WeakPolarHBondContact O-CB 3.48Å; N165-M169 PolarHBondContact O-N 3.49Å |
| 166 | Y | 97.4 | Very high | 97.1 | Very high | 65 Ų | 65 | 77.3 Ų | 77.3 | 26% | 0.255 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.8 | -41.8 | 176.9 | -179.5 | -134.8 | 0 | 0 | 0 | 112.4 | V142 P144 L162 A163 K164 L168 M169 Q170 | V142-Y166 WeakPolarHBondContact O-CE1 3.44Å; P144-Y166 HydrophobicContact CG-CD1 4.37Å; P144-Y166 HydrophobicContact CG-CD2 3.48Å; P144-Y166 VanDerWaalsContact CG-CD2 3.48Å; P144-Y166 HydrophobicContact CG-CE1 4.12Å; P144-Y166 HydrophobicContact CG-CE2 3.21Å; P144-Y166 HydrophobicContact CG-CG 4.07Å; L162-Y166 WeakPolarHBondContact O-CB 3.5Å; L162-Y166 PolarHBondContact O-N 3.28Å; A163-Y166 PolarHBondContact O-N 3.22Å; K164-Y166 VanDerWaalsContact C-N 3.27Å; K164-Y166 PolarHBondContact O-N 3.37Å; Y166-L168 PolarHBondContact O-N 3.41Å; Y166-M169 HydrophobicContact CD2-CE 3.75Å; Y166-M169 HydrophobicContact CE2-CE 3.75Å; Y166-M169 PolarHBondContact O-N 3.36Å; Y166-Q170 HydrophobicContact CD2-CG 4.03Å; Y166-Q170 HydrophobicContact CE2-CG 3.59Å; Y166-Q170 WeakPolarHBondContact O-CG 3.47Å; Y166-Q170 PolarHBondContact O-N 3.24Å; Y166-Q170 PolarHBondContact OH-OE1 3.34Å |
| 167 | I | 98.1 | Very high | 97.2 | Very high | 96 Ų | 96 | 77.6 Ų | 77.6 | 49% | 0.492 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -59.9 | -46.6 | 174.2 | -66.8 | 166.1 | 0 | 0 | 0 | 110.6 | A163 K164 M169 Q170 A171 | A163-I167 WeakPolarHBondContact O-CG1 3.47Å; A163-I167 PolarHBondContact O-N 3.35Å; K164-I167 PolarHBondContact O-N 3.38Å; I167-M169 PolarHBondContact O-N 3.22Å; I167-Q170 PolarHBondContact O-N 3.44Å; I167-A171 PolarHBondContact O-N 2.86Å |
| 168 | L | 98.1 | Very high | 97.2 | Very high | 60 Ų | 60 | 79.9 Ų | 79.9 | 31% | 0.314 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -60.1 | -46.9 | 179.2 | -74 | 172.5 | 0 | 0 | 0 | 112.3 | Y28 K164 N165 Y166 Q170 A171 Q172 | Y28-L168 HydrophobicContact CE1-CD2 3.83Å; Y28-L168 WeakPolarHBondContact OH-CD2 3.41Å; K164-L168 HydrophobicContact CG-CD1 4.43Å; K164-L168 PolarHBondContact O-N 3.48Å; K164-L168 VanDerWaalsContact O-N 3.13Å; N165-L168 PolarHBondContact O-N 3.43Å; Y166-L168 PolarHBondContact O-N 3.41Å; L168-Q170 VanDerWaalsContact C-N 3.34Å; L168-Q170 PolarHBondContact O-N 3.27Å; L168-A171 PolarHBondContact O-N 3.48Å; L168-Q172 WeakPolarHBondContact O-CG 3.38Å; L168-Q172 PolarHBondContact O-N 3.27Å |
| 169 | M | 97.9 | Very high | 97.3 | Very high | 97 Ų | 97 | 88.6 Ų | 88.6 | 48% | 0.478 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.5 | -39.2 | 179.4 | -179.7 | -127.9 | 56.9 | 0 | 0 | 111.6 | N165 Y166 I167 Q172 A173 | N165-M169 WeakPolarHBondContact O-CB 3.48Å; N165-M169 PolarHBondContact O-N 3.49Å; Y166-M169 HydrophobicContact CD2-CE 3.75Å; Y166-M169 HydrophobicContact CE2-CE 3.75Å; Y166-M169 PolarHBondContact O-N 3.36Å; I167-M169 PolarHBondContact O-N 3.22Å; M169-Q172 PolarHBondContact O-N 3.3Å; M169-A173 WeakPolarHBondContact O-CB 3.34Å; M169-A173 PolarHBondContact O-N 3.47Å |
| 170 | Q | 97.9 | Very high | 97.3 | Very high | 82 Ų | 82 | 93.8 Ų | 93.8 | 38% | 0.383 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65.3 | -39.8 | 175 | -74.8 | -171.3 | 96 | 0 | 0 | 112.2 | Y166 I167 L168 A173 L174 | Y166-Q170 HydrophobicContact CD2-CG 4.03Å; Y166-Q170 HydrophobicContact CE2-CG 3.59Å; Y166-Q170 WeakPolarHBondContact O-CG 3.47Å; Y166-Q170 PolarHBondContact O-N 3.24Å; Y166-Q170 PolarHBondContact OH-OE1 3.34Å; I167-Q170 PolarHBondContact O-N 3.44Å; L168-Q170 VanDerWaalsContact C-N 3.34Å; L168-Q170 PolarHBondContact O-N 3.27Å; Q170-A173 PolarHBondContact O-N 2.97Å; Q170-L174 VanDerWaalsContact O-CG 3.32Å; Q170-L174 WeakPolarHBondContact O-CG 3.43Å; Q170-L174 PolarHBondContact O-N 3.3Å |
| 171 | A | 98.1 | Very high | 97.2 | Very high | 45 Ų | 45 | 92.9 Ų | 92.9 | 37% | 0.372 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.1 | -47.2 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | I167 L168 A173 L174 D175 | I167-A171 PolarHBondContact O-N 2.86Å; L168-A171 PolarHBondContact O-N 3.48Å; A171-A173 PolarHBondContact O-N 3.49Å; A171-L174 PolarHBondContact O-N 2.95Å; A171-D175 PolarHBondContact O-N 3.2Å |
| 172 | Q | 97.9 | Very high | 97.1 | Very high | 126 Ų | 126 | 90.5 Ų | 90.5 | 59% | 0.589 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -59.1 | -46.2 | 176 | -71.3 | 179.3 | -34.8 | 0 | 0 | 112.1 | L168 M169 L174 D175 E176 | L168-Q172 WeakPolarHBondContact O-CG 3.38Å; L168-Q172 PolarHBondContact O-N 3.27Å; M169-Q172 PolarHBondContact O-N 3.3Å; Q172-L174 VanDerWaalsContact C-N 3.31Å; Q172-L174 PolarHBondContact O-N 2.85Å; Q172-D175 PolarHBondContact O-N 2.96Å; Q172-E176 WeakPolarHBondContact O-CG 3.48Å; Q172-E176 PolarHBondContact O-N 3.01Å |
| 173 | A | 97.8 | Very high | 97 | Very high | 34 Ų | 34 | 94.5 Ų | 94.5 | 28% | 0.281 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.8 | -39.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | M169 Q170 A171 M177 | M169-A173 WeakPolarHBondContact O-CB 3.34Å; M169-A173 PolarHBondContact O-N 3.47Å; Q170-A173 PolarHBondContact O-N 2.97Å; A171-A173 PolarHBondContact O-N 3.49Å; A173-M177 HydrophobicContact CB-CE 4.14Å; A173-M177 WeakPolarHBondContact O-CB 3.36Å; A173-M177 VanDerWaalsContact O-CE 3.25Å; A173-M177 WeakPolarHBondContact O-CE 3.38Å; A173-M177 WeakPolarHBondContact O-CG 3.32Å; A173-M177 PolarHBondContact O-N 3.38Å |
| 174 | L | 98.3 | Very high | 96.8 | Very high | 89 Ų | 89 | 99.3 Ų | 99.3 | 47% | 0.466 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.7 | -39.6 | 175.8 | -72.4 | 173.5 | 0 | 0 | 0 | 112.3 | Q170 A171 Q172 M177 R178 | Q170-L174 VanDerWaalsContact O-CG 3.32Å; Q170-L174 WeakPolarHBondContact O-CG 3.43Å; Q170-L174 PolarHBondContact O-N 3.3Å; A171-L174 PolarHBondContact O-N 2.95Å; Q172-L174 VanDerWaalsContact C-N 3.31Å; Q172-L174 PolarHBondContact O-N 2.85Å; L174-M177 HydrophobicContact CD2-CE 4.11Å; L174-M177 PolarHBondContact O-N 3.39Å; L174-R178 VanDerWaalsContact O-CG 3.24Å; L174-R178 WeakPolarHBondContact O-CG 3.37Å; L174-R178 PolarHBondContact O-N 2.94Å |
| 175 | D | 97.4 | Very high | 96.5 | Very high | 88 Ų | 88 | 100 Ų | 100 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69.7 | -38.6 | 178.3 | -69.6 | -26.2 | 0 | 0 | 0 | 112.2 | A171 Q172 R178 R179 | A171-D175 PolarHBondContact O-N 3.2Å; Q172-D175 PolarHBondContact O-N 2.96Å; D175-R178 PolarHBondContact O-N 3.49Å; D175-R178 IonicContact OD1-NH1 3.83Å; D175-R178 PolarHBondContact OD1-NH1 3.48Å; D175-R179 WeakPolarHBondContact O-CB 3.41Å; D175-R179 PolarHBondContact O-N 2.92Å |
| 176 | E | 97.6 | Very high | 95.8 | Very high | 131 Ų | 131 | 103 Ų | 103 | 61% | 0.612 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.3 | -47.1 | 171.4 | -73.6 | 178.6 | -175.2 | 0 | 0 | 111.6 | Q172 R178 R179 L180 | Q172-E176 WeakPolarHBondContact O-CG 3.48Å; Q172-E176 PolarHBondContact O-N 3.01Å; E176-R178 VanDerWaalsContact C-N 3.33Å; E176-R178 PolarHBondContact O-N 2.86Å; E176-R179 WeakPolarHBondContact O-CB 3.3Å; E176-R179 PolarHBondContact O-N 3.31Å; E176-L180 WeakPolarHBondContact O-CG 3.48Å; E176-L180 PolarHBondContact O-N 3.46Å |
| 177 | M | 97.7 | Very high | 94 | Very high | 105 Ų | 105 | 101.9 Ų | 101.9 | 52% | 0.517 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -59.5 | -43.2 | 176.1 | -77.8 | -175.4 | -93.3 | 0 | 0 | 111.9 | A173 L174 R179 L180 V181 | A173-M177 HydrophobicContact CB-CE 4.14Å; A173-M177 WeakPolarHBondContact O-CB 3.36Å; A173-M177 VanDerWaalsContact O-CE 3.25Å; A173-M177 WeakPolarHBondContact O-CE 3.38Å; A173-M177 WeakPolarHBondContact O-CG 3.32Å; A173-M177 PolarHBondContact O-N 3.38Å; L174-M177 HydrophobicContact CD2-CE 4.11Å; L174-M177 PolarHBondContact O-N 3.39Å; M177-R179 VanDerWaalsContact C-N 3.35Å; M177-R179 PolarHBondContact O-N 2.94Å; M177-L180 PolarHBondContact O-N 3.07Å; M177-V181 VanDerWaalsContact O-CG2 3.31Å; M177-V181 WeakPolarHBondContact O-CG2 3.38Å; M177-V181 PolarHBondContact O-N 3.31Å |
| 178 | R | 96.3 | Very high | 92 | Very high | 160 Ų | 160 | 106 Ų | 106 | 60% | 0.604 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61 | -42.5 | 175.2 | -73.9 | 165.6 | 177.3 | 163.8 | -3.4 | 112 | L174 D175 E176 V181 A182 | L174-R178 VanDerWaalsContact O-CG 3.24Å; L174-R178 WeakPolarHBondContact O-CG 3.37Å; L174-R178 PolarHBondContact O-N 2.94Å; D175-R178 PolarHBondContact O-N 3.49Å; D175-R178 IonicContact OD1-NH1 3.83Å; D175-R178 PolarHBondContact OD1-NH1 3.48Å; E176-R178 VanDerWaalsContact C-N 3.33Å; E176-R178 PolarHBondContact O-N 2.86Å; R178-V181 PolarHBondContact O-N 3Å; R178-A182 WeakPolarHBondContact O-CB 3.45Å; R178-A182 PolarHBondContact O-N 3.38Å |
| 179 | R | 96.2 | Very high | 89.9 | Confident | 204 Ų | 204 | 106.3 Ų | 106.3 | 77% | 0.77 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.9 | -43.4 | 176.4 | -179.4 | -178.7 | 167.9 | 153.4 | -1 | 111.7 | D175 E176 M177 A182 F183 | D175-R179 WeakPolarHBondContact O-CB 3.41Å; D175-R179 PolarHBondContact O-N 2.92Å; E176-R179 WeakPolarHBondContact O-CB 3.3Å; E176-R179 PolarHBondContact O-N 3.31Å; M177-R179 VanDerWaalsContact C-N 3.35Å; M177-R179 PolarHBondContact O-N 2.94Å; R179-A182 PolarHBondContact O-N 3Å; R179-F183 PolarHBondContact O-N 2.98Å |
| 180 | L | 95.9 | Very high | 87.7 | Confident | 110 Ų | 110 | 109.7 Ų | 109.7 | 58% | 0.576 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.6 | -43.3 | 177.3 | -69.7 | 174.4 | 0 | 0 | 0 | 111.8 | E176 M177 A182 F183 L184 | E176-L180 WeakPolarHBondContact O-CG 3.48Å; E176-L180 PolarHBondContact O-N 3.46Å; M177-L180 PolarHBondContact O-N 3.07Å; L180-A182 VanDerWaalsContact C-N 3.34Å; L180-A182 PolarHBondContact O-N 3.47Å; L180-F183 WeakPolarHBondContact O-CB 3.25Å; L180-F183 PolarHBondContact O-N 3.44Å; L180-L184 WeakPolarHBondContact O-CG 3.37Å; L180-L184 PolarHBondContact O-N 3.47Å |
| 181 | V | 95.4 | Very high | 85.4 | Confident | 77 Ų | 77 | 110 Ų | 110 | 47% | 0.467 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -62 | -43 | 174.7 | 169.8 | 0 | 0 | 0 | 0 | 111 | M177 R178 F183 L184 N185 | M177-V181 VanDerWaalsContact O-CG2 3.31Å; M177-V181 WeakPolarHBondContact O-CG2 3.38Å; M177-V181 PolarHBondContact O-N 3.31Å; R178-V181 PolarHBondContact O-N 3Å; V181-F183 VanDerWaalsContact C-N 3.31Å; V181-F183 PolarHBondContact O-N 3.35Å; V181-L184 PolarHBondContact O-N 3.43Å; V181-N185 VanDerWaalsContact CG1-ND2 3.33Å; V181-N185 WeakPolarHBondContact CG1-ND2 3.33Å; V181-N185 WeakPolarHBondContact O-CB 3.46Å; V181-N185 PolarHBondContact O-N 3.46Å; V181-N185 PolarHBondContact O-ND2 2.8Å |
| 182 | A | 93.9 | Very high | 82.9 | Confident | 40 Ų | 40 | 111.4 Ų | 111.4 | 33% | 0.331 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -62.2 | -38.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | R178 R179 L180 Q186 | R178-A182 WeakPolarHBondContact O-CB 3.45Å; R178-A182 PolarHBondContact O-N 3.38Å; R179-A182 PolarHBondContact O-N 3Å; L180-A182 VanDerWaalsContact C-N 3.34Å; L180-A182 PolarHBondContact O-N 3.47Å; A182-Q186 WeakPolarHBondContact O-CB 3.25Å; A182-Q186 VanDerWaalsContact O-CG 3.27Å; A182-Q186 WeakPolarHBondContact O-CG 3.4Å; A182-Q186 PolarHBondContact O-N 2.93Å; A182-Q186 PolarHBondContact O-NE2 3.25Å |
| 183 | F | 93.6 | Very high | 80.7 | Confident | 153 Ų | 153 | 110.3 Ų | 110.3 | 67% | 0.671 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -64.5 | -44.3 | 175.7 | -178.5 | -98.6 | 0 | 0 | 0 | 111.9 | R179 L180 V181 Q186 | R179-F183 PolarHBondContact O-N 2.98Å; L180-F183 WeakPolarHBondContact O-CB 3.25Å; L180-F183 PolarHBondContact O-N 3.44Å; V181-F183 VanDerWaalsContact C-N 3.31Å; V181-F183 PolarHBondContact O-N 3.35Å; F183-Q186 PolarHBondContact O-N 3.38Å |
| 184 | L | 93.4 | Very high | 78.7 | Confident | 112 Ų | 112 | 115.4 Ų | 115.4 | 59% | 0.586 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -64.6 | -42.2 | 176.3 | -69 | 171.4 | 0 | 0 | 0 | 112.1 | L180 V181 Q186 G187 | L180-L184 WeakPolarHBondContact O-CG 3.37Å; L180-L184 PolarHBondContact O-N 3.47Å; V181-L184 PolarHBondContact O-N 3.43Å; L184-Q186 VanDerWaalsContact C-N 3.28Å; L184-Q186 PolarHBondContact O-N 2.87Å; L184-G187 PolarHBondContact O-N 3.44Å |
| 185 | N | 89.7 | Confident | 76.6 | Confident | 130 Ų | 130 | 118.1 Ų | 118.1 | 70% | 0.695 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -70.2 | -23.2 | 179.8 | -71.2 | -24.5 | 0 | 0 | 0 | 113.4 | V181 G187 | V181-N185 VanDerWaalsContact CG1-ND2 3.33Å; V181-N185 WeakPolarHBondContact CG1-ND2 3.33Å; V181-N185 WeakPolarHBondContact O-CB 3.46Å; V181-N185 PolarHBondContact O-N 3.46Å; V181-N185 PolarHBondContact O-ND2 2.8Å; N185-G187 PolarHBondContact O-N 3.05Å |
| 186 | Q | 82.3 | Confident | 74.5 | Confident | 159 Ų | 159 | 118.4 Ų | 118.4 | 74% | 0.743 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.8 | -1.4 | 173.9 | -79.6 | 168.2 | 78.3 | 0 | 0 | 113.4 | A182 F183 L184 | A182-Q186 WeakPolarHBondContact O-CB 3.25Å; A182-Q186 VanDerWaalsContact O-CG 3.27Å; A182-Q186 WeakPolarHBondContact O-CG 3.4Å; A182-Q186 PolarHBondContact O-N 2.93Å; A182-Q186 PolarHBondContact O-NE2 3.25Å; F183-Q186 PolarHBondContact O-N 3.38Å; L184-Q186 VanDerWaalsContact C-N 3.28Å; L184-Q186 PolarHBondContact O-N 2.87Å |
| 187 | G | 60.9 | Low | 72.6 | Confident | 42 Ų | 42 | 115.8 Ų | 115.8 | 43% | 0.433 | 66% | 0.66 | S | S | . | * | trans | 82.1 | 129.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L184 N185 G189 | L184-G187 PolarHBondContact O-N 3.44Å; N185-G187 PolarHBondContact O-N 3.05Å; G187-G189 PolarHBondContact O-N 2.99Å | ||
| 188 | Q | 56.3 | Low | 70.5 | Confident | 183 Ų | 183 | 116.5 Ų | 116.5 | 86% | 0.855 | 67% | 0.672 | S | S | * | * | 34.5 | 27.1 | 60.1 | -68.6 | -168 | -9.9 | 0 | 0 | 115 | L190 | Q188-L190 PolarHBondContact O-N 3.41Å; Q188-L190 VanDerWaalsContact O-N 3.13Å | |||
| 189 | G | 53.3 | Low | 68.3 | Low | 65 Ų | 65 | 116.9 Ų | 116.9 | 67% | 0.67 | 69% | 0.685 | S | S | * | * | trans | -73.6 | 25.5 | 159.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | G187 A191 | G187-G189 PolarHBondContact O-N 2.99Å; G189-A191 PolarHBondContact O-N 3.39Å | ||
| 190 | L | 52.3 | Low | 66.5 | Low | 169 Ų | 169 | 113.5 Ų | 113.5 | 89% | 0.885 | 69% | 0.688 | S | S | * | * | trans | -78.5 | 38.4 | 165 | -62.5 | 179.6 | 0 | 0 | 0 | 110.8 | Q188 | Q188-L190 PolarHBondContact O-N 3.41Å; Q188-L190 VanDerWaalsContact O-N 3.13Å | ||
| 191 | A | 48.5 | Very low | 64.5 | Low | 87 Ų | 87 | 113.8 Ų | 113.8 | 72% | 0.719 | 70% | 0.696 | S | S | * | * | trans | -93.9 | 52 | 149.6 | 0 | 0 | 0 | 0 | 0 | 107.4 | G189 P193 | G189-A191 PolarHBondContact O-N 3.39Å; A191-P193 VanDerWaalsContact O-CD 3.32Å; A191-P193 WeakPolarHBondContact O-CD 3.2Å | ||
| 192 | A | 47.1 | Very low | 62 | Low | 75 Ų | 75 | 120.7 Ų | 120.7 | 62% | 0.62 | 72% | 0.72 | S | S | * | * | trans | -65.7 | 118.3 | 149.5 | 0 | 0 | 0 | 0 | 0 | 104.2 | V194 | A192-V194 PolarHBondContact O-N 3.15Š| ||
| 193 | P | 51.9 | Low | 59.9 | Low | 104 Ų | 104 | 121.9 Ų | 121.9 | 68% | 0.675 | 74% | 0.736 | S | S | * | * | trans | -56.9 | 113.3 | 165.9 | 25.4 | -30.2 | 0 | 0 | 0 | 104.7 | A191 N195 | A191-P193 VanDerWaalsContact O-CD 3.32Å; A191-P193 WeakPolarHBondContact O-CD 3.2Å; P193-N195 PolarHBondContact O-N 2.76Å | ||
| 194 | V | 54.9 | Low | 57.6 | Low | 140 Ų | 140 | 123.6 Ų | 123.6 | 85% | 0.848 | 75% | 0.746 | S | S | * | * | trans | -53.2 | 95.6 | 151.1 | -96.7 | 0 | 0 | 0 | 0 | 103.7 | A192 A196 | A192-V194 PolarHBondContact O-N 3.15Å; V194-A196 PolarHBondContact O-N 3.21Å | ||
| 195 | N | 53.5 | Low | 55.5 | Low | 147 Ų | 147 | 123 Ų | 123 | 79% | 0.786 | 76% | 0.758 | S | S | * | * | trans | -56 | 99.8 | 159.9 | -93 | 11.6 | 0 | 0 | 0 | 103.2 | P193 A197 | P193-N195 PolarHBondContact O-N 2.76Å; N195-A197 PolarHBondContact O-N 2.88Å | ||
| 196 | A | 53.4 | Low | 53.3 | Low | 93 Ų | 93 | 122.7 Ų | 122.7 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | trans | -59.6 | 94 | 169.3 | 0 | 0 | 0 | 0 | 0 | 105.2 | V194 | V194-A196 PolarHBondContact O-N 3.21Š| ||
| 197 | A | 59.2 | Low | 51.5 | Low | 77 Ų | 77 | 121.1 Ų | 121.1 | 64% | 0.636 | 76% | 0.762 | S | S | * | * | trans | -57.3 | 124.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 106.1 | N195 L199 | N195-A197 PolarHBondContact O-N 2.88Å; A197-L199 PolarHBondContact O-N 3.48Å | ||
| 198 | P | 51.8 | Low | 50.8 | Low | 119 Ų | 119 | 125 Ų | 125 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | trans | -60.9 | 126.1 | -177.7 | 22.1 | -29.8 | 0 | 0 | 0 | 108.8 | T200 | P198-T200 PolarHBondContact O-N 3.27Å; P198-T200 VanDerWaalsContact O-N 3.09Å | ||
| 199 | L | 50.4 | Low | 50.7 | Low | 169 Ų | 169 | 122.3 Ų | 122.3 | 89% | 0.885 | 78% | 0.779 | S | S | * | * | trans | -64.2 | 107.7 | 174.8 | -48.9 | -179.6 | 0 | 0 | 0 | 107.6 | A197 | A197-L199 PolarHBondContact O-N 3.48Š| ||
| 200 | T | 59.8 | Low | 49.9 | Very low | 133 Ų | 133 | 128.5 Ų | 128.5 | 82% | 0.816 | 79% | 0.788 | S | S | * | * | trans | -73.2 | 127.2 | 165.1 | 43.1 | 0 | 0 | 0 | 0 | 108.2 | P198 | P198-T200 PolarHBondContact O-N 3.27Å; P198-T200 VanDerWaalsContact O-N 3.09Å | ||
| 201 | P | 52.8 | Low | 49.7 | Very low | 115 Ų | 115 | 125.1 Ų | 125.1 | 75% | 0.747 | 78% | 0.778 | S | S | * | * | trans | -81 | 143.2 | 173.9 | 32.4 | -29.5 | 0 | 0 | 0 | 109.2 | ||||
| 202 | F | 43.2 | Very low | 49.2 | Very low | 222 Ų | 222 | 126 Ų | 126 | 97% | 0.974 | 79% | 0.785 | S | S | * | * | trans | 74.2 | 111.7 | 153.2 | -120.2 | -100.7 | 0 | 0 | 0 | 117.5 | ||||
| 203 | G | 50 | Low | 48.8 | Very low | 65 Ų | 65 | 126.3 Ų | 126.3 | 67% | 0.67 | 80% | 0.796 | S | S | * | * | trans | 152.4 | 82.7 | 153.4 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 204 | Q | 45.5 | Very low | 48.2 | Very low | 189 Ų | 189 | 126.1 Ų | 126.1 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | trans | 72.3 | 115.7 | 144.4 | -56.4 | -176.4 | 33.7 | 0 | 0 | 119.1 | ||||
| 205 | A | 48.8 | Very low | 47.5 | Very low | 101 Ų | 101 | 124.2 Ų | 124.2 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | -65.3 | 135.4 | 156.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 206 | T | 44.4 | Very low | 46.8 | Very low | 122 Ų | 122 | 126 Ų | 126 | 75% | 0.748 | 81% | 0.811 | S | S | * | * | trans | -150.8 | 102.8 | 152.1 | 8.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 207 | V | 43 | Very low | 46 | Very low | 127 Ų | 127 | 125 Ų | 125 | 77% | 0.77 | 81% | 0.809 | S | S | * | * | 59.3 | 105.5 | 111.2 | -172.9 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 208 | C | 46.7 | Very low | 45.4 | Very low | 124 Ų | 124 | 127.6 Ų | 127.6 | 84% | 0.838 | 82% | 0.82 | S | S | * | * | trans | -54.2 | 144.2 | 159.6 | -52.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 209 | P | 55.2 | Low | 44.6 | Very low | 125 Ų | 125 | 127.7 Ų | 127.7 | 81% | 0.812 | 82% | 0.822 | S | S | * | * | trans | -119 | 139.3 | 146 | 27 | -11.8 | 0 | 0 | 0 | 112.5 | ||||
| 210 | F | 36.7 | Very low | 44.6 | Very low | 195 Ų | 195 | 125.3 Ų | 125.3 | 86% | 0.855 | 82% | 0.817 | S | S | * | * | trans | -53.1 | 135.6 | 168.8 | 172.6 | -95.5 | 0 | 0 | 0 | 114 | ||||
| 211 | S | 47.3 | Very low | 43.7 | Very low | 98 Ų | 98 | 126.6 Ų | 126.6 | 69% | 0.685 | 82% | 0.818 | S | S | * | * | trans | 20.2 | 124.7 | 151.7 | -59 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 212 | A | 38.2 | Very low | 43.1 | Very low | 105 Ų | 105 | 130.8 Ų | 130.8 | 87% | 0.868 | 83% | 0.825 | S | S | * | * | trans | -154.6 | 137.9 | 136.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 213 | G | 37.6 | Very low | 42.7 | Very low | 82 Ų | 82 | 125.9 Ų | 125.9 | 85% | 0.845 | 82% | 0.817 | S | S | * | * | trans | -84 | 168.9 | -154.7 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 214 | A | 39.3 | Very low | 42.4 | Very low | 101 Ų | 101 | 127.9 Ų | 127.9 | 84% | 0.835 | 83% | 0.827 | S | S | * | * | trans | -156.7 | 117 | 152.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 215 | A | 40.2 | Very low | 42.1 | Very low | 99 Ų | 99 | 122.9 Ų | 122.9 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | trans | 60 | 97.7 | 142.3 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 216 | L | 39.3 | Very low | 41.5 | Very low | 185 Ų | 185 | 127.7 Ų | 127.7 | 97% | 0.969 | 82% | 0.82 | S | S | * | * | -2.3 | 129.4 | 129.6 | -59.7 | 168.3 | 0 | 0 | 0 | 117.7 | |||||
| 217 | G | 36.3 | Very low | 41.2 | Very low | 71 Ų | 71 | 127.2 Ų | 127.2 | 73% | 0.732 | 82% | 0.822 | S | S | * | * | trans | -162.8 | 121 | 161.1 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 218 | P | 46.9 | Very low | 40.8 | Very low | 132 Ų | 132 | 125 Ų | 125 | 86% | 0.857 | 83% | 0.825 | S | S | * | * | trans | -99.4 | 155.1 | -162.5 | 11.5 | 9.2 | 0 | 0 | 0 | 114.6 | ||||
| 219 | C | 36.2 | Very low | 40.9 | Very low | 122 Ų | 122 | 125.4 Ų | 125.4 | 82% | 0.824 | 82% | 0.824 | S | S | * | * | trans | -113.5 | 165.4 | 158.4 | -50.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 220 | P | 50.3 | Low | 40.7 | Very low | 119 Ų | 119 | 124.6 Ų | 124.6 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | cis | -125 | 145.8 | -49 | 34.6 | -20.2 | 0 | 0 | 0 | 110.9 | ||||
| 221 | D | 39.1 | Very low | 40.8 | Very low | 159 Ų | 159 | 121.1 Ų | 121.1 | 85% | 0.85 | 82% | 0.818 | S | S | * | * | trans | -144.5 | 111.7 | 168.5 | -109.9 | -53.2 | 0 | 0 | 0 | 110.2 | ||||
| 222 | K | 40.5 | Very low | 40.6 | Very low | 204 Ų | 204 | 120.9 Ų | 120.9 | 89% | 0.887 | 82% | 0.822 | S | S | * | * | trans | -172.5 | 114.4 | 132.4 | -115.4 | 178.4 | 174.3 | -170.5 | 0 | 112.8 | ||||
| 223 | C | 35.2 | Very low | 41.2 | Very low | 119 Ų | 119 | 122.5 Ų | 122.5 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -47.9 | 135.7 | 154.2 | -56.7 | 0 | 0 | 0 | 0 | 112.2 | ||
| 224 | A | 43 | Very low | 41.2 | Very low | 106 Ų | 106 | 125.2 Ų | 125.2 | 88% | 0.876 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -99.8 | 125.4 | 152.1 | 0 | 0 | 0 | 0 | 0 | 108 | ||
| 225 | A | 40.3 | Very low | 41.7 | Very low | 84 Ų | 84 | 128.7 Ų | 128.7 | 69% | 0.694 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -94.5 | 172.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 226 | F | 35.4 | Very low | 41.7 | Very low | 202 Ų | 202 | 132.2 Ų | 132.2 | 89% | 0.886 | 82% | 0.816 | S | S | * | * | trans | 91.6 | 127.6 | 175.5 | -81.7 | -102.5 | 0 | 0 | 0 | 115.7 | ||||
| 227 | S | 39.7 | Very low | 41.6 | Very low | 112 Ų | 112 | 129.2 Ų | 129.2 | 78% | 0.783 | 81% | 0.809 | S | S | * | * | cis | -172.1 | 145.9 | 5.1 | 23.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 228 | G | 34.5 | Very low | 41.8 | Very low | 80 Ų | 80 | 133.2 Ų | 133.2 | 83% | 0.825 | 81% | 0.808 | S | S | * | * | trans | 147.1 | 89.7 | 165.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 229 | T | 48 | Very low | 41.5 | Very low | 133 Ų | 133 | 133.1 Ų | 133.1 | 82% | 0.816 | 80% | 0.796 | S | S | * | * | trans | -52.2 | 176.6 | 173.4 | 44.6 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 230 | P | 49.8 | Very low | 41.6 | Very low | 109 Ų | 109 | 134.7 Ų | 134.7 | 71% | 0.708 | 79% | 0.789 | S | S | * | * | cis | -138.3 | 168.4 | -45.3 | 39 | -21.7 | 0 | 0 | 0 | 114.5 | ||||
| 231 | S | 39.3 | Very low | 41.9 | Very low | 121 Ų | 121 | 137.8 Ų | 137.8 | 85% | 0.846 | 81% | 0.809 | S | S | * | * | trans | 49.9 | 118.8 | 145.8 | -76.2 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 232 | A | 44.1 | Very low | 42.1 | Very low | 93 Ų | 93 | 136.7 Ų | 136.7 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | -171.3 | 102.9 | 108.6 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 233 | L | 50.2 | Low | 42.1 | Very low | 139 Ų | 139 | 133.2 Ų | 133.2 | 73% | 0.728 | 80% | 0.803 | S | S | * | * | 61 | 69.7 | 125.3 | -131 | 84.4 | 0 | 0 | 0 | 120.1 | K235 | L233-K235 HydrophobicContact CD2-CD 3.96Å; L233-K235 HydrophobicContact CD2-CG 4.23Å; L233-K235 HydrophobicContact CG-CD 4.49Å; L233-K235 HydrophobicContact CG-CG 4.22Å; L233-K235 PolarHBondContact O-N 3.49Å | |||
| 234 | C | 37.8 | Very low | 42.5 | Very low | 140 Ų | 140 | 133.9 Ų | 133.9 | 95% | 0.946 | 80% | 0.803 | S | S | * | * | trans | -80 | 94.5 | 153.1 | -69.6 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 235 | K | 50.2 | Low | 42.5 | Very low | 174 Ų | 174 | 135.6 Ų | 135.6 | 76% | 0.757 | 80% | 0.798 | S | S | * | * | trans | -79.6 | 113.1 | 168.3 | -84 | 174.6 | 172.5 | 176 | 0 | 110.2 | L233 | L233-K235 HydrophobicContact CD2-CD 3.96Å; L233-K235 HydrophobicContact CD2-CG 4.23Å; L233-K235 HydrophobicContact CG-CD 4.49Å; L233-K235 HydrophobicContact CG-CG 4.22Å; L233-K235 PolarHBondContact O-N 3.49Å | ||
| 236 | H | 39.7 | Very low | 42.6 | Very low | 173 Ų | 173 | 138.8 Ų | 138.8 | 80% | 0.801 | 81% | 0.805 | S | S | * | * | 67 | 101.3 | 124.7 | -146.4 | 75.3 | 0 | 0 | 0 | 120 | |||||
| 237 | C | 37.3 | Very low | 43.1 | Very low | 122 Ų | 122 | 134.6 Ų | 134.6 | 82% | 0.824 | 80% | 0.799 | S | S | * | * | trans | -145.5 | 134.6 | 144.5 | -71.9 | 0 | 0 | 0 | 0 | 103.2 | ||||
| 238 | H | 40.4 | Very low | 43.3 | Very low | 154 Ų | 154 | 136.2 Ų | 136.2 | 71% | 0.713 | 80% | 0.801 | S | S | * | * | cis | -166.9 | 147.5 | 30.5 | -145.4 | -87.9 | 0 | 0 | 0 | 107.3 | ||||
| 239 | E | 39.8 | Very low | 44 | Very low | 130 Ų | 130 | 140.5 Ų | 140.5 | 61% | 0.607 | 80% | 0.799 | S | S | * | * | trans | 22.1 | 159.1 | 143.9 | -85.2 | -147.2 | 119.5 | 0 | 0 | 122.8 | ||||
| 240 | K | 38 | Very low | 43.7 | Very low | 155 Ų | 155 | 141.2 Ų | 141.2 | 67% | 0.674 | 80% | 0.797 | S | S | * | * | cis | -172.7 | 164.9 | -8.4 | -147.6 | -160.7 | -159.2 | 115.3 | 0 | 103.4 | ||||
| 241 | P | 57.8 | Low | 43.1 | Very low | 184 Ų | 184 | 144.1 Ų | 144.1 | 100% | 1.195 | 81% | 0.805 | S | S | * | * | -132.2 | 0 | 90.9 | 34.3 | -24 | 0 | 0 | 0 | 114.2 |
Retrieved 241 of 241 residues in 283.8 ms
(Link to these results)