| 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 | 45.1 | Very low | 57.4 | Low | 241 Ų | 241 | 160.8 Ų | 160.8 | 100% | 1.187 | 85% | 0.845 | S | S | * | * | 0 | 117.9 | 0 | -62.9 | -158 | -176.8 | 0 | 0 | 109.4 | |||||
| 2 | P | 53.4 | Low | 58.8 | Low | 126 Ų | 126 | 157 Ų | 157 | 82% | 0.818 | 84% | 0.837 | S | S | * | * | trans | -107.1 | 111.4 | 173.9 | 33.4 | -20.8 | 0 | 0 | 0 | 110.4 | ||||
| 3 | R | 54.8 | Low | 59.2 | Low | 243 Ų | 243 | 154.5 Ų | 154.5 | 92% | 0.917 | 84% | 0.835 | S | S | * | * | trans | -145.1 | 136.8 | 162.2 | -77.5 | -167.7 | 138 | -167.6 | -4.9 | 108.8 | ||||
| 4 | R | 57.4 | Low | 59.2 | Low | 201 Ų | 201 | 161.1 Ų | 161.1 | 76% | 0.758 | 84% | 0.842 | S | S | * | * | trans | 105 | 133.3 | 169.2 | -71.1 | 174 | 128.7 | -159.9 | -0.9 | 113.9 | ||||
| 5 | R | 64.7 | Low | 59.8 | Low | 190 Ų | 190 | 165.9 Ų | 165.9 | 72% | 0.717 | 84% | 0.844 | S | S | * | * | cis | -150.1 | 139.6 | 17.6 | -103.6 | 143.3 | -165.1 | -77.4 | 17.2 | 109.7 | G7 | R5-G7 PolarHBondContact O-N 3.31Š| ||
| 6 | V | 56.7 | Low | 60.3 | Low | 140 Ų | 140 | 163.3 Ų | 163.3 | 85% | 0.848 | 84% | 0.842 | S | S | * | * | trans | -74.1 | 111.6 | 155.4 | 173.1 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 7 | G | 60.1 | Low | 60.7 | Low | 81 Ų | 81 | 159.3 Ų | 159.3 | 84% | 0.835 | 84% | 0.839 | S | S | * | * | trans | -97 | 98.1 | 170.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | R5 | R5-G7 PolarHBondContact O-N 3.31Š| ||
| 8 | R | 54.8 | Low | 61.1 | Low | 227 Ų | 227 | 155.9 Ų | 155.9 | 86% | 0.857 | 84% | 0.837 | S | S | * | * | trans | -113.8 | 110.1 | 166.8 | -173.9 | 166.3 | 104.2 | -145.5 | 7.7 | 107.5 | ||||
| 9 | S | 58.8 | Low | 61.5 | Low | 115 Ų | 115 | 160.2 Ų | 160.2 | 80% | 0.804 | 84% | 0.84 | S | S | * | * | trans | 171.4 | 134.4 | 170.3 | -79.6 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 10 | S | 60.2 | Low | 62 | Low | 109 Ų | 109 | 158.5 Ų | 158.5 | 76% | 0.762 | 84% | 0.839 | S | S | * | * | cis | -161.6 | 138.8 | 0.9 | -66.6 | 0 | 0 | 0 | 0 | 106 | ||||
| 11 | A | 65.9 | Low | 62.5 | Low | 96 Ų | 96 | 155.1 Ų | 155.1 | 79% | 0.793 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 135.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110 | ||
| 12 | P | 74.4 | Confident | 64.1 | Low | 115 Ų | 115 | 149.3 Ų | 149.3 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 152.9 | 178.1 | 28.3 | -33.5 | 0 | 0 | 0 | 111.9 | ||
| 13 | P | 64 | Low | 65.1 | Low | 124 Ų | 124 | 148.7 Ų | 148.7 | 81% | 0.805 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 140.8 | 176.5 | 27.3 | -33.5 | 0 | 0 | 0 | 111.2 | R15 | P13-R15 PolarHBondContact O-N 3.18Š|
| 14 | R | 59.2 | Low | 66.2 | Low | 247 Ų | 247 | 142.6 Ų | 142.6 | 93% | 0.932 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -64 | 121.7 | 175.7 | -72 | 176.8 | 174.1 | -125.4 | -0.1 | 110 | ||
| 15 | R | 67.9 | Low | 66.9 | Low | 234 Ų | 234 | 139.2 Ų | 139.2 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 135.4 | 162.3 | -81.1 | 177 | 160.1 | -123.6 | -1.2 | 109 | P13 A17 | P13-R15 PolarHBondContact O-N 3.18Å; R15-A17 PolarHBondContact O-N 2.72Å |
| 16 | P | 67 | Low | 67.2 | Low | 124 Ų | 124 | 134.4 Ų | 134.4 | 81% | 0.805 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -64.2 | 125.4 | 167.5 | 25.7 | -30.1 | 0 | 0 | 0 | 108.7 | ||
| 17 | A | 68.3 | Low | 67.7 | Low | 95 Ų | 95 | 133.8 Ų | 133.8 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 131.6 | 166.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | R15 R19 | R15-A17 PolarHBondContact O-N 2.72Å; A17-R19 PolarHBondContact O-N 3.47Å |
| 18 | A | 66.6 | Low | 67.4 | Low | 98 Ų | 98 | 139.2 Ų | 139.2 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 132.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 19 | R | 69.5 | Low | 67.7 | Low | 238 Ų | 238 | 137.3 Ų | 137.3 | 90% | 0.898 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 133.9 | 169 | -72.3 | 175.7 | 174.1 | -119.2 | 0.5 | 108.2 | A17 A21 | A17-R19 PolarHBondContact O-N 3.47Å; R19-A21 PolarHBondContact O-N 3.18Å |
| 20 | P | 70.9 | Confident | 67.4 | Low | 125 Ų | 125 | 136.5 Ų | 136.5 | 81% | 0.812 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 134.9 | 170.2 | -18.9 | 30.2 | 0 | 0 | 0 | 109.8 | ||
| 21 | A | 73.9 | Confident | 67 | Low | 88 Ų | 88 | 140.9 Ų | 140.9 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 143.8 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | R19 | R19-A21 PolarHBondContact O-N 3.18Š|
| 22 | P | 76.8 | Confident | 66.7 | Low | 119 Ų | 119 | 144.5 Ų | 144.5 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 139.4 | 173.2 | 26.9 | -32.5 | 0 | 0 | 0 | 109.8 | ||
| 23 | P | 75.2 | Confident | 65.9 | Low | 114 Ų | 114 | 142.1 Ų | 142.1 | 74% | 0.74 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -66 | 150.6 | 175.9 | 28.2 | -33.4 | 0 | 0 | 0 | 110.8 | ||
| 24 | P | 77.8 | Confident | 65.4 | Low | 114 Ų | 114 | 142.7 Ų | 142.7 | 74% | 0.74 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 150.6 | 175.3 | 28 | -34.1 | 0 | 0 | 0 | 111 | A26 | P24-A26 PolarHBondContact O-N 3.4Š|
| 25 | P | 72.4 | Confident | 65.1 | Low | 130 Ų | 130 | 133.1 Ų | 133.1 | 84% | 0.844 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 124.9 | 172 | 25.1 | -31.1 | 0 | 0 | 0 | 109.9 | ||
| 26 | A | 71.9 | Confident | 64.8 | Low | 89 Ų | 89 | 129.2 Ų | 129.2 | 74% | 0.736 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -75.2 | 145.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | P24 | P24-A26 PolarHBondContact O-N 3.4Š|
| 27 | P | 66.1 | Low | 64.5 | Low | 127 Ų | 127 | 130.9 Ų | 130.9 | 83% | 0.825 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 140.6 | -179.9 | 24.9 | -32.5 | 0 | 0 | 0 | 112.2 | Q29 | P27-Q29 PolarHBondContact O-N 2.93Š|
| 28 | Q | 54.4 | Low | 63.8 | Low | 196 Ų | 196 | 128.5 Ų | 128.5 | 92% | 0.916 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 119 | 176.6 | -61.9 | 167.5 | -93.2 | 0 | 0 | 109.7 | ||
| 29 | Q | 60.8 | Low | 63.2 | Low | 186 Ų | 186 | 130.7 Ų | 130.7 | 87% | 0.869 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 132.5 | 176.7 | -140.3 | 168.1 | -83.2 | 0 | 0 | 110 | P27 | P27-Q29 PolarHBondContact O-N 2.93Š|
| 30 | P | 52.6 | Low | 62.7 | Low | 98 Ų | 98 | 127.3 Ų | 127.3 | 64% | 0.636 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 146.6 | -173.1 | 24.8 | -32.5 | 0 | 0 | 0 | 113.2 | Q32 | P30-Q32 PolarHBondContact O-N 2.9Š|
| 31 | Q | 52.6 | Low | 62 | Low | 202 Ų | 202 | 124.7 Ų | 124.7 | 94% | 0.944 | 75% | 0.75 | S | S | * | * | trans | -54.3 | 106.5 | 167.4 | -72.1 | 174.1 | -20 | 0 | 0 | 109.9 | ||||
| 32 | Q | 57.7 | Low | 61 | Low | 171 Ų | 171 | 123.6 Ų | 123.6 | 80% | 0.799 | 74% | 0.741 | S | S | * | * | trans | -114.9 | 122.8 | 165.8 | -64.6 | -172.2 | -93.6 | 0 | 0 | 106.8 | P30 | P30-Q32 PolarHBondContact O-N 2.9Š| ||
| 33 | G | 57.9 | Low | 60.1 | Low | 66 Ų | 66 | 123.7 Ų | 123.7 | 68% | 0.68 | 74% | 0.739 | S | S | * | * | trans | -62.2 | 169.1 | -154.6 | 0 | 0 | 0 | 0 | 0 | 116 | G35 | G33-G35 VanDerWaalsContact C-N 3.27Å; G33-G35 PolarHBondContact O-N 2.8Å | ||
| 34 | P | 54.2 | Low | 59.1 | Low | 136 Ų | 136 | 122.8 Ų | 122.8 | 88% | 0.883 | 74% | 0.742 | S | S | * | * | trans | -62.2 | 91.8 | 173.5 | -14.4 | 28.9 | 0 | 0 | 0 | 108.9 | L36 | P34-L36 PolarHBondContact O-N 3.1Š| ||
| 35 | G | 52.8 | Low | 57.5 | Low | 46 Ų | 46 | 120.7 Ų | 120.7 | 47% | 0.474 | 74% | 0.741 | S | S | . | * | trans | -58.4 | 138.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | G33 L37 G38 | G33-G35 VanDerWaalsContact C-N 3.27Å; G33-G35 PolarHBondContact O-N 2.8Å; G35-L37 PolarHBondContact O-N 2.96Å; G35-G38 PolarHBondContact O-N 2.86Å | ||
| 36 | L | 61.1 | Low | 55.8 | Low | 152 Ų | 152 | 117.3 Ų | 117.3 | 80% | 0.796 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.3 | -13 | 175 | -94.9 | 80 | 0 | 0 | 0 | 114.1 | P34 | P34-L36 PolarHBondContact O-N 3.1Š|
| 37 | L | 60.7 | Low | 54.5 | Low | 158 Ų | 158 | 120.7 Ų | 120.7 | 83% | 0.827 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | -26.9 | 171.8 | -114.3 | 90.8 | 0 | 0 | 0 | 114.4 | G35 Q39 M40 | G35-L37 PolarHBondContact O-N 2.96Å; L37-Q39 PolarHBondContact O-N 2.98Å; L37-M40 PolarHBondContact O-N 2.92Å |
| 38 | G | 53.8 | Low | 54.3 | Low | 45 Ų | 45 | 118.5 Ų | 118.5 | 46% | 0.464 | 73% | 0.733 | S | S | . | * | H | α-helix | trans | -71.1 | -18.8 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | G35 M40 A42 | G35-G38 PolarHBondContact O-N 2.86Å; G38-M40 VanDerWaalsContact C-N 3.35Å; G38-A42 WeakPolarHBondContact O-CB 2.94Å; G38-A42 PolarHBondContact O-N 3.31Å |
| 39 | Q | 53.8 | Low | 54.2 | Low | 145 Ų | 145 | 117.9 Ų | 117.9 | 68% | 0.678 | 73% | 0.734 | S | S | * | * | H | α-helix | trans | -76.6 | -21.6 | 179 | -62.5 | -171.9 | 102.4 | 0 | 0 | 112.8 | L37 T43 | L37-Q39 PolarHBondContact O-N 2.98Å; Q39-T43 PolarHBondContact O-OG1 3.21Å |
| 40 | M | 59.2 | Low | 53.3 | Low | 166 Ų | 166 | 112 Ų | 112 | 82% | 0.818 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -87.5 | -32.8 | 170.1 | -78 | -154.5 | -151.9 | 0 | 0 | 112.6 | L37 G38 A42 T43 | L37-M40 PolarHBondContact O-N 2.92Å; G38-M40 VanDerWaalsContact C-N 3.35Å; M40-A42 VanDerWaalsContact C-N 3.31Å; M40-T43 PolarHBondContact O-N 2.71Å; M40-T43 PolarHBondContact O-OG1 2.83Å |
| 41 | A | 55.8 | Low | 52.7 | Low | 70 Ų | 70 | 114 Ų | 114 | 58% | 0.579 | 74% | 0.74 | S | S | * | * | H | α-helix | trans | -69.5 | -30 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | T43 A44 | A41-T43 PolarHBondContact O-N 3.03Å; A41-A44 PolarHBondContact O-N 2.62Å |
| 42 | A | 54 | Low | 52.8 | Low | 65 Ų | 65 | 108.9 Ų | 108.9 | 54% | 0.537 | 73% | 0.732 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.3 | -20.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | G38 M40 A44 | G38-A42 WeakPolarHBondContact O-CB 2.94Å; G38-A42 PolarHBondContact O-N 3.31Å; M40-A42 VanDerWaalsContact C-N 3.31Å; A42-A44 VanDerWaalsContact C-N 3.31Å |
| 43 | T | 57.6 | Low | 52.3 | Low | 121 Ų | 121 | 107.7 Ų | 107.7 | 74% | 0.742 | 74% | 0.736 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.3 | -10.5 | 178.6 | -33 | 0 | 0 | 0 | 0 | 112.9 | Q39 M40 A41 | Q39-T43 PolarHBondContact O-OG1 3.21Å; M40-T43 PolarHBondContact O-N 2.71Å; M40-T43 PolarHBondContact O-OG1 2.83Å; A41-T43 PolarHBondContact O-N 3.03Å |
| 44 | A | 54.9 | Low | 51.7 | Low | 95 Ų | 95 | 107.5 Ų | 107.5 | 79% | 0.785 | 73% | 0.734 | S | S | * | * | S | Bend | trans | -103.5 | -5 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | A41 A42 | A41-A44 PolarHBondContact O-N 2.62Å; A42-A44 VanDerWaalsContact C-N 3.31Å |
| 45 | G | 43.5 | Very low | 51.5 | Low | 70 Ų | 70 | 110.8 Ų | 110.8 | 72% | 0.722 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -141.1 | 53.7 | -175 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 46 | G | 37.5 | Very low | 51.4 | Low | 60 Ų | 60 | 112.6 Ų | 112.6 | 62% | 0.619 | 75% | 0.748 | S | S | * | * | trans | -147.3 | 56.1 | -171.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | A48 | G46-A48 PolarHBondContact O-N 2.95Š| ||
| 47 | V | 44 | Very low | 50.9 | Low | 160 Ų | 160 | 113.8 Ų | 113.8 | 97% | 0.97 | 76% | 0.755 | S | S | * | * | trans | -72.5 | 85.1 | 155.7 | -99.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 48 | A | 62 | Low | 50.1 | Low | 80 Ų | 80 | 109.1 Ų | 109.1 | 66% | 0.661 | 75% | 0.745 | S | S | * | * | trans | -141.3 | 92.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | G46 G50 | G46-A48 PolarHBondContact O-N 2.95Å; A48-G50 PolarHBondContact O-N 2.78Å | ||
| 49 | I | 52 | Low | 49.9 | Very low | 183 Ų | 183 | 114.8 Ų | 114.8 | 94% | 0.938 | 76% | 0.764 | S | S | * | * | trans | 24.9 | 96 | 131.1 | -50 | 176.5 | 0 | 0 | 0 | 113.7 | ||||
| 50 | G | 41.7 | Very low | 49.9 | Very low | 63 Ų | 63 | 112.5 Ų | 112.5 | 65% | 0.649 | 77% | 0.77 | S | S | * | * | trans | -175 | 40.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 116.4 | A48 A52 | A48-G50 PolarHBondContact O-N 2.78Å; G50-A52 PolarHBondContact O-N 2.75Å | ||
| 51 | S | 40 | Very low | 49.7 | Very low | 139 Ų | 139 | 113.1 Ų | 113.1 | 97% | 0.972 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | 39.1 | 179.2 | -57.7 | 0 | 0 | 0 | 0 | 115.6 | ||
| 52 | A | 55.3 | Low | 49.7 | Very low | 95 Ų | 95 | 117.8 Ų | 117.8 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.8 | -2.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 117.4 | G50 | G50-A52 PolarHBondContact O-N 2.75Š|
| 53 | V | 47.2 | Very low | 49.3 | Very low | 146 Ų | 146 | 118.3 Ų | 118.3 | 89% | 0.885 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -137.4 | 102.7 | 179.6 | -178.9 | 0 | 0 | 0 | 0 | 110 | ||
| 54 | G | 44.9 | Very low | 48.9 | Very low | 62 Ų | 62 | 118.9 Ų | 118.9 | 64% | 0.639 | 80% | 0.8 | S | S | * | * | trans | 172.8 | 0.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 118.2 | A56 | G54-A56 PolarHBondContact O-N 2.88Š| ||
| 55 | H | 49.8 | Very low | 48.6 | Very low | 205 Ų | 205 | 122.8 Ų | 122.8 | 95% | 0.949 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.8 | 24.2 | 168.4 | -79.6 | 90.1 | 0 | 0 | 0 | 113.5 | ||
| 56 | A | 51.6 | Low | 48.5 | Very low | 85 Ų | 85 | 122.8 Ų | 122.8 | 70% | 0.702 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.1 | 13.9 | -167.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | G54 | G54-A56 PolarHBondContact O-N 2.88Š|
| 57 | L | 49.6 | Very low | 48.8 | Very low | 177 Ų | 177 | 125.8 Ų | 125.8 | 93% | 0.927 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -128.4 | 17.4 | 172.3 | -64.6 | 174.5 | 0 | 0 | 0 | 113.6 | ||
| 58 | G | 43.6 | Very low | 48.9 | Very low | 60 Ų | 60 | 126.9 Ų | 126.9 | 62% | 0.619 | 81% | 0.805 | S | S | * | * | S | Bend | trans | -109.7 | 91.6 | 157 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||
| 59 | N | 49.8 | Very low | 47.7 | Very low | 164 Ų | 164 | 129.4 Ų | 129.4 | 88% | 0.877 | 81% | 0.811 | S | S | * | * | S | Bend | trans | 170.1 | 5 | 154.1 | -103.7 | 48.5 | 0 | 0 | 0 | 116.4 | ||
| 60 | A | 53.4 | Low | 47 | Very low | 97 Ų | 97 | 128.3 Ų | 128.3 | 80% | 0.802 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -118.9 | 3.9 | -172.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||
| 61 | L | 54.9 | Low | 46.8 | Very low | 178 Ų | 178 | 129.9 Ų | 129.9 | 93% | 0.932 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -123.1 | 4.4 | 178.5 | -63.2 | 171.1 | 0 | 0 | 0 | 113.8 | ||
| 62 | I | 56.9 | Low | 46.8 | Very low | 168 Ų | 168 | 131.4 Ų | 131.4 | 86% | 0.862 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -121.8 | 87.7 | 178.7 | -53.2 | 166.2 | 0 | 0 | 0 | 106.9 | ||
| 63 | G | 44.5 | Very low | 46.4 | Very low | 77 Ų | 77 | 133.2 Ų | 133.2 | 79% | 0.794 | 81% | 0.81 | S | S | * | * | S | Bend | trans | 123 | 77.2 | 170 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 64 | D | 49.8 | Very low | 46.1 | Very low | 133 Ų | 133 | 131.7 Ų | 131.7 | 71% | 0.711 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -170.3 | 132.8 | 131.4 | -161.2 | -115.5 | 0 | 0 | 0 | 108.9 | ||
| 65 | K | 48.3 | Very low | 46 | Very low | 177 Ų | 177 | 136.6 Ų | 136.6 | 77% | 0.77 | 81% | 0.807 | S | S | * | * | trans | 79.6 | 100.1 | 177.3 | -113.8 | 91.2 | 76.7 | -159.8 | 0 | 118.4 | ||||
| 66 | G | 41.9 | Very low | 45.6 | Very low | 70 Ų | 70 | 134.5 Ų | 134.5 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | trans | -71.9 | -159.1 | 149.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 67 | P | 43.8 | Very low | 45.1 | Very low | 123 Ų | 123 | 138.7 Ų | 138.7 | 80% | 0.799 | 80% | 0.802 | S | S | * | * | cis | -114.3 | 138.4 | -21.6 | 35.4 | -21.4 | 0 | 0 | 0 | 111.4 | ||||
| 68 | M | 44.9 | Very low | 44.9 | Very low | 183 Ų | 183 | 136.1 Ų | 136.1 | 90% | 0.901 | 79% | 0.794 | S | S | * | * | trans | -164.6 | 113.9 | 160.1 | -113.4 | 166.7 | -159.5 | 0 | 0 | 111.5 | ||||
| 69 | V | 37.4 | Very low | 44.9 | Very low | 132 Ų | 132 | 138.2 Ų | 138.2 | 80% | 0.8 | 80% | 0.797 | S | S | * | * | trans | 47.1 | 115.8 | 146.7 | -55.4 | 0 | 0 | 0 | 0 | 120 | ||||
| 70 | D | 36.9 | Very low | 44.5 | Very low | 160 Ų | 160 | 137.5 Ų | 137.5 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | 32 | 99.3 | 138.6 | -149.8 | -101.1 | 0 | 0 | 0 | 117.8 | ||||
| 71 | A | 39.1 | Very low | 43.9 | Very low | 96 Ų | 96 | 139.1 Ų | 139.1 | 79% | 0.793 | 78% | 0.784 | S | S | * | * | trans | -159.7 | 121.5 | 150.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 72 | E | 39.6 | Very low | 43.6 | Very low | 171 Ų | 171 | 135 Ų | 135 | 80% | 0.799 | 77% | 0.768 | S | S | * | * | trans | -47.4 | 149.4 | -177.5 | -61.8 | 165.6 | 75.9 | 0 | 0 | 113.9 | V74 | E72-V74 VanDerWaalsContact C-N 3.28Å; E72-V74 PolarHBondContact O-N 2.88Å | ||
| 73 | P | 45.7 | Very low | 43 | Very low | 133 Ų | 133 | 134.1 Ų | 134.1 | 86% | 0.864 | 76% | 0.762 | S | S | * | * | trans | -69.8 | 89.5 | 170.2 | 30.2 | -32.4 | 0 | 0 | 0 | 108.8 | Q75 | P73-Q75 PolarHBondContact O-N 3.26Š| ||
| 74 | V | 42.2 | Very low | 43.1 | Very low | 115 Ų | 115 | 134.9 Ų | 134.9 | 70% | 0.697 | 76% | 0.76 | S | S | * | * | trans | -61.1 | 107.6 | 165 | 114.2 | 0 | 0 | 0 | 0 | 106.4 | E72 Q76 | E72-V74 VanDerWaalsContact C-N 3.28Å; E72-V74 PolarHBondContact O-N 2.88Å; V74-Q76 HydrophobicContact CG1-CB 4.4Å; V74-Q76 PolarHBondContact O-N 3.31Å | ||
| 75 | Q | 41.6 | Very low | 43.1 | Very low | 165 Ų | 165 | 131.9 Ų | 131.9 | 77% | 0.771 | 75% | 0.754 | S | S | * | * | trans | -53.6 | 88.9 | 161.6 | -95.4 | -89.5 | 25.8 | 0 | 0 | 106.9 | P73 Q77 | P73-Q75 PolarHBondContact O-N 3.26Å; Q75-Q77 PolarHBondContact O-N 3.44Å | ||
| 76 | Q | 43.3 | Very low | 43.2 | Very low | 161 Ų | 161 | 127.7 Ų | 127.7 | 75% | 0.752 | 74% | 0.744 | S | S | * | * | trans | -73.5 | 87.5 | 173 | -164.2 | 146.2 | -53.2 | 0 | 0 | 106.2 | V74 V78 | V74-Q76 HydrophobicContact CG1-CB 4.4Å; V74-Q76 PolarHBondContact O-N 3.31Å; Q76-V78 VanDerWaalsContact C-N 3.27Å; Q76-V78 PolarHBondContact O-N 3.2Å | ||
| 77 | Q | 40.2 | Very low | 43.7 | Very low | 172 Ų | 172 | 132.4 Ų | 132.4 | 80% | 0.804 | 75% | 0.751 | S | S | * | * | trans | -52.7 | 95.5 | 167.1 | -69.2 | 170.8 | -105.7 | 0 | 0 | 107.3 | Q75 P79 | Q75-Q77 PolarHBondContact O-N 3.44Å; Q77-P79 WeakPolarHBondContact O-CD 3.45Å | ||
| 78 | V | 44.3 | Very low | 44.3 | Very low | 123 Ų | 123 | 135.4 Ų | 135.4 | 75% | 0.745 | 76% | 0.755 | S | S | * | * | trans | -61.9 | 118.5 | 168.7 | -172.9 | 0 | 0 | 0 | 0 | 105.3 | Q76 D80 | Q76-V78 VanDerWaalsContact C-N 3.27Å; Q76-V78 PolarHBondContact O-N 3.2Å; V78-D80 PolarHBondContact O-N 3.47Å | ||
| 79 | P | 45.5 | Very low | 45.1 | Very low | 105 Ų | 105 | 132.3 Ų | 132.3 | 68% | 0.682 | 74% | 0.736 | S | S | * | * | trans | -59 | 119.2 | 171.3 | 22.6 | -29.2 | 0 | 0 | 0 | 107 | Q77 Q81 | Q77-P79 WeakPolarHBondContact O-CD 3.45Å; P79-Q81 VanDerWaalsContact C-N 3.3Å; P79-Q81 PolarHBondContact O-N 2.85Å | ||
| 80 | D | 40.3 | Very low | 46.6 | Very low | 148 Ų | 148 | 128 Ų | 128 | 79% | 0.791 | 71% | 0.711 | S | S | * | * | trans | -48.4 | 94.8 | 174.1 | -165.6 | -97.5 | 0 | 0 | 0 | 108.3 | V78 P82 | V78-D80 PolarHBondContact O-N 3.47Å; D80-P82 VanDerWaalsContact O-CD 3.29Å; D80-P82 WeakPolarHBondContact O-CD 3.37Å | ||
| 81 | Q | 42 | Very low | 48.9 | Very low | 132 Ų | 132 | 121.1 Ų | 121.1 | 62% | 0.617 | 68% | 0.675 | S | S | * | * | trans | -69.2 | 118 | 165.9 | -79.5 | -85.9 | 104.5 | 0 | 0 | 104.8 | P79 M83 | P79-Q81 VanDerWaalsContact C-N 3.3Å; P79-Q81 PolarHBondContact O-N 2.85Å; Q81-M83 HydrophobicContact CB-CG 4.16Å; Q81-M83 HydrophobicContact CB-SD 3.99Å; Q81-M83 PolarHBondContact O-N 3.48Å | ||
| 82 | P | 47.6 | Very low | 51 | Low | 91 Ų | 91 | 120.2 Ų | 120.2 | 59% | 0.591 | 65% | 0.654 | S | S | * | * | trans | -75 | 62.7 | 175.8 | 32.6 | -34.5 | 0 | 0 | 0 | 109.3 | D80 A84 | D80-P82 VanDerWaalsContact O-CD 3.29Å; D80-P82 WeakPolarHBondContact O-CD 3.37Å; P82-A84 PolarHBondContact O-N 2.81Å | ||
| 83 | M | 45.4 | Very low | 53.1 | Low | 150 Ų | 150 | 118.5 Ų | 118.5 | 74% | 0.739 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72 | -6.5 | 170.7 | -79.5 | 162.4 | 161 | 0 | 0 | 111.6 | Q81 | Q81-M83 HydrophobicContact CB-CG 4.16Å; Q81-M83 HydrophobicContact CB-SD 3.99Å; Q81-M83 PolarHBondContact O-N 3.48Å |
| 84 | A | 46 | Very low | 54.9 | Low | 92 Ų | 92 | 114.3 Ų | 114.3 | 76% | 0.76 | 61% | 0.613 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | -14.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | P82 | P82-A84 PolarHBondContact O-N 2.81Š|
| 85 | A | 48.8 | Very low | 57 | Low | 71 Ų | 71 | 112 Ų | 112 | 59% | 0.587 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -78.4 | -20.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | L87 | A85-L87 PolarHBondContact O-N 3.44Š|
| 86 | T | 51.4 | Low | 59.1 | Low | 89 Ų | 89 | 110 Ų | 110 | 55% | 0.546 | 59% | 0.588 | S | S | . | * | G | 310 helix | trans | -67.1 | -16.7 | -176.6 | -63.8 | 0 | 0 | 0 | 0 | 114.1 | ||
| 87 | L | 51.6 | Low | 61.1 | Low | 169 Ų | 169 | 105.6 Ų | 105.6 | 89% | 0.885 | 57% | 0.567 | S | S | * | * | G | 310 helix | trans | -84.7 | -16.5 | -174.3 | -151.3 | 73.9 | 0 | 0 | 0 | 114.4 | A85 | A85-L87 PolarHBondContact O-N 3.44Š|
| 88 | Q | 56.1 | Low | 63.4 | Low | 185 Ų | 185 | 99 Ų | 99 | 86% | 0.864 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.4 | -34.6 | -174 | -109.7 | 177.5 | 61.2 | 0 | 0 | 114.3 | ||
| 89 | K | 62.9 | Low | 65.5 | Low | 119 Ų | 119 | 97.9 Ų | 97.9 | 52% | 0.517 | 53% | 0.525 | S | S | . | . | trans | -147.6 | 100.9 | 169.6 | -95.5 | 144.1 | 81 | -164.3 | 0 | 108.4 | C91 E92 | K89-C91 PolarHBondContact O-N 3.37Å; K89-E92 HydrophobicContact CB-CB 3.67Å; K89-E92 HydrophobicContact CB-CG 4.2Å; K89-E92 WeakPolarHBondContact CD-OE2 3.45Å; K89-E92 WeakPolarHBondContact CE-OE2 3.33Å; K89-E92 IonicContact NZ-OE2 2.62Å; K89-E92 PolarHBondContact NZ-OE2 3.33Å; K89-E92 WeakPolarHBondContact O-CB 3.06Å; K89-E92 PolarHBondContact O-N 2.04Å | ||
| 90 | P | 68.7 | Low | 67.5 | Low | 41 Ų | 41 | 99.5 Ų | 99.5 | 27% | 0.266 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.7 | -14.7 | -168.8 | 25 | -34.6 | 0 | 0 | 0 | 114.2 | C120 Y124 | P90-C120 VanDerWaalsContact C-SG 3.55Å; P90-C120 PolarHBondContact O-SG 2.88Å; P90-Y124 HydrophobicContact CB-CD1 3.24Å; P90-Y124 HydrophobicContact CB-CD2 3.51Å; P90-Y124 HydrophobicContact CB-CE1 3.24Å; P90-Y124 HydrophobicContact CB-CE2 3.52Å; P90-Y124 HydrophobicContact CB-CG 3.36Å; P90-Y124 HydrophobicContact CG-CD1 3.44Å; P90-Y124 VanDerWaalsContact CG-CD1 3.44Å; P90-Y124 HydrophobicContact CG-CD2 3.92Å; P90-Y124 HydrophobicContact CG-CE1 3.99Å; P90-Y124 HydrophobicContact CG-CE2 4.42Å; P90-Y124 HydrophobicContact CG-CG 3.37Å |
| 91 | C | 85.5 | Confident | 69.8 | Low | 16 Ų | 16 | 93.2 Ų | 93.2 | 11% | 0.108 | 49% | 0.491 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -111.4 | 11.5 | 175.4 | -52 | 0 | 0 | 0 | 0 | 113.6 | K89 F93 E94 L95 C120 R121 | K89-C91 PolarHBondContact O-N 3.37Å; C91-F93 VanDerWaalsContact C-N 3.32Å; C91-F93 PolarHBondContact O-N 3.43Å; C91-E94 PolarHBondContact O-N 2.85Å; C91-L95 WeakPolarHBondContact O-CB 3.42Å; C91-L95 PolarHBondContact O-N 3.36Å; C91-C120 WeakPolarHBondContact CA-SG 3.21Å; C91-C120 HydrophobicContact CB-CB 3.85Å; C91-C120 WeakPolarHBondContact CB-SG 3.3Å; C91-C120 WeakPolarHBondContact SG-CB 3.27Å; C91-C120 PolarHBondContact SG-O 3.06Å; C91-C120 CovalentContact SG-SG 2.04Å; C91-C120 PolarHBondContact SG-SG 3.22Å; C91-R121 PolarHBondContact SG-N 3.33Å |
| 92 | E | 83 | Confident | 72 | Confident | 76 Ų | 76 | 88.6 Ų | 88.6 | 36% | 0.355 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.9 | -39 | -176 | -155.4 | 165.6 | 86.7 | 0 | 0 | 112.3 | K89 L95 Q96 | K89-E92 HydrophobicContact CB-CB 3.67Å; K89-E92 HydrophobicContact CB-CG 4.2Å; K89-E92 WeakPolarHBondContact CD-OE2 3.45Å; K89-E92 WeakPolarHBondContact CE-OE2 3.33Å; K89-E92 IonicContact NZ-OE2 2.62Å; K89-E92 PolarHBondContact NZ-OE2 3.33Å; K89-E92 WeakPolarHBondContact O-CB 3.06Å; K89-E92 PolarHBondContact O-N 2.04Å; E92-L95 PolarHBondContact O-N 2.86Å; E92-Q96 WeakPolarHBondContact O-CB 2.83Å; E92-Q96 PolarHBondContact O-N 3.46Å |
| 93 | F | 82.7 | Confident | 73.9 | Confident | 135 Ų | 135 | 92.6 Ų | 92.6 | 59% | 0.592 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -64.7 | -49.8 | 177.9 | -177.3 | -102.5 | 0 | 0 | 0 | 111.7 | C91 L95 Q96 Q97 | C91-F93 VanDerWaalsContact C-N 3.32Å; C91-F93 PolarHBondContact O-N 3.43Å; F93-L95 VanDerWaalsContact C-N 3.28Å; F93-L95 PolarHBondContact O-N 3.26Å; F93-Q96 PolarHBondContact O-N 2.81Å; F93-Q97 PolarHBondContact O-N 2.8Å |
| 94 | E | 84.8 | Confident | 75.8 | Confident | 45 Ų | 45 | 91 Ų | 91 | 21% | 0.21 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -59.4 | -39.1 | 173.7 | -107.1 | 73.6 | 79.8 | 0 | 0 | 112.2 | C91 Q97 F98 V116 L117 | C91-E94 PolarHBondContact O-N 2.85Å; E94-Q97 PolarHBondContact O-N 2.82Å; E94-F98 PolarHBondContact O-N 3.24Å; E94-V116 HydrophobicContact CG-CB 3.68Å; E94-V116 HydrophobicContact CG-CG1 3.31Å; E94-L117 HydrophobicContact CB-CB 4.28Å; E94-L117 HydrophobicContact CB-CD1 4.42Å; E94-L117 HydrophobicContact CB-CG 4.48Å |
| 95 | L | 85 | Confident | 77.6 | Confident | 68 Ų | 68 | 90.3 Ų | 90.3 | 36% | 0.356 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -68.2 | -41.9 | 178.8 | -177.3 | 65.5 | 0 | 0 | 0 | 112.5 | C91 E92 F93 F98 L99 L117 | C91-L95 WeakPolarHBondContact O-CB 3.42Å; C91-L95 PolarHBondContact O-N 3.36Å; E92-L95 PolarHBondContact O-N 2.86Å; F93-L95 VanDerWaalsContact C-N 3.28Å; F93-L95 PolarHBondContact O-N 3.26Å; L95-F98 PolarHBondContact O-N 2.92Å; L95-L99 HydrophobicContact CD1-CD1 4.37Å; L95-L99 HydrophobicContact CD1-CG 4.37Å; L95-L99 HydrophobicContact CG-CD1 4.15Å; L95-L99 WeakPolarHBondContact O-CB 3.5Å; L95-L99 WeakPolarHBondContact O-CG 3.34Å; L95-L99 PolarHBondContact O-N 3.37Å; L95-L117 HydrophobicContact CB-CD1 3.65Å; L95-L117 HydrophobicContact CD1-CD1 3.58Å; L95-L117 HydrophobicContact CG-CD1 4.21Å |
| 96 | Q | 86.3 | Confident | 79.2 | Confident | 122 Ų | 122 | 93 Ų | 93 | 57% | 0.57 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -61.3 | -45.7 | 173.5 | -96.3 | -179.8 | -25.9 | 0 | 0 | 111.2 | E92 F93 F98 L99 E100 | E92-Q96 WeakPolarHBondContact O-CB 2.83Å; E92-Q96 PolarHBondContact O-N 3.46Å; F93-Q96 PolarHBondContact O-N 2.81Å; Q96-F98 VanDerWaalsContact C-N 3.32Å; Q96-F98 PolarHBondContact O-N 3.47Å; Q96-L99 PolarHBondContact O-N 3.37Å; Q96-E100 VanDerWaalsContact O-CB 3.3Å; Q96-E100 WeakPolarHBondContact O-CB 3.49Å; Q96-E100 PolarHBondContact O-N 3Å |
| 97 | Q | 84.4 | Confident | 80.7 | Confident | 69 Ų | 69 | 94.2 Ų | 94.2 | 32% | 0.322 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -62.6 | -40.2 | 178.5 | -71.4 | -155.4 | 87.8 | 0 | 0 | 112.4 | F93 E94 C101 F113 | F93-Q97 PolarHBondContact O-N 2.8Å; E94-Q97 PolarHBondContact O-N 2.82Å; Q97-C101 WeakPolarHBondContact O-CB 3.12Å; Q97-C101 PolarHBondContact O-N 3.04Å; Q97-F113 HydrophobicContact CB-CD1 3.6Å; Q97-F113 HydrophobicContact CB-CE1 3.77Å; Q97-F113 HydrophobicContact CB-CG 4.38Å; Q97-F113 HydrophobicContact CG-CE1 4.34Å |
| 98 | F | 88.8 | Confident | 82.3 | Confident | 32 Ų | 32 | 90.2 Ų | 90.2 | 14% | 0.14 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -62.9 | -46.3 | 174 | 175.4 | -108.9 | 0 | 0 | 0 | 112.2 | E94 L95 Q96 C101 A102 L107 C110 F113 N114 L117 | E94-F98 PolarHBondContact O-N 3.24Å; L95-F98 PolarHBondContact O-N 2.92Å; Q96-F98 VanDerWaalsContact C-N 3.32Å; Q96-F98 PolarHBondContact O-N 3.47Å; F98-C101 PolarHBondContact O-N 2.94Å; F98-A102 HydrophobicContact CZ-CB 4.4Å; F98-A102 WeakPolarHBondContact O-CB 3.37Å; F98-A102 PolarHBondContact O-N 3.41Å; F98-L107 HydrophobicContact CE2-CD2 4.14Å; F98-L107 HydrophobicContact CZ-CD2 3.61Å; F98-C110 HydrophobicContact CD2-CB 3.88Å; F98-C110 HydrophobicContact CE2-CB 3.74Å; F98-F113 HydrophobicContact CB-CB 4.04Å; F98-F113 HydrophobicContact CD2-CB 4.26Å; F98-N114 HydrophobicContact CD2-CB 4.43Å; F98-N114 WeakPolarHBondContact CD2-ND2 3.29Å; F98-N114 HydrophobicContact CE2-CB 4.44Å; F98-N114 WeakPolarHBondContact CE2-ND2 3.35Å; F98-N114 WeakPolarHBondContact CZ-ND2 3.39Å; F98-L117 HydrophobicContact CB-CD1 4.05Å |
| 99 | L | 88.1 | Confident | 83.6 | Confident | 100 Ų | 100 | 87.1 Ų | 87.1 | 52% | 0.524 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -66.1 | -37.6 | 179.4 | -73.7 | 175 | 0 | 0 | 0 | 112.4 | L95 Q96 A102 K103 | L95-L99 HydrophobicContact CD1-CD1 4.37Å; L95-L99 HydrophobicContact CD1-CG 4.37Å; L95-L99 HydrophobicContact CG-CD1 4.15Å; L95-L99 WeakPolarHBondContact O-CB 3.5Å; L95-L99 WeakPolarHBondContact O-CG 3.34Å; L95-L99 PolarHBondContact O-N 3.37Å; Q96-L99 PolarHBondContact O-N 3.37Å; L99-A102 PolarHBondContact O-N 3.38Å; L99-K103 WeakPolarHBondContact O-CB 3.27Å; L99-K103 PolarHBondContact O-N 3.4Å |
| 100 | E | 88.1 | Confident | 84.9 | Confident | 139 Ų | 139 | 81.4 Ų | 81.4 | 65% | 0.65 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -68.1 | -39.4 | 177.6 | -172.1 | 151.4 | 92.7 | 0 | 0 | 111.5 | Q96 N104 | Q96-E100 VanDerWaalsContact O-CB 3.3Å; Q96-E100 WeakPolarHBondContact O-CB 3.49Å; Q96-E100 PolarHBondContact O-N 3Å; E100-N104 PolarHBondContact O-N 2.92Å; E100-N104 PolarHBondContact O-ND2 3.45Å |
| 101 | C | 88.3 | Confident | 85.7 | Confident | 16 Ų | 16 | 85.5 Ų | 85.5 | 11% | 0.108 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -62.9 | -50.3 | 171.4 | -178.3 | 0 | 0 | 0 | 0 | 111.1 | Q97 F98 K103 N104 N105 C110 F113 | Q97-C101 WeakPolarHBondContact O-CB 3.12Å; Q97-C101 PolarHBondContact O-N 3.04Å; F98-C101 PolarHBondContact O-N 2.94Å; C101-K103 VanDerWaalsContact C-N 3.25Å; C101-K103 PolarHBondContact O-N 2.87Å; C101-N104 PolarHBondContact O-N 3.33Å; C101-N105 WeakPolarHBondContact O-CA 2.96Å; C101-N105 WeakPolarHBondContact O-CB 3.18Å; C101-N105 PolarHBondContact O-N 2.8Å; C101-N105 PolarHBondContact O-ND2 3.41Å; C101-C110 HydrophobicContact CB-CB 3.82Å; C101-C110 WeakPolarHBondContact CB-SG 3.18Å; C101-C110 WeakPolarHBondContact SG-CA 3.03Å; C101-C110 WeakPolarHBondContact SG-CB 3.39Å; C101-C110 CovalentContact SG-SG 2.03Å; C101-C110 PolarHBondContact SG-SG 3.02Å; C101-F113 HydrophobicContact CB-CD2 3.93Å; C101-F113 HydrophobicContact CB-CE2 4.14Å |
| 102 | A | 88.5 | Confident | 85.6 | Confident | 36 Ų | 36 | 87 Ų | 87 | 30% | 0.298 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -67.1 | -24.4 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | F98 L99 L107 C110 | F98-A102 HydrophobicContact CZ-CB 4.4Å; F98-A102 WeakPolarHBondContact O-CB 3.37Å; F98-A102 PolarHBondContact O-N 3.41Å; L99-A102 PolarHBondContact O-N 3.38Å; A102-L107 HydrophobicContact CB-CD2 4.03Å; A102-C110 PolarHBondContact N-SG 3.39Å; A102-C110 VanDerWaalsContact N-SG 3.41Å |
| 103 | K | 87.9 | Confident | 85.6 | Confident | 175 Ų | 175 | 86.7 Ų | 86.7 | 76% | 0.761 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -71.3 | -33.4 | 175.8 | 179.1 | 176.3 | 171.4 | 177.9 | 0 | 112.4 | L99 C101 | L99-K103 WeakPolarHBondContact O-CB 3.27Å; L99-K103 PolarHBondContact O-N 3.4Å; C101-K103 VanDerWaalsContact C-N 3.25Å; C101-K103 PolarHBondContact O-N 2.87Å |
| 104 | N | 85 | Confident | 85.7 | Confident | 116 Ų | 116 | 82.8 Ų | 82.8 | 62% | 0.62 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -108.9 | -18.6 | -173.7 | -64.9 | -76.9 | 0 | 0 | 0 | 113.4 | E100 C101 | E100-N104 PolarHBondContact O-N 2.92Å; E100-N104 PolarHBondContact O-ND2 3.45Å; C101-N104 PolarHBondContact O-N 3.33Å |
| 105 | N | 84.2 | Confident | 85.8 | Confident | 78 Ų | 78 | 87.2 Ų | 87.2 | 42% | 0.417 | 46% | 0.456 | S | S | . | . | S | Bend | trans | -135.1 | 160.1 | -174.1 | -56 | -86.3 | 0 | 0 | 0 | 111.2 | C101 L109 | C101-N105 WeakPolarHBondContact O-CA 2.96Å; C101-N105 WeakPolarHBondContact O-CB 3.18Å; C101-N105 PolarHBondContact O-N 2.8Å; C101-N105 PolarHBondContact O-ND2 3.41Å; N105-L109 HydrophobicContact CB-CB 4.37Å |
| 106 | D | 82.5 | Confident | 85.8 | Confident | 127 Ų | 127 | 87.2 Ų | 87.2 | 68% | 0.679 | 46% | 0.458 | S | S | * | . | trans | -61.8 | 141.7 | 169.6 | -76.6 | -77 | 0 | 0 | 0 | 111.7 | S108 L109 | D106-S108 PolarHBondContact O-N 3.04Å; D106-L109 HydrophobicContact CB-CD1 4.29Å; D106-L109 PolarHBondContact O-N 3.22Å | ||
| 107 | L | 83 | Confident | 85.8 | Confident | 114 Ų | 114 | 82.9 Ų | 82.9 | 60% | 0.597 | 44% | 0.439 | S | S | * | . | G | 310 helix | trans | -51.5 | -29.6 | -176 | -74.1 | 156.9 | 0 | 0 | 0 | 113.9 | F98 A102 L109 C110 E111 | F98-L107 HydrophobicContact CE2-CD2 4.14Å; F98-L107 HydrophobicContact CZ-CD2 3.61Å; A102-L107 HydrophobicContact CB-CD2 4.03Å; L107-L109 VanDerWaalsContact C-N 3.28Å; L107-L109 PolarHBondContact O-N 3.22Å; L107-C110 PolarHBondContact O-N 3.04Å; L107-E111 PolarHBondContact O-N 3.13Å |
| 108 | S | 83.6 | Confident | 86 | Confident | 85 Ų | 85 | 86.1 Ų | 86.1 | 59% | 0.594 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -63.1 | -31 | 178 | -48.5 | 0 | 0 | 0 | 0 | 113.1 | D106 C110 | D106-S108 PolarHBondContact O-N 3.04Å; S108-C110 PolarHBondContact O-N 3.26Å |
| 109 | L | 84.4 | Confident | 85.9 | Confident | 120 Ų | 120 | 90.2 Ų | 90.2 | 63% | 0.628 | 47% | 0.471 | S | S | * | . | G | 310 helix | trans | -75.9 | -18.7 | 175.5 | -76.7 | 80.9 | 0 | 0 | 0 | 111.8 | N105 D106 L107 | N105-L109 HydrophobicContact CB-CB 4.37Å; D106-L109 HydrophobicContact CB-CD1 4.29Å; D106-L109 PolarHBondContact O-N 3.22Å; L107-L109 VanDerWaalsContact C-N 3.28Å; L107-L109 PolarHBondContact O-N 3.22Å |
| 110 | C | 89.5 | Confident | 85.9 | Confident | 0 Ų | 0 | 85.9 Ų | 85.9 | 0% | 0 | 45% | 0.449 | C | S | . | . | G | 310 helix | trans | -96.6 | 6.8 | -176.3 | -49 | 0 | 0 | 0 | 0 | 113.2 | F98 C101 A102 L107 S108 G112 F113 N114 | F98-C110 HydrophobicContact CD2-CB 3.88Å; F98-C110 HydrophobicContact CE2-CB 3.74Å; C101-C110 HydrophobicContact CB-CB 3.82Å; C101-C110 WeakPolarHBondContact CB-SG 3.18Å; C101-C110 WeakPolarHBondContact SG-CA 3.03Å; C101-C110 WeakPolarHBondContact SG-CB 3.39Å; C101-C110 CovalentContact SG-SG 2.03Å; C101-C110 PolarHBondContact SG-SG 3.02Å; A102-C110 PolarHBondContact N-SG 3.39Å; A102-C110 VanDerWaalsContact N-SG 3.41Å; L107-C110 PolarHBondContact O-N 3.04Å; S108-C110 PolarHBondContact O-N 3.26Å; C110-G112 PolarHBondContact O-N 3.23Å; C110-F113 PolarHBondContact O-N 3.5Å; C110-F113 VanDerWaalsContact O-N 3.13Å; C110-N114 PolarHBondContact O-N 3.38Å |
| 111 | E | 85.3 | Confident | 85.8 | Confident | 127 Ų | 127 | 86 Ų | 86 | 59% | 0.593 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -56.1 | -34.9 | 177.5 | -84.4 | -176.6 | 63.8 | 0 | 0 | 112.6 | L107 N114 Q115 | L107-E111 PolarHBondContact O-N 3.13Å; E111-N114 WeakPolarHBondContact O-CB 3.44Å; E111-N114 PolarHBondContact O-N 3.04Å; E111-Q115 PolarHBondContact O-N 3.41Å |
| 112 | G | 84.3 | Confident | 85.7 | Confident | 46 Ų | 46 | 90.5 Ų | 90.5 | 47% | 0.474 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -59.1 | -49.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | C110 N114 Q115 V116 | C110-G112 PolarHBondContact O-N 3.23Å; G112-N114 VanDerWaalsContact C-N 3.27Å; G112-N114 PolarHBondContact O-N 2.03Å; G112-Q115 PolarHBondContact O-N 2.88Å; G112-V116 PolarHBondContact O-N 3.3Å |
| 113 | F | 83 | Confident | 85.6 | Confident | 70 Ų | 70 | 98.1 Ų | 98.1 | 31% | 0.307 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.3 | -32.9 | 176.3 | -64.5 | -71.8 | 0 | 0 | 0 | 112.2 | Q97 F98 C101 C110 Q115 V116 L117 | Q97-F113 HydrophobicContact CB-CD1 3.6Å; Q97-F113 HydrophobicContact CB-CE1 3.77Å; Q97-F113 HydrophobicContact CB-CG 4.38Å; Q97-F113 HydrophobicContact CG-CE1 4.34Å; F98-F113 HydrophobicContact CB-CB 4.04Å; F98-F113 HydrophobicContact CD2-CB 4.26Å; C101-F113 HydrophobicContact CB-CD2 3.93Å; C101-F113 HydrophobicContact CB-CE2 4.14Å; C110-F113 PolarHBondContact O-N 3.5Å; C110-F113 VanDerWaalsContact O-N 3.13Å; F113-Q115 VanDerWaalsContact C-N 3.34Å; F113-Q115 PolarHBondContact O-N 3.26Å; F113-V116 PolarHBondContact O-N 3.29Å; F113-L117 VanDerWaalsContact O-CB 3.27Å; F113-L117 WeakPolarHBondContact O-CB 3.39Å; F113-L117 PolarHBondContact O-N 3.26Å |
| 114 | N | 83.6 | Confident | 85.4 | Confident | 53 Ų | 53 | 95.6 Ų | 95.6 | 28% | 0.283 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.3 | -37.1 | 176.5 | -132.1 | -92.7 | 0 | 0 | 0 | 112.7 | F98 C110 E111 G112 K118 | F98-N114 HydrophobicContact CD2-CB 4.43Å; F98-N114 WeakPolarHBondContact CD2-ND2 3.29Å; F98-N114 HydrophobicContact CE2-CB 4.44Å; F98-N114 WeakPolarHBondContact CE2-ND2 3.35Å; F98-N114 WeakPolarHBondContact CZ-ND2 3.39Å; C110-N114 PolarHBondContact O-N 3.38Å; E111-N114 WeakPolarHBondContact O-CB 3.44Å; E111-N114 PolarHBondContact O-N 3.04Å; G112-N114 VanDerWaalsContact C-N 3.27Å; G112-N114 PolarHBondContact O-N 2.03Å; N114-K118 WeakPolarHBondContact O-CB 2.83Å; N114-K118 PolarHBondContact O-N 3.35Å |
| 115 | Q | 88.1 | Confident | 85.1 | Confident | 139 Ų | 139 | 97.2 Ų | 97.2 | 65% | 0.65 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -65.2 | -48.6 | 175.3 | -75.9 | -163.2 | 70.7 | 0 | 0 | 111.6 | E111 G112 F113 L117 K118 E119 | E111-Q115 PolarHBondContact O-N 3.41Å; G112-Q115 PolarHBondContact O-N 2.88Å; F113-Q115 VanDerWaalsContact C-N 3.34Å; F113-Q115 PolarHBondContact O-N 3.26Å; Q115-L117 VanDerWaalsContact C-N 3.27Å; Q115-L117 PolarHBondContact O-N 3.4Å; Q115-K118 PolarHBondContact O-N 3.4Å; Q115-E119 WeakPolarHBondContact O-CB 3.06Å; Q115-E119 PolarHBondContact O-N 3Å |
| 116 | V | 85.3 | Confident | 84.3 | Confident | 68 Ų | 68 | 98.5 Ų | 98.5 | 41% | 0.412 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.6 | -39.6 | 179 | -165.6 | 0 | 0 | 0 | 0 | 110.5 | E94 G112 F113 E119 C120 | E94-V116 HydrophobicContact CG-CB 3.68Å; E94-V116 HydrophobicContact CG-CG1 3.31Å; G112-V116 PolarHBondContact O-N 3.3Å; F113-V116 PolarHBondContact O-N 3.29Å; V116-E119 PolarHBondContact O-N 2.92Å; V116-C120 WeakPolarHBondContact O-CB 3.33Å; V116-C120 PolarHBondContact O-N 3.45Å |
| 117 | L | 86.6 | Confident | 84.3 | Confident | 31 Ų | 31 | 97.1 Ų | 97.1 | 16% | 0.162 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -64.5 | -43 | 176.6 | -167.2 | 138.8 | 0 | 0 | 0 | 113.2 | E94 L95 F98 F113 Q115 E119 C120 R121 | E94-L117 HydrophobicContact CB-CB 4.28Å; E94-L117 HydrophobicContact CB-CD1 4.42Å; E94-L117 HydrophobicContact CB-CG 4.48Å; L95-L117 HydrophobicContact CB-CD1 3.65Å; L95-L117 HydrophobicContact CD1-CD1 3.58Å; L95-L117 HydrophobicContact CG-CD1 4.21Å; F98-L117 HydrophobicContact CB-CD1 4.05Å; F113-L117 VanDerWaalsContact O-CB 3.27Å; F113-L117 WeakPolarHBondContact O-CB 3.39Å; F113-L117 PolarHBondContact O-N 3.26Å; Q115-L117 VanDerWaalsContact C-N 3.27Å; Q115-L117 PolarHBondContact O-N 3.4Å; L117-E119 VanDerWaalsContact C-N 3.31Å; L117-C120 PolarHBondContact O-N 3.48Å; L117-R121 WeakPolarHBondContact O-CB 3.38Å; L117-R121 PolarHBondContact O-N 2.93Å |
| 118 | K | 87.2 | Confident | 84.4 | Confident | 136 Ų | 136 | 96.2 Ų | 96.2 | 59% | 0.591 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -62.5 | -41 | 173.1 | -90.5 | -178.9 | 171.2 | 174.6 | 0 | 111.6 | N114 Q115 R121 T122 | N114-K118 WeakPolarHBondContact O-CB 2.83Å; N114-K118 PolarHBondContact O-N 3.35Å; Q115-K118 PolarHBondContact O-N 3.4Å; K118-R121 WeakPolarHBondContact O-CB 3.01Å; K118-R121 PolarHBondContact O-N 2.82Å; K118-T122 WeakPolarHBondContact O-CB 3.43Å; K118-T122 PolarHBondContact O-N 3.2Å; K118-T122 PolarHBondContact O-OG1 3.05Å |
| 119 | E | 86.6 | Confident | 84.5 | Confident | 118 Ų | 118 | 96.8 Ų | 96.8 | 55% | 0.551 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -65.5 | -45.2 | 179.2 | -156.7 | 170.2 | 113.8 | 0 | 0 | 110 | Q115 V116 L117 R121 T122 R123 | Q115-E119 WeakPolarHBondContact O-CB 3.06Å; Q115-E119 PolarHBondContact O-N 3Å; V116-E119 PolarHBondContact O-N 2.92Å; L117-E119 VanDerWaalsContact C-N 3.31Å; E119-R121 PolarHBondContact O-N 2.98Å; E119-T122 PolarHBondContact O-N 2.76Å; E119-R123 WeakPolarHBondContact O-CB 3.34Å; E119-R123 WeakPolarHBondContact O-CG 3.24Å; E119-R123 PolarHBondContact O-N 3.4Å |
| 120 | C | 88.8 | Confident | 84.5 | Confident | 9 Ų | 9 | 95.5 Ų | 95.5 | 6% | 0.061 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -57.2 | -48.4 | 171.5 | -175.9 | 0 | 0 | 0 | 0 | 111.5 | P90 C91 V116 L117 T122 R123 Y124 | P90-C120 VanDerWaalsContact C-SG 3.55Å; P90-C120 PolarHBondContact O-SG 2.88Å; C91-C120 WeakPolarHBondContact CA-SG 3.21Å; C91-C120 HydrophobicContact CB-CB 3.85Å; C91-C120 WeakPolarHBondContact CB-SG 3.3Å; C91-C120 WeakPolarHBondContact SG-CB 3.27Å; C91-C120 PolarHBondContact SG-O 3.06Å; C91-C120 CovalentContact SG-SG 2.04Å; C91-C120 PolarHBondContact SG-SG 3.22Å; V116-C120 WeakPolarHBondContact O-CB 3.33Å; V116-C120 PolarHBondContact O-N 3.45Å; L117-C120 PolarHBondContact O-N 3.48Å; C120-T122 VanDerWaalsContact C-N 3.26Å; C120-T122 PolarHBondContact O-N 3.47Å; C120-R123 WeakPolarHBondContact O-CB 3.39Å; C120-R123 PolarHBondContact O-N 3.29Å; C120-R123 VanDerWaalsContact O-N 3.1Å; C120-Y124 VanDerWaalsContact O-CD2 3.27Å; C120-Y124 WeakPolarHBondContact O-CD2 3.43Å; C120-Y124 PolarHBondContact O-N 3.33Å; C120-Y124 WeakPolarHBondContact SG-CD2 3.48Å |
| 121 | R | 85.9 | Confident | 84.2 | Confident | 141 Ų | 141 | 101.4 Ų | 101.4 | 53% | 0.532 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -56.4 | -42.4 | 177.5 | -174.8 | 172.8 | -174.1 | 154.2 | 13.9 | 112.2 | C91 L117 K118 E119 N125 V126 | C91-R121 PolarHBondContact SG-N 3.33Å; L117-R121 WeakPolarHBondContact O-CB 3.38Å; L117-R121 PolarHBondContact O-N 2.93Å; K118-R121 WeakPolarHBondContact O-CB 3.01Å; K118-R121 PolarHBondContact O-N 2.82Å; E119-R121 PolarHBondContact O-N 2.98Å; R121-N125 WeakPolarHBondContact O-CA 3.04Å; R121-N125 PolarHBondContact O-N 3.39Å; R121-V126 HydrophobicContact CB-CG2 4.39Å; R121-V126 WeakPolarHBondContact CD-O 3.4Å; R121-V126 HydrophobicContact CG-CG2 4Å; R121-V126 WeakPolarHBondContact CG-O 3.33Å; R121-V126 PolarHBondContact NE-O 3.44Å; R121-V126 PolarHBondContact NE-OXT 2.84Å; R121-V126 PolarHBondContact NH2-O 3.34Å; R121-V126 PolarHBondContact NH2-OXT 2.86Å; R121-V126 PolarHBondContact O-N 3.45Å |
| 122 | T | 87.2 | Confident | 84.1 | Confident | 112 Ų | 112 | 99.7 Ų | 99.7 | 69% | 0.687 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -69 | -39.9 | 177.6 | -52.4 | 0 | 0 | 0 | 0 | 111.7 | K118 E119 C120 | K118-T122 WeakPolarHBondContact O-CB 3.43Å; K118-T122 PolarHBondContact O-N 3.2Å; K118-T122 PolarHBondContact O-OG1 3.05Å; E119-T122 PolarHBondContact O-N 2.76Å; C120-T122 VanDerWaalsContact C-N 3.26Å; C120-T122 PolarHBondContact O-N 3.47Å |
| 123 | R | 85.7 | Confident | 84.1 | Confident | 196 Ų | 196 | 103.6 Ų | 103.6 | 74% | 0.74 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -65.9 | -41.4 | 178.6 | -72.9 | -75.3 | -169.4 | 158 | 4.9 | 112.6 | E119 C120 | E119-R123 WeakPolarHBondContact O-CB 3.34Å; E119-R123 WeakPolarHBondContact O-CG 3.24Å; E119-R123 PolarHBondContact O-N 3.4Å; C120-R123 WeakPolarHBondContact O-CB 3.39Å; C120-R123 PolarHBondContact O-N 3.29Å; C120-R123 VanDerWaalsContact O-N 3.1Å |
| 124 | Y | 83.1 | Confident | 84.1 | Confident | 122 Ų | 122 | 106.2 Ų | 106.2 | 48% | 0.478 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -96 | 0.1 | -177.6 | -68.6 | -81.9 | 0 | 0 | 0 | 113.6 | P90 C120 V126 | P90-Y124 HydrophobicContact CB-CD1 3.24Å; P90-Y124 HydrophobicContact CB-CD2 3.51Å; P90-Y124 HydrophobicContact CB-CE1 3.24Å; P90-Y124 HydrophobicContact CB-CE2 3.52Å; P90-Y124 HydrophobicContact CB-CG 3.36Å; P90-Y124 HydrophobicContact CG-CD1 3.44Å; P90-Y124 VanDerWaalsContact CG-CD1 3.44Å; P90-Y124 HydrophobicContact CG-CD2 3.92Å; P90-Y124 HydrophobicContact CG-CE1 3.99Å; P90-Y124 HydrophobicContact CG-CE2 4.42Å; P90-Y124 HydrophobicContact CG-CG 3.37Å; C120-Y124 VanDerWaalsContact O-CD2 3.27Å; C120-Y124 WeakPolarHBondContact O-CD2 3.43Å; C120-Y124 PolarHBondContact O-N 3.33Å; C120-Y124 WeakPolarHBondContact SG-CD2 3.48Å; Y124-V126 VanDerWaalsContact C-N 3.28Å; Y124-V126 PolarHBondContact O-N 3.4Å |
| 125 | N | 79 | Confident | 84.2 | Confident | 149 Ų | 149 | 110.6 Ų | 110.6 | 80% | 0.797 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.9 | 45.5 | 178.2 | -158 | 88.1 | 0 | 0 | 0 | 113.1 | R121 | R121-N125 WeakPolarHBondContact O-CA 3.04Å; R121-N125 PolarHBondContact O-N 3.39Å |
| 126 | V | 66.8 | Low | 83.8 | Confident | 106 Ų | 106 | 108 Ų | 108 | 64% | 0.642 | 51% | 0.514 | S | S | * | . | trans | -104.1 | 0 | 176.4 | -64.7 | 0 | 0 | 0 | 0 | 112.3 | R121 Y124 | R121-V126 HydrophobicContact CB-CG2 4.39Å; R121-V126 WeakPolarHBondContact CD-O 3.4Å; R121-V126 HydrophobicContact CG-CG2 4Å; R121-V126 WeakPolarHBondContact CG-O 3.33Å; R121-V126 PolarHBondContact NE-O 3.44Å; R121-V126 PolarHBondContact NE-OXT 2.84Å; R121-V126 PolarHBondContact NH2-O 3.34Å; R121-V126 PolarHBondContact NH2-OXT 2.86Å; R121-V126 PolarHBondContact O-N 3.45Å; Y124-V126 VanDerWaalsContact C-N 3.28Å; Y124-V126 PolarHBondContact O-N 3.4Å |
Retrieved 126 of 126 residues in 123.5 ms
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