| 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 | 54.1 | Low | 54.2 | Low | 251 Ų | 251 | 135 Ų | 135 | 100% | 1.236 | 72% | 0.717 | S | S | * | * | 0 | 64.6 | 0 | -65.1 | -173.8 | -171.7 | 0 | 0 | 111.1 | |||||
| 2 | A | 58.3 | Low | 53.8 | Low | 80 Ų | 80 | 131.9 Ų | 131.9 | 66% | 0.661 | 71% | 0.707 | S | S | * | * | trans | -130 | 3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | S5 | A2-S5 PolarHBondContact O-OG 3.17Š| ||
| 3 | A | 54.3 | Low | 53.6 | Low | 84 Ų | 84 | 129.4 Ų | 129.4 | 69% | 0.694 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -88.4 | -18.8 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 4 | M | 54.2 | Low | 53.1 | Low | 175 Ų | 175 | 124.5 Ų | 124.5 | 86% | 0.862 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | -3.4 | -178.1 | -76.6 | -157.2 | -150.7 | 0 | 0 | 114.9 | ||
| 5 | S | 52.5 | Low | 52.7 | Low | 70 Ų | 70 | 122.8 Ų | 122.8 | 49% | 0.49 | 68% | 0.68 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94.2 | -16.7 | -177.8 | 52.3 | 0 | 0 | 0 | 0 | 113.9 | A2 | A2-S5 PolarHBondContact O-OG 3.17Š|
| 6 | L | 56.1 | Low | 52.7 | Low | 125 Ų | 125 | 119.1 Ų | 119.1 | 65% | 0.654 | 67% | 0.67 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.1 | -38.4 | -179.3 | -66.1 | 176 | 0 | 0 | 0 | 112.5 | R8 R9 | L6-R8 VanDerWaalsContact C-N 3.3Å; L6-R8 PolarHBondContact O-N 2.96Å; L6-R9 PolarHBondContact O-N 2.95Å |
| 7 | L | 55.1 | Low | 52.5 | Low | 141 Ų | 141 | 117.2 Ų | 117.2 | 74% | 0.738 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -67 | -29 | 178.2 | -73.7 | 167.6 | 0 | 0 | 0 | 113.3 | R9 | L7-R9 VanDerWaalsContact C-N 3.32Å; L7-R9 PolarHBondContact O-N 3.27Å |
| 8 | R | 53 | Low | 52.2 | Low | 200 Ų | 200 | 119.4 Ų | 119.4 | 76% | 0.755 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -73.5 | -18.7 | 175.5 | -86.3 | -175 | 162.5 | -171.1 | -3.7 | 114 | L6 S11 V12 | L6-R8 VanDerWaalsContact C-N 3.3Å; L6-R8 PolarHBondContact O-N 2.96Å; R8-S11 PolarHBondContact O-OG 3.47Å; R8-V12 WeakPolarHBondContact O-CG2 3.44Å |
| 9 | R | 53.1 | Low | 52.2 | Low | 192 Ų | 192 | 117.4 Ų | 117.4 | 73% | 0.725 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -88 | -25.6 | 178.5 | -71 | -171.3 | 177.1 | -162 | 0.1 | 113.1 | L6 L7 T13 | L6-R9 PolarHBondContact O-N 2.95Å; L7-R9 VanDerWaalsContact C-N 3.32Å; L7-R9 PolarHBondContact O-N 3.27Å; R9-T13 PolarHBondContact O-OG1 3.1Å |
| 10 | V | 53.2 | Low | 52 | Low | 101 Ų | 101 | 115.1 Ų | 115.1 | 61% | 0.612 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -72.5 | -33.8 | 174.2 | -179.3 | 0 | 0 | 0 | 0 | 111.1 | T13 A14 | V10-T13 PolarHBondContact O-OG1 3.3Å; V10-A14 PolarHBondContact O-N 3.18Å |
| 11 | S | 52.3 | Low | 51.7 | Low | 66 Ų | 66 | 120.8 Ų | 120.8 | 46% | 0.462 | 69% | 0.688 | S | S | . | * | H | α-helix | trans | -73.3 | -28.6 | 178.9 | 58.8 | 0 | 0 | 0 | 0 | 114.2 | R8 V15 | R8-S11 PolarHBondContact O-OG 3.47Å; S11-V15 WeakPolarHBondContact O-CG2 3.29Å |
| 12 | V | 49.9 | Very low | 51.3 | Low | 98 Ų | 98 | 114.9 Ų | 114.9 | 59% | 0.594 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -81.6 | -30.9 | -179 | 179.2 | 0 | 0 | 0 | 0 | 112 | R8 A16 | R8-V12 WeakPolarHBondContact O-CG2 3.44Å; V12-A16 WeakPolarHBondContact O-CB 3.45Å; V12-A16 PolarHBondContact O-N 3.27Å; V12-A16 VanDerWaalsContact O-N 3.1Å |
| 13 | T | 51.1 | Low | 50.7 | Low | 99 Ų | 99 | 119.4 Ų | 119.4 | 61% | 0.607 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -76.9 | -30.6 | 178.8 | 41.9 | 0 | 0 | 0 | 0 | 112.9 | R9 V10 | R9-T13 PolarHBondContact O-OG1 3.1Å; V10-T13 PolarHBondContact O-OG1 3.3Å |
| 14 | A | 46.3 | Very low | 50.1 | Low | 61 Ų | 61 | 118.8 Ų | 118.8 | 50% | 0.504 | 68% | 0.682 | S | S | . | * | H | α-helix | trans | -71.2 | -31.5 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113 | V10 | V10-A14 PolarHBondContact O-N 3.18Å |
| 15 | V | 47.1 | Very low | 49.7 | Very low | 99 Ų | 99 | 116.6 Ų | 116.6 | 60% | 0.6 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -80.4 | -34.9 | 179.2 | 173.3 | 0 | 0 | 0 | 0 | 112 | S11 A17 L18 S19 | S11-V15 WeakPolarHBondContact O-CG2 3.29Å; V15-A17 VanDerWaalsContact C-N 3.31Å; V15-A17 PolarHBondContact O-N 3.42Å; V15-L18 PolarHBondContact O-N 3.48Å; V15-S19 PolarHBondContact O-N 3.29Å |
| 16 | A | 52.4 | Low | 49.2 | Very low | 63 Ų | 63 | 124.1 Ų | 124.1 | 52% | 0.521 | 70% | 0.697 | S | S | . | * | H | α-helix | trans | -70.2 | -23.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | V12 L18 S19 | V12-A16 WeakPolarHBondContact O-CB 3.45Å; V12-A16 PolarHBondContact O-N 3.27Å; V12-A16 VanDerWaalsContact O-N 3.1Å; A16-L18 VanDerWaalsContact C-N 3.34Å; A16-S19 PolarHBondContact O-OG 3.1Å |
| 17 | A | 49.5 | Very low | 49 | Very low | 87 Ų | 87 | 126.1 Ų | 126.1 | 72% | 0.719 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | -18.2 | 173 | 0 | 0 | 0 | 0 | 0 | 113.5 | V15 | V15-A17 VanDerWaalsContact C-N 3.31Å; V15-A17 PolarHBondContact O-N 3.42Å |
| 18 | L | 47.6 | Very low | 48.5 | Very low | 158 Ų | 158 | 123 Ų | 123 | 83% | 0.827 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.3 | -13.7 | 175.4 | -80.5 | 161.9 | 0 | 0 | 0 | 113.2 | V15 A16 G20 | V15-L18 PolarHBondContact O-N 3.48Å; A16-L18 VanDerWaalsContact C-N 3.34Å; L18-G20 PolarHBondContact O-N 3.47Å |
| 19 | S | 52.2 | Low | 48.3 | Very low | 81 Ų | 81 | 123.7 Ų | 123.7 | 57% | 0.566 | 72% | 0.718 | S | S | * | * | trans | -99.6 | 61.6 | 174.7 | 64.8 | 0 | 0 | 0 | 0 | 111.3 | V15 A16 R21 | V15-S19 PolarHBondContact O-N 3.29Å; A16-S19 PolarHBondContact O-OG 3.1Å; S19-R21 VanDerWaalsContact C-N 3.3Å; S19-R21 PolarHBondContact O-N 2.91Å | ||
| 20 | G | 48.8 | Very low | 48.3 | Very low | 71 Ų | 71 | 118.2 Ų | 118.2 | 73% | 0.732 | 72% | 0.721 | S | S | * | * | trans | -66.1 | 82.9 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L18 | L18-G20 PolarHBondContact O-N 3.47Š| ||
| 21 | R | 45.2 | Very low | 48.3 | Very low | 234 Ų | 234 | 116.6 Ų | 116.6 | 88% | 0.883 | 72% | 0.724 | S | S | * | * | trans | -123.5 | 105.6 | 163 | -86.8 | -175.9 | 159.6 | -175 | -5.4 | 109.3 | S19 L23 | S19-R21 VanDerWaalsContact C-N 3.3Å; S19-R21 PolarHBondContact O-N 2.91Å; R21-L23 PolarHBondContact O-N 2.74Å; R21-L23 VanDerWaalsContact O-N 3.15Å | ||
| 22 | P | 46.2 | Very low | 48.5 | Very low | 128 Ų | 128 | 122.9 Ų | 122.9 | 83% | 0.831 | 74% | 0.743 | S | S | * | * | trans | -69.2 | 112.8 | 170 | 28 | -29.1 | 0 | 0 | 0 | 107.8 | G24 | P22-G24 PolarHBondContact O-N 3.49Å; P22-G24 VanDerWaalsContact O-N 3.08Å | ||
| 23 | L | 44.8 | Very low | 48.8 | Very low | 175 Ų | 175 | 125.6 Ų | 125.6 | 92% | 0.916 | 75% | 0.754 | S | S | * | * | trans | -65.9 | 106.8 | 166.1 | -150.1 | 91.1 | 0 | 0 | 0 | 106.4 | R21 T25 | R21-L23 PolarHBondContact O-N 2.74Å; R21-L23 VanDerWaalsContact O-N 3.15Å; L23-T25 PolarHBondContact O-N 2.88Å | ||
| 24 | G | 42.7 | Very low | 48.8 | Very low | 71 Ų | 71 | 127 Ų | 127 | 73% | 0.732 | 76% | 0.762 | S | S | * | * | trans | -52 | 124.6 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | P22 | P22-G24 PolarHBondContact O-N 3.49Å; P22-G24 VanDerWaalsContact O-N 3.08Å | ||
| 25 | T | 43.8 | Very low | 49.2 | Very low | 129 Ų | 129 | 136.1 Ų | 136.1 | 79% | 0.791 | 78% | 0.784 | S | S | * | * | trans | -55.1 | 142.5 | 166.6 | 32 | 0 | 0 | 0 | 0 | 112.2 | L23 | L23-T25 PolarHBondContact O-N 2.88Š| ||
| 26 | R | 43.1 | Very low | 49.5 | Very low | 228 Ų | 228 | 134.3 Ų | 134.3 | 86% | 0.86 | 79% | 0.785 | S | S | * | * | trans | 72.7 | 101.2 | 148 | -80.6 | 177.2 | 163 | -105.1 | 0.7 | 117.5 | G28 | R26-G28 PolarHBondContact O-N 3.28Å; R26-G28 VanDerWaalsContact O-N 3.1Å | ||
| 27 | L | 51.7 | Low | 49.6 | Very low | 167 Ų | 167 | 140.7 Ų | 140.7 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | -3.7 | 99.5 | 117.4 | -107.6 | 101.1 | 0 | 0 | 0 | 113.3 | |||||
| 28 | G | 44.5 | Very low | 49.7 | Very low | 74 Ų | 74 | 142.5 Ų | 142.5 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | -100.8 | 98.9 | 159.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | R26 G30 | R26-G28 PolarHBondContact O-N 3.28Å; R26-G28 VanDerWaalsContact O-N 3.1Å; G28-G30 PolarHBondContact O-N 3.27Å | ||
| 29 | F | 49.3 | Very low | 50 | Low | 216 Ų | 216 | 144.2 Ų | 144.2 | 95% | 0.947 | 81% | 0.807 | S | S | * | * | trans | -74.4 | 99.9 | 168 | -169.9 | -92 | 0 | 0 | 0 | 107.4 | ||||
| 30 | G | 51.7 | Low | 50.4 | Low | 77 Ų | 77 | 145 Ų | 145 | 79% | 0.794 | 82% | 0.818 | S | S | * | * | trans | 175.9 | 99.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | G28 | G28-G30 PolarHBondContact O-N 3.27Š| ||
| 31 | G | 54.8 | Low | 51.1 | Low | 66 Ų | 66 | 146 Ų | 146 | 68% | 0.68 | 82% | 0.819 | S | S | * | * | trans | 143.7 | 39.7 | 169 | 0 | 0 | 0 | 0 | 0 | 115.9 | L33 | G31-L33 PolarHBondContact O-N 3.23Š| ||
| 32 | F | 55.2 | Low | 52 | Low | 198 Ų | 198 | 138.2 Ų | 138.2 | 87% | 0.868 | 81% | 0.805 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | 0.5 | 176.6 | -172.5 | -106.7 | 0 | 0 | 0 | 113.9 | ||
| 33 | L | 57.4 | Low | 52.7 | Low | 155 Ų | 155 | 137.5 Ų | 137.5 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -137.6 | 47.7 | -172.6 | -63.3 | 176 | 0 | 0 | 0 | 114.7 | G31 | G31-L33 PolarHBondContact O-N 3.23Š|
| 34 | T | 50.2 | Low | 53.7 | Low | 128 Ų | 128 | 134.3 Ų | 134.3 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | -126.5 | 95.1 | 157.5 | 50.1 | 0 | 0 | 0 | 0 | 109.2 | G36 | T34-G36 PolarHBondContact O-N 3.03Š| ||
| 35 | R | 54.2 | Low | 54.7 | Low | 254 Ų | 254 | 141.1 Ų | 141.1 | 96% | 0.958 | 79% | 0.791 | S | S | * | * | trans | -64.9 | 82 | 169 | -173 | 177.3 | -175.7 | 171.4 | 0.8 | 108.7 | ||||
| 36 | G | 55.2 | Low | 55.4 | Low | 61 Ų | 61 | 141.9 Ų | 141.9 | 63% | 0.629 | 79% | 0.786 | S | S | * | * | trans | -85.2 | 128.7 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.3 | T34 | T34-G36 PolarHBondContact O-N 3.03Š| ||
| 37 | F | 53.3 | Low | 56.2 | Low | 197 Ų | 197 | 136.3 Ų | 136.3 | 86% | 0.864 | 78% | 0.782 | S | S | * | * | trans | -50.2 | 131.6 | 170.6 | -73.5 | -95.3 | 0 | 0 | 0 | 109.6 | K39 | F37-K39 PolarHBondContact O-N 3.33Š| ||
| 38 | P | 51.7 | Low | 56.6 | Low | 124 Ų | 124 | 131.1 Ų | 131.1 | 81% | 0.805 | 77% | 0.768 | S | S | * | * | trans | -66.9 | 93.2 | 170.3 | 28.5 | -31.6 | 0 | 0 | 0 | 106.8 | A40 | P38-A40 PolarHBondContact O-N 3.4Š| ||
| 39 | K | 54.5 | Low | 57.1 | Low | 195 Ų | 195 | 134.9 Ų | 134.9 | 85% | 0.848 | 77% | 0.771 | S | S | * | * | trans | -55.5 | 115.8 | 162.6 | -174.7 | 167.4 | -176.3 | 165.6 | 0 | 104.2 | F37 A41 | F37-K39 PolarHBondContact O-N 3.33Å; K39-A41 PolarHBondContact O-N 3.09Å | ||
| 40 | A | 61 | Low | 57.8 | Low | 97 Ų | 97 | 130.4 Ų | 130.4 | 80% | 0.802 | 75% | 0.753 | S | S | * | * | trans | -56.6 | 90.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | P38 A42 | P38-A40 PolarHBondContact O-N 3.4Å; A40-A42 PolarHBondContact O-N 3.08Å | ||
| 41 | A | 62.6 | Low | 58.8 | Low | 91 Ų | 91 | 129.7 Ų | 129.7 | 75% | 0.752 | 75% | 0.746 | S | S | * | * | trans | -73.4 | 86.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 103.9 | K39 | K39-A41 PolarHBondContact O-N 3.09Š| ||
| 42 | A | 64.6 | Low | 59.6 | Low | 71 Ų | 71 | 136 Ų | 136 | 59% | 0.587 | 75% | 0.754 | S | S | * | * | trans | -45.4 | 129.3 | 163.3 | 0 | 0 | 0 | 0 | 0 | 106.4 | A40 V44 | A40-A42 PolarHBondContact O-N 3.08Å; A42-V44 VanDerWaalsContact C-N 3.29Å; A42-V44 PolarHBondContact O-N 3.12Å | ||
| 43 | P | 61.4 | Low | 60.5 | Low | 114 Ų | 114 | 135.7 Ų | 135.7 | 74% | 0.74 | 75% | 0.747 | S | S | * | * | trans | -60 | 100 | 177.3 | 23.3 | -31.6 | 0 | 0 | 0 | 107.2 | R45 | P43-R45 VanDerWaalsContact C-N 3.34Å; P43-R45 PolarHBondContact O-N 3.08Å | ||
| 44 | V | 64.7 | Low | 61.7 | Low | 107 Ų | 107 | 135.1 Ų | 135.1 | 65% | 0.648 | 74% | 0.744 | S | S | * | * | trans | -65 | 103.8 | 173.1 | 173.3 | 0 | 0 | 0 | 0 | 104.5 | A42 H46 | A42-V44 VanDerWaalsContact C-N 3.29Å; A42-V44 PolarHBondContact O-N 3.12Å; V44-H46 VanDerWaalsContact C-N 3.35Å; V44-H46 PolarHBondContact O-CD2 2.88Å; V44-H46 PolarHBondContact O-N 3.49Å | ||
| 45 | R | 63.8 | Low | 63.4 | Low | 215 Ų | 215 | 138 Ų | 138 | 81% | 0.811 | 75% | 0.746 | S | S | * | * | trans | -67.6 | 97.9 | 178.6 | -65.8 | -169.3 | 175.9 | -162.6 | -0.3 | 107.4 | P43 S47 | P43-R45 VanDerWaalsContact C-N 3.34Å; P43-R45 PolarHBondContact O-N 3.08Å; R45-S47 PolarHBondContact O-N 3.3Å | ||
| 46 | H | 59 | Low | 65 | Low | 145 Ų | 145 | 130.3 Ų | 130.3 | 67% | 0.671 | 73% | 0.727 | S | S | * | * | trans | -73 | 37.4 | 164.1 | -63.2 | -75.2 | 0 | 0 | 0 | 111.1 | V44 G48 | V44-H46 VanDerWaalsContact C-N 3.35Å; V44-H46 PolarHBondContact O-CD2 2.88Å; V44-H46 PolarHBondContact O-N 3.49Å; H46-G48 PolarHBondContact O-N 3.21Å | ||
| 47 | S | 58.6 | Low | 66.5 | Low | 111 Ų | 111 | 134.6 Ų | 134.6 | 78% | 0.776 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | 11.7 | 176.4 | 49.7 | 0 | 0 | 0 | 0 | 113 | R45 | R45-S47 PolarHBondContact O-N 3.3Š|
| 48 | G | 60.6 | Low | 68.2 | Low | 57 Ų | 57 | 133.8 Ų | 133.8 | 59% | 0.588 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.5 | 48.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | H46 H50 | H46-G48 PolarHBondContact O-N 3.21Å; G48-H50 PolarHBondContact O-N 3.32Å |
| 49 | D | 55.2 | Low | 70 | Confident | 154 Ų | 154 | 133.3 Ų | 133.3 | 82% | 0.824 | 72% | 0.722 | S | S | * | * | trans | -68.4 | 27.2 | 168.3 | -111.7 | -36 | 0 | 0 | 0 | 112.8 | ||||
| 50 | H | 63.9 | Low | 71.8 | Confident | 121 Ų | 121 | 128 Ų | 128 | 56% | 0.56 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -118.7 | 111.5 | 166.5 | -127.5 | 85.9 | 0 | 0 | 0 | 105.9 | G48 R53 | G48-H50 PolarHBondContact O-N 3.32Å; H50-R53 PolarHBondContact CD2-NE 2.97Å; H50-R53 PolarHBondContact CD2-NH2 3.21Å; H50-R53 PolarHBondContact CE1-NH2 3.26Å; H50-R53 PolarHBondContact ND1-NH2 2.91Å; H50-R53 PolarHBondContact NE2-NE 3.34Å; H50-R53 PolarHBondContact NE2-NH2 2.87Å |
| 51 | G | 72.6 | Confident | 73.3 | Confident | 63 Ų | 63 | 129.8 Ų | 129.8 | 65% | 0.649 | 70% | 0.696 | S | S | * | * | trans | -47.6 | 153.7 | 175 | 0 | 0 | 0 | 0 | 0 | 111.5 | R53 | G51-R53 WeakPolarHBondContact O-CG 3.42Å; G51-R53 PolarHBondContact O-N 2.82Å | ||
| 52 | K | 71.8 | Confident | 74.8 | Confident | 198 Ų | 198 | 131.6 Ų | 131.6 | 86% | 0.861 | 69% | 0.687 | S | S | * | * | trans | -28.9 | 90 | 175.2 | 45.5 | -173.8 | 173.4 | -172.6 | 0 | 112.8 | L54 | K52-L54 PolarHBondContact O-N 3.25Å; K52-L54 VanDerWaalsContact O-N 3.12Å | ||
| 53 | R | 73.5 | Confident | 76.3 | Confident | 191 Ų | 191 | 134.7 Ų | 134.7 | 72% | 0.721 | 68% | 0.684 | S | S | * | * | trans | -72.4 | 107 | -179.2 | -68 | -174.1 | -172.8 | -161.9 | -6.9 | 107.4 | H50 G51 | H50-R53 PolarHBondContact CD2-NE 2.97Å; H50-R53 PolarHBondContact CD2-NH2 3.21Å; H50-R53 PolarHBondContact CE1-NH2 3.26Å; H50-R53 PolarHBondContact ND1-NH2 2.91Å; H50-R53 PolarHBondContact NE2-NE 3.34Å; H50-R53 PolarHBondContact NE2-NH2 2.87Å; G51-R53 WeakPolarHBondContact O-CG 3.42Å; G51-R53 PolarHBondContact O-N 2.82Å | ||
| 54 | L | 84.4 | Confident | 77.9 | Confident | 143 Ų | 143 | 134 Ų | 134 | 75% | 0.749 | 68% | 0.675 | S | S | * | * | trans | -76 | 141.5 | 175.2 | -60.3 | 174.9 | 0 | 0 | 0 | 109.5 | K52 V56 | K52-L54 PolarHBondContact O-N 3.25Å; K52-L54 VanDerWaalsContact O-N 3.12Å; L54-V56 PolarHBondContact O-N 2.98Å | ||
| 55 | F | 85.5 | Confident | 79.4 | Confident | 189 Ų | 189 | 135.6 Ų | 135.6 | 83% | 0.829 | 67% | 0.669 | S | S | * | * | trans | -70.8 | 102.2 | 170 | -176.3 | -100.9 | 0 | 0 | 0 | 108.7 | I57 | F55-I57 HydrophobicContact CD1-CG1 4.08Å; F55-I57 HydrophobicContact CE1-CG1 4.13Å; F55-I57 PolarHBondContact O-N 3.44Å | ||
| 56 | V | 87.1 | Confident | 81 | Confident | 92 Ų | 92 | 131.3 Ų | 131.3 | 56% | 0.558 | 65% | 0.652 | S | S | * | * | trans | -78.3 | 110.5 | 176.6 | -175.8 | 0 | 0 | 0 | 0 | 108.2 | L54 R58 | L54-V56 PolarHBondContact O-N 2.98Å; V56-R58 HydrophobicContact CB-CG 4.42Å; V56-R58 HydrophobicContact CG1-CG 3.78Å; V56-R58 PolarHBondContact O-N 3.49Å | ||
| 57 | I | 86.8 | Confident | 82.8 | Confident | 152 Ų | 152 | 130.7 Ų | 130.7 | 78% | 0.779 | 65% | 0.648 | S | S | * | * | trans | -65.6 | 109.3 | 173.2 | -57.1 | 173.1 | 0 | 0 | 0 | 107.4 | F55 | F55-I57 HydrophobicContact CD1-CG1 4.08Å; F55-I57 HydrophobicContact CE1-CG1 4.13Å; F55-I57 PolarHBondContact O-N 3.44Å | ||
| 58 | R | 88.7 | Confident | 84.6 | Confident | 180 Ų | 180 | 129.8 Ų | 129.8 | 68% | 0.679 | 63% | 0.634 | S | S | * | * | trans | -117.5 | 147.8 | 175.7 | -64.9 | -147 | -170.8 | -164.5 | 6.3 | 110 | V56 | V56-R58 HydrophobicContact CB-CG 4.42Å; V56-R58 HydrophobicContact CG1-CG 3.78Å; V56-R58 PolarHBondContact O-N 3.49Å | ||
| 59 | P | 90.8 | Very high | 86.3 | Confident | 113 Ų | 113 | 134.5 Ų | 134.5 | 73% | 0.734 | 64% | 0.638 | S | S | * | * | trans | -62.5 | 155 | 171 | 28.7 | -35.4 | 0 | 0 | 0 | 110.5 | R61 | P59-R61 PolarHBondContact O-N 3.47Å; P59-R61 VanDerWaalsContact O-N 3.1Å | ||
| 60 | S | 91.8 | Very high | 88.4 | Confident | 83 Ų | 83 | 131 Ų | 131 | 58% | 0.58 | 62% | 0.62 | S | S | * | * | trans | -65.7 | 113.2 | -178.9 | 81.9 | 0 | 0 | 0 | 0 | 110.4 | F62 | S60-F62 VanDerWaalsContact C-N 3.26Š| ||
| 61 | R | 92.1 | Very high | 90 | Very high | 136 Ų | 136 | 129 Ų | 129 | 51% | 0.513 | 61% | 0.613 | S | S | . | * | trans | -89.4 | 7.5 | 175.8 | -61.3 | -173.8 | 70.6 | -176.2 | 5.7 | 113 | P59 R65 | P59-R61 PolarHBondContact O-N 3.47Å; P59-R61 VanDerWaalsContact O-N 3.1Å; R61-R65 WeakPolarHBondContact O-CB 3.46Å; R61-R65 WeakPolarHBondContact O-CD 3.45Å; R61-R65 WeakPolarHBondContact O-CG 3.32Å; R61-R65 PolarHBondContact O-N 3.32Å | ||
| 62 | F | 94.4 | Very high | 91.1 | Very high | 128 Ų | 128 | 135.2 Ų | 135.2 | 56% | 0.561 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -68.9 | -48.6 | -172.9 | 176.3 | -102 | 0 | 0 | 0 | 111.2 | S60 R65 R66 | S60-F62 VanDerWaalsContact C-N 3.26Å; F62-R65 PolarHBondContact O-N 3.01Å; F62-R66 VanDerWaalsContact O-CB 3.28Å; F62-R66 WeakPolarHBondContact O-CB 3.34Å; F62-R66 PolarHBondContact O-N 2.99Å |
| 63 | Y | 95.3 | Very high | 92.3 | Very high | 136 Ų | 136 | 131.7 Ų | 131.7 | 53% | 0.533 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -65.7 | -45.3 | -176.7 | -66.5 | -73.9 | 0 | 0 | 0 | 112.3 | R65 R66 F67 | Y63-R65 VanDerWaalsContact C-N 3.34Å; Y63-R65 PolarHBondContact O-N 3.48Å; Y63-R66 PolarHBondContact O-N 3.21Å; Y63-F67 WeakPolarHBondContact O-CB 3.25Å; Y63-F67 PolarHBondContact O-N 3.38Å |
| 64 | D | 94.9 | Very high | 93.4 | Very high | 101 Ų | 101 | 129.7 Ų | 129.7 | 54% | 0.54 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -59.1 | -46.4 | 177.5 | -50.1 | -27.7 | 0 | 0 | 0 | 111.5 | R66 F67 L68 | D64-R66 PolarHBondContact O-N 3.48Å; D64-F67 PolarHBondContact O-N 3Å; D64-L68 WeakPolarHBondContact O-CG 3.48Å; D64-L68 PolarHBondContact O-N 3.25Å |
| 65 | R | 96.1 | Very high | 94 | Very high | 140 Ų | 140 | 127.9 Ų | 127.9 | 53% | 0.528 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.5 | -39.3 | 179 | -70.9 | 177.2 | -178.1 | -166 | 0.8 | 111.5 | R61 F62 Y63 K69 | R61-R65 WeakPolarHBondContact O-CB 3.46Å; R61-R65 WeakPolarHBondContact O-CD 3.45Å; R61-R65 WeakPolarHBondContact O-CG 3.32Å; R61-R65 PolarHBondContact O-N 3.32Å; F62-R65 PolarHBondContact O-N 3.01Å; Y63-R65 VanDerWaalsContact C-N 3.34Å; Y63-R65 PolarHBondContact O-N 3.48Å; R65-K69 WeakPolarHBondContact O-CB 3.26Å; R65-K69 WeakPolarHBondContact O-CG 3.46Å; R65-K69 PolarHBondContact O-N 3.41Å; R65-K69 VanDerWaalsContact O-N 3.08Å |
| 66 | R | 97.2 | Very high | 94.5 | Very high | 124 Ų | 124 | 120.8 Ų | 120.8 | 47% | 0.468 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.6 | -44.5 | 177.3 | -173.4 | 179.6 | 70.2 | 164.8 | 3.1 | 110.9 | F62 Y63 D64 K69 L70 | F62-R66 VanDerWaalsContact O-CB 3.28Å; F62-R66 WeakPolarHBondContact O-CB 3.34Å; F62-R66 PolarHBondContact O-N 2.99Å; Y63-R66 PolarHBondContact O-N 3.21Å; D64-R66 PolarHBondContact O-N 3.48Å; R66-K69 PolarHBondContact O-N 3.32Å; R66-L70 HydrophobicContact CG-CD1 4.06Å; R66-L70 WeakPolarHBondContact O-CG 3.28Å; R66-L70 PolarHBondContact O-N 2.94Å |
| 67 | F | 97.3 | Very high | 95 | Very high | 132 Ų | 132 | 121.3 Ų | 121.3 | 58% | 0.579 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -59.9 | -50 | 177.5 | 176.2 | -104.9 | 0 | 0 | 0 | 111.6 | Y63 D64 K69 L70 L71 | Y63-F67 WeakPolarHBondContact O-CB 3.25Å; Y63-F67 PolarHBondContact O-N 3.38Å; D64-F67 PolarHBondContact O-N 3Å; F67-K69 VanDerWaalsContact C-N 3.28Å; F67-K69 PolarHBondContact O-N 3.32Å; F67-L70 PolarHBondContact O-N 3.43Å; F67-L71 HydrophobicContact CE1-CD2 4.36Å; F67-L71 WeakPolarHBondContact O-CB 3.5Å; F67-L71 PolarHBondContact O-N 3.43Å |
| 68 | L | 96.9 | Very high | 95.4 | Very high | 93 Ų | 93 | 118.3 Ų | 118.3 | 49% | 0.487 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.5 | -33.8 | 178.7 | -68.2 | 174.1 | 0 | 0 | 0 | 112.8 | D64 R72 | D64-L68 WeakPolarHBondContact O-CG 3.48Å; D64-L68 PolarHBondContact O-N 3.25Å; L68-R72 WeakPolarHBondContact O-CB 2.91Å; L68-R72 WeakPolarHBondContact O-CG 3.36Å; L68-R72 PolarHBondContact O-N 3.49Å |
| 69 | K | 97.1 | Very high | 95.8 | Very high | 155 Ų | 155 | 111.4 Ų | 111.4 | 67% | 0.674 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.2 | -46.2 | 173.7 | -77.2 | 175.8 | 180 | -171.5 | 0 | 111.7 | R65 R66 F67 F73 | R65-K69 WeakPolarHBondContact O-CB 3.26Å; R65-K69 WeakPolarHBondContact O-CG 3.46Å; R65-K69 PolarHBondContact O-N 3.41Å; R65-K69 VanDerWaalsContact O-N 3.08Å; R66-K69 PolarHBondContact O-N 3.32Å; F67-K69 VanDerWaalsContact C-N 3.28Å; F67-K69 PolarHBondContact O-N 3.32Å; K69-F73 VanDerWaalsContact O-CB 3.29Å; K69-F73 WeakPolarHBondContact O-CB 3.48Å; K69-F73 PolarHBondContact O-N 2.94Å |
| 70 | L | 97.7 | Very high | 96.1 | Very high | 82 Ų | 82 | 110.9 Ų | 110.9 | 43% | 0.429 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.8 | -47.1 | 177.8 | -71.9 | 166.6 | 0 | 0 | 0 | 111 | R66 F67 R72 F73 Y74 | R66-L70 HydrophobicContact CG-CD1 4.06Å; R66-L70 WeakPolarHBondContact O-CG 3.28Å; R66-L70 PolarHBondContact O-N 2.94Å; F67-L70 PolarHBondContact O-N 3.43Å; L70-R72 PolarHBondContact O-N 3.07Å; L70-F73 WeakPolarHBondContact O-CB 3.29Å; L70-F73 PolarHBondContact O-N 3.04Å; L70-F73 VanDerWaalsContact O-N 3.1Å; L70-Y74 HydrophobicContact CB-CE2 4.45Å; L70-Y74 HydrophobicContact CD2-CE2 4.34Å; L70-Y74 WeakPolarHBondContact O-CD2 3.32Å; L70-Y74 PolarHBondContact O-N 2.91Å |
| 71 | L | 97.3 | Very high | 96.3 | Very high | 79 Ų | 79 | 110.2 Ų | 110.2 | 41% | 0.414 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -55.6 | -50.8 | 177 | -177.7 | 63.9 | 0 | 0 | 0 | 111.7 | F67 F73 Y74 I75 | F67-L71 HydrophobicContact CE1-CD2 4.36Å; F67-L71 WeakPolarHBondContact O-CB 3.5Å; F67-L71 PolarHBondContact O-N 3.43Å; L71-F73 VanDerWaalsContact C-N 3.3Å; L71-F73 PolarHBondContact O-N 3.46Å; L71-Y74 PolarHBondContact O-N 2.79Å; L71-I75 HydrophobicContact CD1-CD1 3.99Å; L71-I75 HydrophobicContact CG-CD1 3.94Å; L71-I75 VanDerWaalsContact O-CG1 3.3Å; L71-I75 WeakPolarHBondContact O-CG1 3.39Å; L71-I75 PolarHBondContact O-N 3.45Å |
| 72 | R | 96.9 | Very high | 96.5 | Very high | 193 Ų | 193 | 107.7 Ų | 107.7 | 73% | 0.728 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -62.2 | -38 | 176.6 | -78 | 178.4 | 176.5 | 178.6 | -1.3 | 112.2 | L68 L70 A76 | L68-R72 WeakPolarHBondContact O-CB 2.91Å; L68-R72 WeakPolarHBondContact O-CG 3.36Å; L68-R72 PolarHBondContact O-N 3.49Å; L70-R72 PolarHBondContact O-N 3.07Å; R72-A76 WeakPolarHBondContact O-CB 3.31Å; R72-A76 PolarHBondContact O-N 3.23Å |
| 73 | F | 97.4 | Very high | 96.5 | Very high | 123 Ų | 123 | 104 Ų | 104 | 54% | 0.539 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.2 | -49.1 | 178.3 | 176.4 | -101.4 | 0 | 0 | 0 | 111.6 | K69 L70 L71 I75 A76 L77 | K69-F73 VanDerWaalsContact O-CB 3.29Å; K69-F73 WeakPolarHBondContact O-CB 3.48Å; K69-F73 PolarHBondContact O-N 2.94Å; L70-F73 WeakPolarHBondContact O-CB 3.29Å; L70-F73 PolarHBondContact O-N 3.04Å; L70-F73 VanDerWaalsContact O-N 3.1Å; L71-F73 VanDerWaalsContact C-N 3.3Å; L71-F73 PolarHBondContact O-N 3.46Å; F73-I75 PolarHBondContact O-N 3.15Å; F73-A76 PolarHBondContact O-N 2.94Å; F73-L77 VanDerWaalsContact O-CB 3.29Å; F73-L77 WeakPolarHBondContact O-CB 3.4Å; F73-L77 PolarHBondContact O-N 2.67Å |
| 74 | Y | 96.4 | Very high | 96.5 | Very high | 149 Ų | 149 | 101.7 Ų | 101.7 | 58% | 0.584 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -67.8 | -36 | 179.7 | -72.9 | -71.2 | 0 | 0 | 0 | 113.2 | L70 L71 | L70-Y74 HydrophobicContact CB-CE2 4.45Å; L70-Y74 HydrophobicContact CD2-CE2 4.34Å; L70-Y74 WeakPolarHBondContact O-CD2 3.32Å; L70-Y74 PolarHBondContact O-N 2.91Å; L71-Y74 PolarHBondContact O-N 2.79Å |
| 75 | I | 97.2 | Very high | 96.4 | Very high | 105 Ų | 105 | 103.6 Ų | 103.6 | 54% | 0.538 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -67 | -45.4 | 173.5 | -66.2 | 168.5 | 0 | 0 | 0 | 110.4 | L71 F73 L77 G79 | L71-I75 HydrophobicContact CD1-CD1 3.99Å; L71-I75 HydrophobicContact CG-CD1 3.94Å; L71-I75 VanDerWaalsContact O-CG1 3.3Å; L71-I75 WeakPolarHBondContact O-CG1 3.39Å; L71-I75 PolarHBondContact O-N 3.45Å; F73-I75 PolarHBondContact O-N 3.15Å; I75-L77 VanDerWaalsContact C-N 3.32Å; I75-L77 PolarHBondContact O-N 2.94Å; I75-G79 WeakPolarHBondContact O-CA 3.13Å; I75-G79 PolarHBondContact O-N 3.43Å |
| 76 | A | 96.5 | Very high | 96.1 | Very high | 40 Ų | 40 | 99.8 Ų | 99.8 | 33% | 0.331 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.6 | -33.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | R72 F73 T78 G79 I80 | R72-A76 WeakPolarHBondContact O-CB 3.31Å; R72-A76 PolarHBondContact O-N 3.23Å; F73-A76 PolarHBondContact O-N 2.94Å; A76-T78 VanDerWaalsContact C-N 3.26Å; A76-T78 PolarHBondContact O-N 3.38Å; A76-G79 PolarHBondContact O-N 3.05Å; A76-I80 HydrophobicContact CB-CD1 4.14Å; A76-I80 WeakPolarHBondContact O-CB 3.19Å; A76-I80 VanDerWaalsContact O-CG1 3.28Å; A76-I80 WeakPolarHBondContact O-CG1 3.2Å; A76-I80 PolarHBondContact O-N 2.99Å |
| 77 | L | 96.6 | Very high | 95.7 | Very high | 104 Ų | 104 | 97.7 Ų | 97.7 | 55% | 0.545 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -56.4 | -40.2 | 179.9 | -176.2 | 67.2 | 0 | 0 | 0 | 112.2 | F73 I75 P81 | F73-L77 VanDerWaalsContact O-CB 3.29Å; F73-L77 WeakPolarHBondContact O-CB 3.4Å; F73-L77 PolarHBondContact O-N 2.67Å; I75-L77 VanDerWaalsContact C-N 3.32Å; I75-L77 PolarHBondContact O-N 2.94Å; L77-P81 WeakPolarHBondContact O-CD 3.47Å; L77-P81 WeakPolarHBondContact O-CG 3.27Å |
| 78 | T | 95.4 | Very high | 95.5 | Very high | 89 Ų | 89 | 95.4 Ų | 95.4 | 55% | 0.546 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -99.7 | -31.1 | 177.7 | 54.5 | 0 | 0 | 0 | 0 | 112.5 | A76 P81 V82 | A76-T78 VanDerWaalsContact C-N 3.26Å; A76-T78 PolarHBondContact O-N 3.38Å; T78-P81 VanDerWaalsContact O-CD 3.29Å; T78-P81 WeakPolarHBondContact O-CD 3.36Å; T78-P81 VanDerWaalsContact O-CG 3.29Å; T78-P81 WeakPolarHBondContact O-CG 3.47Å; T78-V82 WeakPolarHBondContact O-CB 3.41Å; T78-V82 WeakPolarHBondContact O-CG2 3.38Å; T78-V82 PolarHBondContact O-N 3.28Å; T78-V82 VanDerWaalsContact O-N 3.15Å |
| 79 | G | 96.9 | Very high | 95.1 | Very high | 35 Ų | 35 | 93.4 Ų | 93.4 | 36% | 0.361 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.5 | -40.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | I75 A76 A83 | I75-G79 WeakPolarHBondContact O-CA 3.13Å; I75-G79 PolarHBondContact O-N 3.43Å; A76-G79 PolarHBondContact O-N 3.05Å; G79-A83 VanDerWaalsContact O-CB 3.3Å; G79-A83 WeakPolarHBondContact O-CB 3.34Å; G79-A83 PolarHBondContact O-N 3.33Å |
| 80 | I | 96.1 | Very high | 94.6 | Very high | 102 Ų | 102 | 89.7 Ų | 89.7 | 52% | 0.523 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.2 | -53.5 | 177.9 | -64.2 | 168.3 | 0 | 0 | 0 | 111.7 | A76 V82 A83 I84 | A76-I80 HydrophobicContact CB-CD1 4.14Å; A76-I80 WeakPolarHBondContact O-CB 3.19Å; A76-I80 VanDerWaalsContact O-CG1 3.28Å; A76-I80 WeakPolarHBondContact O-CG1 3.2Å; A76-I80 PolarHBondContact O-N 2.99Å; I80-V82 VanDerWaalsContact C-N 3.31Å; I80-V82 PolarHBondContact O-N 2.88Å; I80-A83 PolarHBondContact O-N 2.84Å; I80-I84 HydrophobicContact CG2-CD1 3.77Å; I80-I84 HydrophobicContact CG2-CG1 4.43Å; I80-I84 WeakPolarHBondContact O-CG1 3.25Å; I80-I84 PolarHBondContact O-N 3.19Å |
| 81 | P | 96.3 | Very high | 94.2 | Very high | 69 Ų | 69 | 91 Ų | 91 | 45% | 0.448 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.7 | -35.7 | 179.8 | 22 | -31.9 | 0 | 0 | 0 | 112.7 | L77 T78 I84 F85 | L77-P81 WeakPolarHBondContact O-CD 3.47Å; L77-P81 WeakPolarHBondContact O-CG 3.27Å; T78-P81 VanDerWaalsContact O-CD 3.29Å; T78-P81 WeakPolarHBondContact O-CD 3.36Å; T78-P81 VanDerWaalsContact O-CG 3.29Å; T78-P81 WeakPolarHBondContact O-CG 3.47Å; P81-I84 PolarHBondContact O-N 3.05Å; P81-F85 WeakPolarHBondContact O-CB 3.47Å; P81-F85 PolarHBondContact O-N 3.42Å |
| 82 | V | 95.9 | Very high | 93.8 | Very high | 83 Ų | 83 | 95 Ų | 95 | 50% | 0.503 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.1 | -45 | 174.2 | 170.3 | 0 | 0 | 0 | 0 | 111.4 | T78 I80 I84 F85 I86 | T78-V82 WeakPolarHBondContact O-CB 3.41Å; T78-V82 WeakPolarHBondContact O-CG2 3.38Å; T78-V82 PolarHBondContact O-N 3.28Å; T78-V82 VanDerWaalsContact O-N 3.15Å; I80-V82 VanDerWaalsContact C-N 3.31Å; I80-V82 PolarHBondContact O-N 2.88Å; V82-I84 PolarHBondContact O-N 2.86Å; V82-F85 PolarHBondContact O-N 2.85Å; V82-I86 HydrophobicContact CG1-CD1 3.77Å; V82-I86 HydrophobicContact CG1-CG1 4.49Å; V82-I86 WeakPolarHBondContact O-CD1 3.3Å; V82-I86 VanDerWaalsContact O-CG1 3.25Å; V82-I86 WeakPolarHBondContact O-CG1 3.49Å; V82-I86 PolarHBondContact O-N 3.01Å |
| 83 | A | 94.4 | Very high | 93.2 | Very high | 51 Ų | 51 | 92.2 Ų | 92.2 | 42% | 0.421 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | G79 I80 I86 T87 | G79-A83 VanDerWaalsContact O-CB 3.3Å; G79-A83 WeakPolarHBondContact O-CB 3.34Å; G79-A83 PolarHBondContact O-N 3.33Å; I80-A83 PolarHBondContact O-N 2.84Å; A83-I86 PolarHBondContact O-N 2.84Å; A83-T87 WeakPolarHBondContact O-CG2 3.37Å; A83-T87 PolarHBondContact O-N 3.29Å; A83-T87 PolarHBondContact O-OG1 2.81Å |
| 84 | I | 95.3 | Very high | 92.1 | Very high | 87 Ų | 87 | 88 Ų | 88 | 45% | 0.446 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -60.1 | -50.1 | 175.5 | -67.4 | 168.4 | 0 | 0 | 0 | 110 | I80 P81 V82 I86 T87 L88 | I80-I84 HydrophobicContact CG2-CD1 3.77Å; I80-I84 HydrophobicContact CG2-CG1 4.43Å; I80-I84 WeakPolarHBondContact O-CG1 3.25Å; I80-I84 PolarHBondContact O-N 3.19Å; P81-I84 PolarHBondContact O-N 3.05Å; V82-I84 PolarHBondContact O-N 2.86Å; I84-I86 VanDerWaalsContact C-N 3.32Å; I84-I86 PolarHBondContact O-N 3.32Å; I84-T87 WeakPolarHBondContact CA-OG1 3.29Å; I84-T87 PolarHBondContact O-N 2.97Å; I84-T87 PolarHBondContact O-OG1 3.2Å; I84-L88 HydrophobicContact CG2-CD1 3.71Å; I84-L88 HydrophobicContact CG2-CG 4.06Å; I84-L88 VanDerWaalsContact O-CG 3.31Å; I84-L88 WeakPolarHBondContact O-CG 3.24Å; I84-L88 PolarHBondContact O-N 3.41Å |
| 85 | F | 93.4 | Very high | 91 | Very high | 141 Ų | 141 | 85.8 Ų | 85.8 | 62% | 0.618 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -55.1 | -47.2 | 179.9 | -178.6 | -98.5 | 0 | 0 | 0 | 112.1 | P81 V82 T87 L88 V89 | P81-F85 WeakPolarHBondContact O-CB 3.47Å; P81-F85 PolarHBondContact O-N 3.42Å; V82-F85 PolarHBondContact O-N 2.85Å; F85-T87 VanDerWaalsContact C-N 3.34Å; F85-T87 PolarHBondContact O-N 3.41Å; F85-L88 PolarHBondContact O-N 2.95Å; F85-V89 HydrophobicContact CD1-CG2 4.25Å; F85-V89 HydrophobicContact CE1-CG2 3.85Å; F85-V89 HydrophobicContact CE2-CG2 4.32Å; F85-V89 HydrophobicContact CZ-CG2 3.89Å; F85-V89 WeakPolarHBondContact O-CG2 3.34Å; F85-V89 PolarHBondContact O-N 2.91Å |
| 86 | I | 90.2 | Very high | 90 | Very high | 59 Ų | 59 | 83.3 Ų | 83.3 | 30% | 0.303 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60.7 | -43.8 | 176.5 | -67.2 | 165 | 0 | 0 | 0 | 111.1 | V82 A83 I84 L88 N90 A118 | V82-I86 HydrophobicContact CG1-CD1 3.77Å; V82-I86 HydrophobicContact CG1-CG1 4.49Å; V82-I86 WeakPolarHBondContact O-CD1 3.3Å; V82-I86 VanDerWaalsContact O-CG1 3.25Å; V82-I86 WeakPolarHBondContact O-CG1 3.49Å; V82-I86 PolarHBondContact O-N 3.01Å; A83-I86 PolarHBondContact O-N 2.84Å; I84-I86 VanDerWaalsContact C-N 3.32Å; I84-I86 PolarHBondContact O-N 3.32Å; I86-L88 VanDerWaalsContact C-N 3.34Å; I86-N90 WeakPolarHBondContact O-CB 3.28Å; I86-N90 PolarHBondContact O-N 3.1Å; I86-A118 HydrophobicContact CD1-CB 4.45Å; I86-A118 HydrophobicContact CG2-CB 3.54Å |
| 87 | T | 89.6 | Confident | 88.7 | Confident | 80 Ų | 80 | 90.1 Ų | 90.1 | 49% | 0.491 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.7 | -38.6 | 178.2 | 56.1 | 0 | 0 | 0 | 0 | 112.2 | A83 I84 F85 N90 V91 | A83-T87 WeakPolarHBondContact O-CG2 3.37Å; A83-T87 PolarHBondContact O-N 3.29Å; A83-T87 PolarHBondContact O-OG1 2.81Å; I84-T87 WeakPolarHBondContact CA-OG1 3.29Å; I84-T87 PolarHBondContact O-N 2.97Å; I84-T87 PolarHBondContact O-OG1 3.2Å; F85-T87 VanDerWaalsContact C-N 3.34Å; F85-T87 PolarHBondContact O-N 3.41Å; T87-N90 PolarHBondContact O-N 3.42Å; T87-V91 WeakPolarHBondContact O-CB 3.35Å; T87-V91 VanDerWaalsContact O-CG2 3.28Å; T87-V91 WeakPolarHBondContact O-CG2 3.36Å; T87-V91 PolarHBondContact O-N 3.3Å |
| 88 | L | 91.4 | Very high | 87.7 | Confident | 84 Ų | 84 | 93.7 Ų | 93.7 | 44% | 0.44 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.6 | -48 | 177.9 | -66.1 | 172.2 | 0 | 0 | 0 | 110.9 | I84 F85 I86 N90 V91 F92 | I84-L88 HydrophobicContact CG2-CD1 3.71Å; I84-L88 HydrophobicContact CG2-CG 4.06Å; I84-L88 VanDerWaalsContact O-CG 3.31Å; I84-L88 WeakPolarHBondContact O-CG 3.24Å; I84-L88 PolarHBondContact O-N 3.41Å; F85-L88 PolarHBondContact O-N 2.95Å; I86-L88 VanDerWaalsContact C-N 3.34Å; L88-N90 VanDerWaalsContact C-N 3.25Å; L88-N90 PolarHBondContact O-N 3.42Å; L88-V91 PolarHBondContact O-N 3.5Å; L88-F92 HydrophobicContact CB-CD2 4.24Å; L88-F92 HydrophobicContact CD2-CD2 4.28Å; L88-F92 HydrophobicContact CD2-CE2 3.7Å; L88-F92 WeakPolarHBondContact O-CB 3.29Å; L88-F92 VanDerWaalsContact O-CD2 3.24Å; L88-F92 WeakPolarHBondContact O-CD2 3.3Å; L88-F92 PolarHBondContact O-N 3.4Å |
| 89 | V | 88.9 | Confident | 86.8 | Confident | 52 Ų | 52 | 93.3 Ų | 93.3 | 32% | 0.315 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -55.6 | -44.1 | 175 | 168 | 0 | 0 | 0 | 0 | 110.6 | F85 V91 I93 G94 | F85-V89 HydrophobicContact CD1-CG2 4.25Å; F85-V89 HydrophobicContact CE1-CG2 3.85Å; F85-V89 HydrophobicContact CE2-CG2 4.32Å; F85-V89 HydrophobicContact CZ-CG2 3.89Å; F85-V89 WeakPolarHBondContact O-CG2 3.34Å; F85-V89 PolarHBondContact O-N 2.91Å; V89-V91 PolarHBondContact O-N 3.08Å; V89-I93 HydrophobicContact CB-CD1 4.37Å; V89-I93 HydrophobicContact CG1-CD1 3.95Å; V89-I93 HydrophobicContact CG2-CD1 4.3Å; V89-I93 VanDerWaalsContact O-CB 3.31Å; V89-I93 WeakPolarHBondContact O-CB 3.31Å; V89-I93 PolarHBondContact O-N 2.88Å; V89-G94 PolarHBondContact O-N 3.32Å |
| 90 | N | 86.4 | Confident | 86 | Confident | 76 Ų | 76 | 100.7 Ų | 100.7 | 41% | 0.406 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -69.5 | -33.1 | -178.7 | -166.5 | 55.6 | 0 | 0 | 0 | 113.8 | I86 T87 L88 | I86-N90 WeakPolarHBondContact O-CB 3.28Å; I86-N90 PolarHBondContact O-N 3.1Å; T87-N90 PolarHBondContact O-N 3.42Å; L88-N90 VanDerWaalsContact C-N 3.25Å; L88-N90 PolarHBondContact O-N 3.42Å |
| 91 | V | 89.3 | Confident | 85.2 | Confident | 111 Ų | 111 | 100.4 Ų | 100.4 | 67% | 0.673 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -79.8 | -40.1 | 179.5 | 169.9 | 0 | 0 | 0 | 0 | 111.8 | T87 L88 V89 | T87-V91 WeakPolarHBondContact O-CB 3.35Å; T87-V91 VanDerWaalsContact O-CG2 3.28Å; T87-V91 WeakPolarHBondContact O-CG2 3.36Å; T87-V91 PolarHBondContact O-N 3.3Å; L88-V91 PolarHBondContact O-N 3.5Å; V89-V91 PolarHBondContact O-N 3.08Å |
| 92 | F | 88.4 | Confident | 84.7 | Confident | 163 Ų | 163 | 101.1 Ų | 101.1 | 72% | 0.715 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -92.6 | -37.3 | -173.1 | -68.7 | -66.9 | 0 | 0 | 0 | 114.2 | L88 | L88-F92 HydrophobicContact CB-CD2 4.24Å; L88-F92 HydrophobicContact CD2-CD2 4.28Å; L88-F92 HydrophobicContact CD2-CE2 3.7Å; L88-F92 WeakPolarHBondContact O-CB 3.29Å; L88-F92 VanDerWaalsContact O-CD2 3.24Å; L88-F92 WeakPolarHBondContact O-CD2 3.3Å; L88-F92 PolarHBondContact O-N 3.4Å |
| 93 | I | 84.6 | Confident | 83.9 | Confident | 134 Ų | 134 | 106.6 Ų | 106.6 | 69% | 0.687 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | -38.4 | -178.4 | -62.9 | 158.8 | 0 | 0 | 0 | 110.7 | V89 | V89-I93 HydrophobicContact CB-CD1 4.37Å; V89-I93 HydrophobicContact CG1-CD1 3.95Å; V89-I93 HydrophobicContact CG2-CD1 4.3Å; V89-I93 VanDerWaalsContact O-CB 3.31Å; V89-I93 WeakPolarHBondContact O-CB 3.31Å; V89-I93 PolarHBondContact O-N 2.88Å |
| 94 | G | 75.1 | Confident | 83.4 | Confident | 34 Ų | 34 | 108.2 Ų | 108.2 | 35% | 0.351 | 60% | 0.598 | S | S | . | * | trans | 73.7 | -176.4 | -177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | V89 | V89-G94 PolarHBondContact O-N 3.32Š| ||
| 95 | Q | 73.8 | Confident | 82.9 | Confident | 103 Ų | 103 | 109.4 Ų | 109.4 | 48% | 0.481 | 60% | 0.597 | S | S | . | * | P | Polyproline II helix | trans | -86.1 | 139.7 | 176 | -66.1 | -170.9 | -36.1 | 0 | 0 | 110.3 | E97 | Q95-E97 PolarHBondContact O-N 3.1Š|
| 96 | A | 74.6 | Confident | 82.6 | Confident | 52 Ų | 52 | 108.7 Ų | 108.7 | 43% | 0.43 | 60% | 0.604 | S | S | . | * | P | Polyproline II helix | trans | -64.8 | 133 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | K114 | A96-K114 HydrophobicContact CB-CG 4.34Å; A96-K114 WeakPolarHBondContact O-CE 3.38Å |
| 97 | E | 70 | Confident | 82.4 | Confident | 184 Ų | 184 | 106.9 Ų | 106.9 | 86% | 0.86 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -86.5 | 143.1 | 171.3 | -67.1 | -172.4 | 165.7 | 0 | 0 | 110 | Q95 A99 | Q95-E97 PolarHBondContact O-N 3.1Å; E97-A99 PolarHBondContact O-N 3.05Å |
| 98 | L | 76.4 | Confident | 82.2 | Confident | 178 Ų | 178 | 107.9 Ų | 107.9 | 93% | 0.932 | 60% | 0.595 | S | S | * | * | trans | -79.1 | 110.5 | 176.3 | -175.1 | 67.3 | 0 | 0 | 0 | 107.9 | ||||
| 99 | A | 77 | Confident | 82 | Confident | 81 Ų | 81 | 110.1 Ų | 110.1 | 67% | 0.669 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -103.8 | 149.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110 | E97 | E97-A99 PolarHBondContact O-N 3.05Š|
| 100 | E | 78.3 | Confident | 81.8 | Confident | 190 Ų | 190 | 115.1 Ų | 115.1 | 89% | 0.888 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 141.7 | 171.9 | -68.1 | 176.8 | -178.2 | 0 | 0 | 109.8 | P102 | E100-P102 WeakPolarHBondContact O-CD 3.11Š|
| 101 | I | 81.1 | Confident | 81.5 | Confident | 96 Ų | 96 | 115 Ų | 115 | 49% | 0.492 | 61% | 0.614 | S | S | . | * | P | Polyproline II helix | trans | -67.3 | 121.9 | -179.3 | -59.5 | 169.7 | 0 | 0 | 0 | 107.6 | Y105 P107 | I101-Y105 WeakPolarHBondContact CG2-O 3.29Å; I101-P107 HydrophobicContact CD1-CG 4.08Å; I101-P107 HydrophobicContact CG1-CG 4.16Å; I101-P107 HydrophobicContact CG2-CG 4.06Å |
| 102 | P | 84.4 | Confident | 81.2 | Confident | 85 Ų | 85 | 116.7 Ų | 116.7 | 55% | 0.552 | 61% | 0.609 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 144.1 | 178 | 26.4 | -31.2 | 0 | 0 | 0 | 110.8 | E100 G104 Y105 | E100-P102 WeakPolarHBondContact O-CD 3.11Å; P102-G104 PolarHBondContact O-N 3.3Å; P102-Y105 PolarHBondContact O-N 3.06Å; P102-Y105 VanDerWaalsContact O-N 3.17Å |
| 103 | E | 78.9 | Confident | 80.7 | Confident | 198 Ų | 198 | 117.3 Ų | 117.3 | 93% | 0.925 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.3 | 124.5 | -177.9 | -66.4 | -66.2 | 171.9 | 0 | 0 | 111.4 | ||
| 104 | G | 84.9 | Confident | 80.2 | Confident | 85 Ų | 85 | 116.7 Ų | 116.7 | 88% | 0.876 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 89.3 | 4.5 | 180 | 0 | 0 | 0 | 0 | 0 | 115.9 | P102 | P102-G104 PolarHBondContact O-N 3.3Š|
| 105 | Y | 84.3 | Confident | 79.7 | Confident | 112 Ų | 112 | 117.4 Ų | 117.4 | 44% | 0.439 | 61% | 0.607 | S | S | . | * | trans | -104.5 | 131 | 171.5 | -174 | -112 | 0 | 0 | 0 | 111.6 | I101 P102 P107 E111 | I101-Y105 WeakPolarHBondContact CG2-O 3.29Å; P102-Y105 PolarHBondContact O-N 3.06Å; P102-Y105 VanDerWaalsContact O-N 3.17Å; Y105-P107 HydrophobicContact CD1-CG 4.32Å; Y105-P107 HydrophobicContact CE1-CB 4.28Å; Y105-P107 HydrophobicContact CE1-CG 4.43Å; Y105-E111 WeakPolarHBondContact CE1-OE2 3.32Å; Y105-E111 PolarHBondContact OH-OE1 3.38Å; Y105-E111 VanDerWaalsContact OH-OE1 3.1Å; Y105-E111 PolarHBondContact OH-OE2 3.12Å | ||
| 106 | V | 86.4 | Confident | 79 | Confident | 125 Ų | 125 | 118.8 Ų | 118.8 | 76% | 0.758 | 61% | 0.612 | S | S | * | * | trans | -102.2 | 110.1 | 171.8 | -179.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 107 | P | 87.1 | Confident | 78.1 | Confident | 21 Ų | 21 | 117.1 Ų | 117.1 | 14% | 0.136 | 60% | 0.599 | C | S | . | * | trans | -64.4 | 146.3 | -179.3 | -18 | 29.6 | 0 | 0 | 0 | 111.9 | I101 Y105 E111 Y112 | I101-P107 HydrophobicContact CD1-CG 4.08Å; I101-P107 HydrophobicContact CG1-CG 4.16Å; I101-P107 HydrophobicContact CG2-CG 4.06Å; Y105-P107 HydrophobicContact CD1-CG 4.32Å; Y105-P107 HydrophobicContact CE1-CB 4.28Å; Y105-P107 HydrophobicContact CE1-CG 4.43Å; P107-E111 HydrophobicContact CB-CB 4.27Å; P107-E111 WeakPolarHBondContact CB-OE2 3.36Å; P107-Y112 HydrophobicContact CB-CE1 4.34Å; P107-Y112 HydrophobicContact CB-CE2 4.18Å; P107-Y112 HydrophobicContact CG-CE1 4.31Å | ||
| 108 | E | 84.7 | Confident | 77.3 | Confident | 101 Ų | 101 | 110.9 Ų | 110.9 | 47% | 0.472 | 58% | 0.58 | S | S | . | * | trans | -70.5 | 152.5 | 169.1 | -76.8 | -66.3 | 164 | 0 | 0 | 111.5 | W110 E111 | E108-W110 HydrophobicContact CB-CZ2 4.31Å; E108-W110 PolarHBondContact O-N 3.36Å; E108-E111 HydrophobicContact CB-CG 4.3Å; E108-E111 WeakPolarHBondContact O-CB 3.15Å; E108-E111 PolarHBondContact O-N 3.48Å | ||
| 109 | H | 86.7 | Confident | 76.2 | Confident | 132 Ų | 132 | 104.4 Ų | 104.4 | 61% | 0.611 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | -21.1 | -173.3 | 63.6 | -80.9 | 0 | 0 | 0 | 114.8 | Y113 | H109-Y113 VanDerWaalsContact O-CE2 3.29Å; H109-Y113 WeakPolarHBondContact O-CE2 3.19Å |
| 110 | W | 85.1 | Confident | 75.1 | Confident | 156 Ų | 156 | 101.2 Ų | 101.2 | 59% | 0.591 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.6 | -16.4 | 179.1 | 54.8 | -92.3 | 0 | 0 | 0 | 113.8 | E108 Y112 Y113 | E108-W110 HydrophobicContact CB-CZ2 4.31Å; E108-W110 PolarHBondContact O-N 3.36Å; W110-Y112 VanDerWaalsContact C-N 3.25Å; W110-Y112 PolarHBondContact O-N 3.42Å; W110-Y113 PolarHBondContact O-N 3.09Å |
| 111 | E | 81.6 | Confident | 74.2 | Confident | 74 Ų | 74 | 95.1 Ų | 95.1 | 35% | 0.346 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.1 | -21 | -179.8 | -66 | 176.8 | -165.9 | 0 | 0 | 112.3 | Y105 P107 E108 Y113 | Y105-E111 WeakPolarHBondContact CE1-OE2 3.32Å; Y105-E111 PolarHBondContact OH-OE1 3.38Å; Y105-E111 VanDerWaalsContact OH-OE1 3.1Å; Y105-E111 PolarHBondContact OH-OE2 3.12Å; P107-E111 HydrophobicContact CB-CB 4.27Å; P107-E111 WeakPolarHBondContact CB-OE2 3.36Å; E108-E111 HydrophobicContact CB-CG 4.3Å; E108-E111 WeakPolarHBondContact O-CB 3.15Å; E108-E111 PolarHBondContact O-N 3.48Å; E111-Y113 PolarHBondContact O-N 3.44Å |
| 112 | Y | 82 | Confident | 72.9 | Confident | 146 Ų | 146 | 98.8 Ų | 98.8 | 57% | 0.573 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.9 | -15.7 | 173.7 | -62.7 | -71 | 0 | 0 | 0 | 113.4 | P107 W110 | P107-Y112 HydrophobicContact CB-CE1 4.34Å; P107-Y112 HydrophobicContact CB-CE2 4.18Å; P107-Y112 HydrophobicContact CG-CE1 4.31Å; W110-Y112 VanDerWaalsContact C-N 3.25Å; W110-Y112 PolarHBondContact O-N 3.42Å |
| 113 | Y | 78.7 | Confident | 71.6 | Confident | 176 Ų | 176 | 99.9 Ų | 99.9 | 69% | 0.69 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -92.6 | 118.3 | -177.4 | -61.1 | -71.5 | 0 | 0 | 0 | 111.7 | H109 W110 E111 G115 | H109-Y113 VanDerWaalsContact O-CE2 3.29Å; H109-Y113 WeakPolarHBondContact O-CE2 3.19Å; W110-Y113 PolarHBondContact O-N 3.09Å; E111-Y113 PolarHBondContact O-N 3.44Å; Y113-G115 PolarHBondContact O-N 2.94Å |
| 114 | K | 72.7 | Confident | 70.7 | Confident | 121 Ų | 121 | 92.3 Ų | 92.3 | 53% | 0.526 | 49% | 0.489 | S | S | . | . | trans | -65.7 | 116.3 | 165.5 | -156.8 | -179.8 | -166.6 | -176.4 | 0 | 108.8 | A96 K116 | A96-K114 HydrophobicContact CB-CG 4.34Å; A96-K114 WeakPolarHBondContact O-CE 3.38Å; K114-K116 PolarHBondContact O-N 3.26Å | ||
| 115 | G | 65.5 | Low | 69.5 | Low | 49 Ų | 49 | 90.9 Ų | 90.9 | 51% | 0.505 | 47% | 0.469 | S | S | . | . | trans | -57.6 | 99.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y113 G117 | Y113-G115 PolarHBondContact O-N 2.94Å; G115-G117 PolarHBondContact O-N 3.2Å | ||
| 116 | K | 58.7 | Low | 68 | Low | 133 Ų | 133 | 88.7 Ų | 88.7 | 58% | 0.578 | 47% | 0.469 | S | S | * | . | trans | -85.3 | 93.4 | -179.1 | -77.2 | -169.2 | 170.6 | -167.7 | 0 | 110.3 | K114 S120 D124 | K114-K116 PolarHBondContact O-N 3.26Å; K116-S120 VanDerWaalsContact CD-OG 3.25Å; K116-S120 WeakPolarHBondContact CD-OG 3.29Å; K116-S120 VanDerWaalsContact CE-OG 3.28Å; K116-S120 WeakPolarHBondContact CE-OG 3.37Å; K116-S120 WeakPolarHBondContact CG-OG 3.35Å; K116-D124 IonicContact NZ-OD1 3.71Å; K116-D124 IonicContact NZ-OD2 2.74Å; K116-D124 PolarHBondContact NZ-OD2 3.44Å | ||
| 117 | G | 55.3 | Low | 66.7 | Low | 16 Ų | 16 | 88.7 Ų | 88.7 | 17% | 0.165 | 46% | 0.461 | C | S | . | . | trans | -60.6 | 154.2 | 161.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | G115 G119 S120 | G115-G117 PolarHBondContact O-N 3.2Å; G117-G119 PolarHBondContact O-N 3.1Å; G117-S120 PolarHBondContact O-N 3.47Å | ||
| 118 | A | 54.3 | Low | 65.5 | Low | 54 Ų | 54 | 95.5 Ų | 95.5 | 45% | 0.446 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -55.9 | -11.1 | -172.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | I86 | I86-A118 HydrophobicContact CD1-CB 4.45Å; I86-A118 HydrophobicContact CG2-CB 3.54Å |
| 119 | G | 52.8 | Low | 64.4 | Low | 42 Ų | 42 | 100.1 Ų | 100.1 | 43% | 0.433 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.7 | -33.2 | 168 | 0 | 0 | 0 | 0 | 0 | 113.8 | G117 A121 K122 I123 | G117-G119 PolarHBondContact O-N 3.1Å; G119-A121 PolarHBondContact O-N 3.14Å; G119-K122 PolarHBondContact O-N 2.81Å; G119-I123 WeakPolarHBondContact O-CG1 3.13Å; G119-I123 PolarHBondContact O-N 3.16Å |
| 120 | S | 54.7 | Low | 62.7 | Low | 14 Ų | 14 | 102 Ų | 102 | 10% | 0.098 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -66.2 | -37.8 | 178.8 | -171.5 | 0 | 0 | 0 | 0 | 111.9 | K116 G117 K122 I123 D124 | K116-S120 VanDerWaalsContact CD-OG 3.25Å; K116-S120 WeakPolarHBondContact CD-OG 3.29Å; K116-S120 VanDerWaalsContact CE-OG 3.28Å; K116-S120 WeakPolarHBondContact CE-OG 3.37Å; K116-S120 WeakPolarHBondContact CG-OG 3.35Å; G117-S120 PolarHBondContact O-N 3.47Å; S120-K122 VanDerWaalsContact C-N 3.3Å; S120-K122 PolarHBondContact O-N 3.19Å; S120-I123 PolarHBondContact O-N 2.74Å; S120-D124 WeakPolarHBondContact O-CB 3.28Å; S120-D124 PolarHBondContact O-N 3.41Å; S120-D124 VanDerWaalsContact O-OD2 3.13Å; S120-D124 PolarHBondContact OG-OD2 2.88Å |
| 121 | A | 57.8 | Low | 61.6 | Low | 62 Ų | 62 | 98.4 Ų | 98.4 | 51% | 0.512 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66 | -30.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113 | G119 A125 | G119-A121 PolarHBondContact O-N 3.14Å; A121-A125 WeakPolarHBondContact O-CB 3.42Å; A121-A125 PolarHBondContact O-N 2.85Å |
| 122 | K | 55.1 | Low | 60.7 | Low | 172 Ų | 172 | 101.2 Ų | 101.2 | 75% | 0.748 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -73.5 | -37.3 | 175.6 | -76.1 | -171.1 | -179.7 | 177.8 | 0 | 112.4 | G119 S120 C126 | G119-K122 PolarHBondContact O-N 2.81Å; S120-K122 VanDerWaalsContact C-N 3.3Å; S120-K122 PolarHBondContact O-N 3.19Å; K122-C126 VanDerWaalsContact O-CB 3.27Å; K122-C126 WeakPolarHBondContact O-CB 3.28Å; K122-C126 PolarHBondContact O-N 3Å |
| 123 | I | 57.4 | Low | 59.9 | Low | 109 Ų | 109 | 99.5 Ų | 99.5 | 56% | 0.559 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -67.6 | -48.7 | 176.2 | -56.7 | 166.6 | 0 | 0 | 0 | 108.7 | G119 S120 A125 C126 E127 | G119-I123 WeakPolarHBondContact O-CG1 3.13Å; G119-I123 PolarHBondContact O-N 3.16Å; S120-I123 PolarHBondContact O-N 2.74Å; I123-A125 VanDerWaalsContact C-N 3.32Å; I123-A125 PolarHBondContact O-N 3.09Å; I123-C126 PolarHBondContact O-N 3.03Å; I123-E127 VanDerWaalsContact O-CB 3.32Å; I123-E127 WeakPolarHBondContact O-CB 3.37Å; I123-E127 PolarHBondContact O-N 3.15Å |
| 124 | D | 58.6 | Low | 58.8 | Low | 38 Ų | 38 | 98.3 Ų | 98.3 | 20% | 0.203 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -63.3 | -32.4 | 178.1 | -65.4 | -31.4 | 0 | 0 | 0 | 113.3 | K116 S120 R128 | K116-D124 IonicContact NZ-OD1 3.71Å; K116-D124 IonicContact NZ-OD2 2.74Å; K116-D124 PolarHBondContact NZ-OD2 3.44Å; S120-D124 WeakPolarHBondContact O-CB 3.28Å; S120-D124 PolarHBondContact O-N 3.41Å; S120-D124 VanDerWaalsContact O-OD2 3.13Å; S120-D124 PolarHBondContact OG-OD2 2.88Å; D124-R128 VanDerWaalsContact O-CB 3.29Å; D124-R128 WeakPolarHBondContact O-CB 3.22Å; D124-R128 WeakPolarHBondContact O-CG 3.43Å; D124-R128 PolarHBondContact O-N 2.9Å; D124-R128 VanDerWaalsContact O-N 3.08Å; D124-R128 PolarHBondContact O-NE 3.34Å |
| 125 | A | 59.2 | Low | 58 | Low | 55 Ų | 55 | 102.3 Ų | 102.3 | 46% | 0.455 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -78.9 | -35.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A121 I123 R129 | A121-A125 WeakPolarHBondContact O-CB 3.42Å; A121-A125 PolarHBondContact O-N 2.85Å; I123-A125 VanDerWaalsContact C-N 3.32Å; I123-A125 PolarHBondContact O-N 3.09Å; A125-R129 WeakPolarHBondContact O-CB 3.4Å; A125-R129 PolarHBondContact O-N 3.08Å; A125-R129 VanDerWaalsContact O-N 3.12Å |
| 126 | C | 53.6 | Low | 57.6 | Low | 67 Ų | 67 | 105 Ų | 105 | 45% | 0.453 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.6 | -48.3 | 172.3 | -167.2 | 0 | 0 | 0 | 0 | 109.9 | K122 I123 R128 R129 W130 | K122-C126 VanDerWaalsContact O-CB 3.27Å; K122-C126 WeakPolarHBondContact O-CB 3.28Å; K122-C126 PolarHBondContact O-N 3Å; I123-C126 PolarHBondContact O-N 3.03Å; C126-R128 PolarHBondContact O-N 3.27Å; C126-R129 WeakPolarHBondContact O-CB 3.2Å; C126-R129 PolarHBondContact O-N 3.39Å; C126-R129 VanDerWaalsContact O-N 3.08Å; C126-W130 PolarHBondContact O-N 2.92Å; C126-W130 VanDerWaalsContact O-N 3.09Å |
| 127 | E | 59.4 | Low | 57.6 | Low | 124 Ų | 124 | 103.5 Ų | 103.5 | 58% | 0.579 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.1 | -39.9 | -179.4 | -167.8 | 164.2 | -172.6 | 0 | 0 | 112.8 | I123 R129 W130 T131 | I123-E127 VanDerWaalsContact O-CB 3.32Å; I123-E127 WeakPolarHBondContact O-CB 3.37Å; I123-E127 PolarHBondContact O-N 3.15Å; E127-R129 VanDerWaalsContact C-N 3.29Å; E127-R129 PolarHBondContact O-N 2.94Å; E127-W130 PolarHBondContact O-N 2.73Å; E127-T131 WeakPolarHBondContact O-CG2 3.45Å; E127-T131 PolarHBondContact O-N 2.88Å; E127-T131 PolarHBondContact O-OG1 3.01Å |
| 128 | R | 60.9 | Low | 57.7 | Low | 165 Ų | 165 | 108.3 Ų | 108.3 | 62% | 0.623 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64.7 | -30.9 | 170.9 | -80.7 | -171.4 | -81.1 | -158.5 | -3.1 | 113.8 | D124 C126 T131 L132 | D124-R128 VanDerWaalsContact O-CB 3.29Å; D124-R128 WeakPolarHBondContact O-CB 3.22Å; D124-R128 WeakPolarHBondContact O-CG 3.43Å; D124-R128 PolarHBondContact O-N 2.9Å; D124-R128 VanDerWaalsContact O-N 3.08Å; D124-R128 PolarHBondContact O-NE 3.34Å; C126-R128 PolarHBondContact O-N 3.27Å; R128-T131 VanDerWaalsContact CA-OG1 3.26Å; R128-T131 WeakPolarHBondContact CA-OG1 3.4Å; R128-T131 PolarHBondContact O-OG1 3.25Å; R128-T131 VanDerWaalsContact O-OG1 3.1Å; R128-L132 WeakPolarHBondContact O-CB 3.33Å; R128-L132 WeakPolarHBondContact O-CD1 3.43Å; R128-L132 WeakPolarHBondContact O-CG 3.42Å; R128-L132 PolarHBondContact O-N 2.76Å |
| 129 | R | 61.6 | Low | 57.9 | Low | 198 Ų | 198 | 111.5 Ų | 111.5 | 75% | 0.747 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -73.1 | -33.8 | 176.7 | -165.2 | 175.2 | -163 | -116.4 | 1.3 | 112.3 | A125 C126 E127 V133 | A125-R129 WeakPolarHBondContact O-CB 3.4Å; A125-R129 PolarHBondContact O-N 3.08Å; A125-R129 VanDerWaalsContact O-N 3.12Å; C126-R129 WeakPolarHBondContact O-CB 3.2Å; C126-R129 PolarHBondContact O-N 3.39Å; C126-R129 VanDerWaalsContact O-N 3.08Å; E127-R129 VanDerWaalsContact C-N 3.29Å; E127-R129 PolarHBondContact O-N 2.94Å; R129-V133 WeakPolarHBondContact O-CG2 3.48Å |
| 130 | W | 52.6 | Low | 58.2 | Low | 171 Ų | 171 | 115.9 Ų | 115.9 | 65% | 0.648 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -76.5 | -36.6 | 175.8 | -74.3 | 102.6 | 0 | 0 | 0 | 112.7 | C126 E127 V133 L134 | C126-W130 PolarHBondContact O-N 2.92Å; C126-W130 VanDerWaalsContact O-N 3.09Å; E127-W130 PolarHBondContact O-N 2.73Å; W130-V133 PolarHBondContact O-N 3.34Å; W130-L134 PolarHBondContact O-N 2.85Å |
| 131 | T | 62 | Low | 58.4 | Low | 80 Ų | 80 | 122.7 Ų | 122.7 | 49% | 0.491 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -68.5 | -34.4 | 176.8 | 45.2 | 0 | 0 | 0 | 0 | 113.4 | E127 R128 V133 L134 | E127-T131 WeakPolarHBondContact O-CG2 3.45Å; E127-T131 PolarHBondContact O-N 2.88Å; E127-T131 PolarHBondContact O-OG1 3.01Å; R128-T131 VanDerWaalsContact CA-OG1 3.26Å; R128-T131 WeakPolarHBondContact CA-OG1 3.4Å; R128-T131 PolarHBondContact O-OG1 3.25Å; R128-T131 VanDerWaalsContact O-OG1 3.1Å; T131-V133 VanDerWaalsContact C-N 3.29Å; T131-V133 PolarHBondContact O-N 3.1Å; T131-L134 PolarHBondContact O-N 2.65Å |
| 132 | L | 61.4 | Low | 58.5 | Low | 134 Ų | 134 | 127 Ų | 127 | 70% | 0.702 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | -15.7 | 173.6 | -74.1 | 169.4 | 0 | 0 | 0 | 114.4 | R128 | R128-L132 WeakPolarHBondContact O-CB 3.33Å; R128-L132 WeakPolarHBondContact O-CD1 3.43Å; R128-L132 WeakPolarHBondContact O-CG 3.42Å; R128-L132 PolarHBondContact O-N 2.76Å |
| 133 | V | 65.5 | Low | 58.8 | Low | 110 Ų | 110 | 123.5 Ų | 123.5 | 67% | 0.667 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.6 | -16.8 | 177.1 | 171.3 | 0 | 0 | 0 | 0 | 111.6 | R129 W130 T131 | R129-V133 WeakPolarHBondContact O-CG2 3.48Å; W130-V133 PolarHBondContact O-N 3.34Å; T131-V133 VanDerWaalsContact C-N 3.29Å; T131-V133 PolarHBondContact O-N 3.1Å |
| 134 | L | 55.4 | Low | 58.9 | Low | 150 Ų | 150 | 124.8 Ų | 124.8 | 79% | 0.785 | 62% | 0.619 | S | S | * | * | trans | -97.4 | 8.5 | -179.7 | -107.7 | 136.4 | 0 | 0 | 0 | 113.5 | W130 T131 | W130-L134 PolarHBondContact O-N 2.85Å; T131-L134 PolarHBondContact O-N 2.65Å | ||
| 135 | L | 56.1 | Low | 58.9 | Low | 205 Ų | 205 | 132.6 Ų | 132.6 | 100% | 1.073 | 66% | 0.657 | S | S | * | * | trans | -120.9 | 0 | 179.9 | -144.4 | 153.2 | 0 | 0 | 0 | 108.9 |
Retrieved 135 of 135 residues in 19.4 ms
(Link to these results)