| 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 | 37.2 | Very low | 45.3 | Very low | 239 Ų | 239 | 149.7 Ų | 149.7 | 100% | 1.177 | 86% | 0.856 | S | S | * | * | 0 | 135.8 | 0 | -72.6 | 162.2 | 67.9 | 0 | 0 | 108.4 | |||||
| 2 | S | 40.5 | Very low | 45.8 | Very low | 108 Ų | 108 | 152.7 Ų | 152.7 | 76% | 0.755 | 86% | 0.857 | S | S | * | * | trans | 60.4 | 107.4 | 163.1 | -76.5 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 3 | S | 43.6 | Very low | 46.4 | Very low | 115 Ų | 115 | 147.2 Ų | 147.2 | 80% | 0.804 | 84% | 0.835 | S | S | * | * | 70 | 123.1 | 67.9 | 75.6 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 4 | G | 40.5 | Very low | 47.1 | Very low | 77 Ų | 77 | 144.7 Ų | 144.7 | 79% | 0.794 | 83% | 0.827 | S | S | * | * | trans | 145.8 | 72.2 | 154.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 5 | G | 43.8 | Very low | 47.5 | Very low | 86 Ų | 86 | 143.7 Ų | 143.7 | 89% | 0.887 | 82% | 0.816 | S | S | * | * | trans | -68.2 | 133.3 | 156 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 6 | S | 49.8 | Very low | 47.4 | Very low | 113 Ų | 113 | 142.7 Ų | 142.7 | 79% | 0.79 | 81% | 0.808 | S | S | * | * | trans | -114.6 | 93.7 | 167.7 | -160.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 7 | R | 49.1 | Very low | 47.5 | Very low | 242 Ų | 242 | 143.9 Ų | 143.9 | 91% | 0.913 | 81% | 0.808 | S | S | * | * | trans | -76.3 | 119.8 | 158.2 | -83.6 | -178.1 | -170.8 | 172.8 | 3 | 107.1 | ||||
| 8 | F | 44.1 | Very low | 47.6 | Very low | 176 Ų | 176 | 145.1 Ų | 145.1 | 77% | 0.772 | 81% | 0.811 | S | S | * | * | trans | -123.6 | 96.2 | 157 | -115 | -94.5 | 0 | 0 | 0 | 110.1 | ||||
| 9 | K | 47.6 | Very low | 48 | Very low | 178 Ų | 178 | 145.1 Ų | 145.1 | 77% | 0.774 | 81% | 0.807 | S | S | * | * | trans | 45.3 | 91.3 | 142.4 | -59.1 | -176 | 179.7 | -85.3 | 0 | 117.5 | ||||
| 10 | Q | 46.3 | Very low | 48.3 | Very low | 190 Ų | 190 | 142.9 Ų | 142.9 | 89% | 0.888 | 80% | 0.798 | S | S | * | * | trans | -81.4 | 129.3 | 142.9 | -75.7 | 179.6 | -8 | 0 | 0 | 108.3 | E12 | Q10-E12 PolarHBondContact O-N 3.29Š| ||
| 11 | S | 55.3 | Low | 48.6 | Very low | 123 Ų | 123 | 145.3 Ų | 145.3 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | trans | -62.6 | 108.7 | 175.9 | 49 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 12 | E | 52.3 | Low | 49.1 | Very low | 185 Ų | 185 | 143.6 Ų | 143.6 | 86% | 0.864 | 78% | 0.783 | S | S | * | * | trans | -82.2 | 126.8 | 169.3 | -72.8 | -175.2 | 157.4 | 0 | 0 | 110.2 | Q10 | Q10-E12 PolarHBondContact O-N 3.29Š| ||
| 13 | S | 53 | Low | 49.4 | Very low | 82 Ų | 82 | 148.1 Ų | 148.1 | 57% | 0.573 | 79% | 0.792 | S | S | * | * | trans | -69.4 | 141.4 | 178.3 | -171.4 | 0 | 0 | 0 | 0 | 110.9 | I15 | S13-I15 PolarHBondContact O-N 2.86Š| ||
| 14 | P | 56.7 | Low | 49.7 | Very low | 112 Ų | 112 | 148.8 Ų | 148.8 | 73% | 0.727 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.5 | 10.3 | -170.6 | 25.1 | -33.7 | 0 | 0 | 0 | 116.4 | ||
| 15 | I | 52 | Low | 50.2 | Low | 129 Ų | 129 | 154.5 Ų | 154.5 | 66% | 0.662 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.8 | -23.2 | -176.7 | -61.9 | 177.3 | 0 | 0 | 0 | 112.3 | S13 M17 | S13-I15 PolarHBondContact O-N 2.86Å; I15-M17 PolarHBondContact O-N 3.4Å |
| 16 | N | 46.3 | Very low | 49.9 | Very low | 128 Ų | 128 | 156 Ų | 156 | 68% | 0.684 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | 0.4 | -175.4 | -79.9 | -6.8 | 0 | 0 | 0 | 115.4 | ||
| 17 | M | 49.3 | Very low | 49.5 | Very low | 163 Ų | 163 | 157.5 Ų | 157.5 | 80% | 0.803 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.9 | -6.5 | -177.7 | -145.9 | -170.4 | -46.3 | 0 | 0 | 113.9 | I15 | I15-M17 PolarHBondContact O-N 3.4Š|
| 18 | L | 49.5 | Very low | 49.5 | Very low | 166 Ų | 166 | 155 Ų | 155 | 87% | 0.869 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -99.2 | -1.6 | -173.5 | -141.9 | 73.8 | 0 | 0 | 0 | 114.5 | ||
| 19 | I | 54.4 | Low | 49.4 | Very low | 145 Ų | 145 | 156 Ų | 156 | 74% | 0.744 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -98.3 | -10.5 | -176.6 | -64.7 | 175.5 | 0 | 0 | 0 | 112.3 | ||
| 20 | T | 54.4 | Low | 49.5 | Very low | 101 Ų | 101 | 152.6 Ų | 152.6 | 62% | 0.62 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -120.7 | 60.9 | -166.5 | -35.7 | 0 | 0 | 0 | 0 | 113.2 | ||
| 21 | H | 53.9 | Low | 49.1 | Very low | 193 Ų | 193 | 151.2 Ų | 151.2 | 89% | 0.894 | 78% | 0.779 | S | S | * | * | trans | -178.7 | 89.8 | 147.6 | -92.6 | -64.3 | 0 | 0 | 0 | 110.9 | ||||
| 22 | R | 48.1 | Very low | 48.6 | Very low | 204 Ų | 204 | 150.6 Ų | 150.6 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | trans | -152.6 | 59.4 | 153.5 | -155.8 | 172.5 | -177 | 154.1 | -0.1 | 111.6 | M24 | R22-M24 HydrophobicContact CG-CE 4.35Å; R22-M24 HydrophobicContact CG-CG 4.11Å; R22-M24 HydrophobicContact CG-SD 4.43Å; R22-M24 PolarHBondContact O-N 3.39Å | ||
| 23 | E | 46.8 | Very low | 48.3 | Very low | 202 Ų | 202 | 146.7 Ų | 146.7 | 94% | 0.944 | 77% | 0.765 | S | S | * | * | trans | -73 | 96.5 | 155.1 | -72.8 | -160.7 | 149.6 | 0 | 0 | 108 | ||||
| 24 | M | 49.8 | Very low | 47.7 | Very low | 129 Ų | 129 | 150.8 Ų | 150.8 | 64% | 0.635 | 78% | 0.78 | S | S | * | * | trans | -95.7 | 107.4 | 163.5 | -78.6 | -174.7 | 176.9 | 0 | 0 | 108.3 | R22 C26 | R22-M24 HydrophobicContact CG-CE 4.35Å; R22-M24 HydrophobicContact CG-CG 4.11Å; R22-M24 HydrophobicContact CG-SD 4.43Å; R22-M24 PolarHBondContact O-N 3.39Å; M24-C26 PolarHBondContact O-N 3.17Å | ||
| 25 | K | 51.9 | Low | 47.5 | Very low | 198 Ų | 198 | 154.6 Ų | 154.6 | 86% | 0.861 | 79% | 0.785 | S | S | * | * | trans | -67.2 | 112.3 | 167.3 | -163.7 | 165.1 | -176.7 | 176.2 | 0 | 108 | ||||
| 26 | C | 38 | Very low | 47.3 | Very low | 116 Ų | 116 | 155.1 Ų | 155.1 | 78% | 0.784 | 79% | 0.794 | S | S | * | * | trans | -123.7 | 118.6 | 168.1 | -74.8 | 0 | 0 | 0 | 0 | 108.7 | M24 | M24-C26 PolarHBondContact O-N 3.17Š| ||
| 27 | D | 40.2 | Very low | 47.1 | Very low | 145 Ų | 145 | 154.6 Ų | 154.6 | 78% | 0.775 | 80% | 0.795 | S | S | * | * | trans | -55.9 | 135.4 | -176 | -69.7 | -70.4 | 0 | 0 | 0 | 114.1 | K29 | D27-K29 PolarHBondContact O-N 3.4Š| ||
| 28 | M | 49.2 | Very low | 47.1 | Very low | 191 Ų | 191 | 152 Ų | 152 | 94% | 0.941 | 79% | 0.791 | S | S | * | * | trans | -70 | 93.4 | 164.2 | -74.1 | -103.9 | 81.4 | 0 | 0 | 109.1 | ||||
| 29 | K | 43.5 | Very low | 46.9 | Very low | 195 Ų | 195 | 150.9 Ų | 150.9 | 85% | 0.848 | 79% | 0.79 | S | S | * | * | trans | -99.6 | 132.7 | 161.1 | -102 | 171.3 | 176.5 | 175.6 | 0 | 109.7 | D27 | D27-K29 PolarHBondContact O-N 3.4Š| ||
| 30 | S | 48.1 | Very low | 46.4 | Very low | 107 Ų | 107 | 151.3 Ų | 151.3 | 75% | 0.748 | 79% | 0.789 | S | S | * | * | trans | -67.3 | 140.3 | -177 | 47.7 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 31 | E | 38.1 | Very low | 46.4 | Very low | 161 Ų | 161 | 153.1 Ų | 153.1 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | trans | 71.1 | 153.5 | 151 | -77.2 | -104.5 | 123.2 | 0 | 0 | 119.6 | ||||
| 32 | P | 45.5 | Very low | 46.3 | Very low | 111 Ų | 111 | 153 Ų | 153 | 72% | 0.721 | 79% | 0.792 | S | S | * | * | cis | -129.6 | 164.5 | 19.6 | 37.7 | -19.1 | 0 | 0 | 0 | 116.8 | L34 | P32-L34 PolarHBondContact O-N 2.98Š| ||
| 33 | S | 45.6 | Very low | 46.3 | Very low | 102 Ų | 102 | 149.6 Ų | 149.6 | 71% | 0.713 | 79% | 0.789 | S | S | * | * | trans | -47.9 | 115.3 | 173.4 | -76.1 | 0 | 0 | 0 | 0 | 114.5 | K35 | S33-K35 PolarHBondContact O-N 3.15Š| ||
| 34 | L | 41.4 | Very low | 46.6 | Very low | 169 Ų | 169 | 145.7 Ų | 145.7 | 89% | 0.885 | 78% | 0.781 | S | S | * | * | trans | -76.8 | 107 | 161 | -79.2 | 168.4 | 0 | 0 | 0 | 108.8 | P32 V36 | P32-L34 PolarHBondContact O-N 2.98Å; L34-V36 PolarHBondContact O-N 3.09Å | ||
| 35 | K | 50.7 | Low | 46.5 | Very low | 192 Ų | 192 | 150.4 Ų | 150.4 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | trans | -62.3 | 117.3 | 166.4 | -67 | -175.5 | -179 | -173.4 | 0 | 108.2 | S33 V37 | S33-K35 PolarHBondContact O-N 3.15Å; K35-V37 PolarHBondContact O-N 3.34Å; K35-V37 VanDerWaalsContact O-N 3.08Å | ||
| 36 | V | 47.8 | Very low | 46.4 | Very low | 139 Ų | 139 | 149.7 Ų | 149.7 | 84% | 0.842 | 79% | 0.79 | S | S | * | * | trans | -62.3 | 107.7 | 169.9 | 178.4 | 0 | 0 | 0 | 0 | 107.8 | L34 | L34-V36 PolarHBondContact O-N 3.09Š| ||
| 37 | V | 44 | Very low | 46.9 | Very low | 118 Ų | 118 | 148.9 Ų | 148.9 | 72% | 0.715 | 79% | 0.786 | S | S | * | * | trans | -77.8 | 129.7 | 169.1 | -178.9 | 0 | 0 | 0 | 0 | 107.1 | K35 V39 | K35-V37 PolarHBondContact O-N 3.34Å; K35-V37 VanDerWaalsContact O-N 3.08Å; V37-V39 PolarHBondContact O-N 3.29Å | ||
| 38 | P | 49.4 | Very low | 47.5 | Very low | 109 Ų | 109 | 146.4 Ų | 146.4 | 71% | 0.708 | 78% | 0.778 | S | S | * | * | trans | -61.2 | 129.1 | 175.6 | -16 | 28.7 | 0 | 0 | 0 | 109.4 | E40 | P38-E40 VanDerWaalsContact C-N 3.34Å; P38-E40 PolarHBondContact O-N 3.03Å | ||
| 39 | V | 43.7 | Very low | 47.3 | Very low | 141 Ų | 141 | 144.2 Ų | 144.2 | 86% | 0.855 | 77% | 0.77 | S | S | * | * | trans | -66.4 | 98.5 | 168.9 | 170.2 | 0 | 0 | 0 | 0 | 107.1 | V37 T41 | V37-V39 PolarHBondContact O-N 3.29Å; V39-T41 PolarHBondContact O-N 3.39Å | ||
| 40 | E | 44.7 | Very low | 47.6 | Very low | 154 Ų | 154 | 138.3 Ų | 138.3 | 72% | 0.72 | 76% | 0.764 | S | S | * | * | trans | -73.4 | 111.7 | 173.4 | -161.7 | 175.3 | -172.5 | 0 | 0 | 107.9 | P38 R42 | P38-E40 VanDerWaalsContact C-N 3.34Å; P38-E40 PolarHBondContact O-N 3.03Å; E40-R42 VanDerWaalsContact C-N 3.31Å; E40-R42 PolarHBondContact O-N 3.27Å | ||
| 41 | T | 54.8 | Low | 47.6 | Very low | 139 Ų | 139 | 142 Ų | 142 | 85% | 0.853 | 77% | 0.767 | S | S | * | * | trans | -63.8 | 90.4 | 174.3 | -32.9 | 0 | 0 | 0 | 0 | 108.6 | V39 D43 | V39-T41 PolarHBondContact O-N 3.39Å; T41-D43 PolarHBondContact O-N 3.07Å | ||
| 42 | R | 51.1 | Low | 47.9 | Very low | 192 Ų | 192 | 143.2 Ų | 143.2 | 73% | 0.725 | 77% | 0.772 | S | S | * | * | trans | -77.4 | 106.9 | 175.5 | -82 | -167.4 | 159.8 | -175.8 | -5.2 | 110 | E40 | E40-R42 VanDerWaalsContact C-N 3.31Å; E40-R42 PolarHBondContact O-N 3.27Å | ||
| 43 | D | 47.2 | Very low | 47.7 | Very low | 131 Ų | 131 | 143.1 Ų | 143.1 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | -60.2 | 130.8 | 161.5 | -107.1 | -35.9 | 0 | 0 | 0 | 109.5 | T41 Y45 | T41-D43 PolarHBondContact O-N 3.07Å; D43-Y45 PolarHBondContact O-N 3.18Å | ||
| 44 | P | 55.2 | Low | 47.5 | Very low | 120 Ų | 120 | 146 Ų | 146 | 78% | 0.779 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | 0.7 | -176.8 | -20.6 | 31.3 | 0 | 0 | 0 | 115.8 | ||
| 45 | Y | 46.7 | Very low | 47.6 | Very low | 229 Ų | 229 | 142.4 Ų | 142.4 | 90% | 0.898 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.4 | 5.4 | -172.4 | -90 | -83.9 | 0 | 0 | 0 | 115.5 | D43 | D43-Y45 PolarHBondContact O-N 3.18Š|
| 46 | F | 49 | Very low | 47.4 | Very low | 182 Ų | 182 | 142.7 Ų | 142.7 | 80% | 0.798 | 78% | 0.783 | S | S | * | * | trans | -108.8 | 114.1 | 179.3 | -155.4 | -100.6 | 0 | 0 | 0 | 112.4 | ||||
| 47 | S | 48.2 | Very low | 46.9 | Very low | 99 Ų | 99 | 142.1 Ų | 142.1 | 69% | 0.692 | 78% | 0.782 | S | S | * | * | trans | -95.6 | 130.4 | 177.5 | -158 | 0 | 0 | 0 | 0 | 110.5 | N49 | S47-N49 VanDerWaalsContact C-N 3.29Å; S47-N49 PolarHBondContact O-N 3.26Å | ||
| 48 | P | 54.1 | Low | 46.8 | Very low | 93 Ų | 93 | 143.5 Ų | 143.5 | 60% | 0.604 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -76.3 | -4.9 | -167.3 | -14.9 | 30.4 | 0 | 0 | 0 | 116 | G50 | P48-G50 PolarHBondContact O-N 3.47Š|
| 49 | N | 44.6 | Very low | 46.4 | Very low | 146 Ų | 146 | 142.7 Ų | 142.7 | 78% | 0.781 | 79% | 0.793 | S | S | * | * | trans | -103.2 | 92.1 | -170.8 | -71.8 | -4 | 0 | 0 | 0 | 111.1 | S47 K51 | S47-N49 VanDerWaalsContact C-N 3.29Å; S47-N49 PolarHBondContact O-N 3.26Å; N49-K51 PolarHBondContact O-N 3.06Å | ||
| 50 | G | 50 | Low | 46.1 | Very low | 70 Ų | 70 | 140.5 Ų | 140.5 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | -62.9 | 111.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | P48 | P48-G50 PolarHBondContact O-N 3.47Š| ||
| 51 | K | 48.8 | Very low | 45.9 | Very low | 185 Ų | 185 | 140.8 Ų | 140.8 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -149 | 99.5 | 153 | -54.3 | -81.4 | -179.7 | 163.3 | 0 | 106.3 | N49 | N49-K51 PolarHBondContact O-N 3.06Š| ||
| 52 | H | 42.6 | Very low | 45.3 | Very low | 186 Ų | 186 | 143.6 Ų | 143.6 | 86% | 0.861 | 80% | 0.795 | S | S | * | * | trans | 167.4 | 102.6 | 148.3 | -81.7 | -50.7 | 0 | 0 | 0 | 107.6 | I54 | H52-I54 PolarHBondContact O-N 3.11Š| ||
| 53 | A | 43 | Very low | 44.6 | Very low | 110 Ų | 110 | 141.5 Ų | 141.5 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | trans | -70.1 | 120.9 | 170.2 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 54 | I | 40.3 | Very low | 44.4 | Very low | 161 Ų | 161 | 143.2 Ų | 143.2 | 83% | 0.826 | 81% | 0.806 | S | S | * | * | trans | -118.1 | 123.2 | 165.9 | -63.7 | 175.5 | 0 | 0 | 0 | 106.8 | H52 | H52-I54 PolarHBondContact O-N 3.11Š| ||
| 55 | A | 44.8 | Very low | 43.9 | Very low | 94 Ų | 94 | 145.6 Ų | 145.6 | 78% | 0.777 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 143.6 | -174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 56 | K | 44.7 | Very low | 44 | Very low | 199 Ų | 199 | 140.1 Ų | 140.1 | 87% | 0.865 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 133.8 | 169.6 | -80.2 | 177 | 173.4 | 177.7 | 0 | 110.7 | T58 | K56-T58 PolarHBondContact O-N 3.05Š|
| 57 | P | 39.1 | Very low | 43.4 | Very low | 127 Ų | 127 | 137.3 Ų | 137.3 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 118 | 159.3 | 27.3 | -23.9 | 0 | 0 | 0 | 109.2 | ||
| 58 | T | 41.4 | Very low | 42.8 | Very low | 146 Ų | 146 | 137.8 Ų | 137.8 | 90% | 0.896 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 124.3 | 167 | -146.3 | 0 | 0 | 0 | 0 | 107.9 | K56 | K56-T58 PolarHBondContact O-N 3.05Š|
| 59 | A | 40 | Very low | 41.8 | Very low | 93 Ų | 93 | 138.5 Ų | 138.5 | 77% | 0.769 | 81% | 0.812 | S | S | * | * | trans | -115 | 115.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | I61 | A59-I61 PolarHBondContact O-N 3.03Š| ||
| 60 | A | 38.4 | Very low | 41.9 | Very low | 95 Ų | 95 | 137 Ų | 137 | 79% | 0.785 | 81% | 0.81 | S | S | * | * | trans | -62.2 | 126.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | K62 | A60-K62 PolarHBondContact O-N 3.14Š| ||
| 61 | I | 40.8 | Very low | 41.1 | Very low | 160 Ų | 160 | 139.1 Ų | 139.1 | 82% | 0.821 | 81% | 0.814 | S | S | * | * | trans | -74.2 | 111 | 164.4 | -65.5 | 166.4 | 0 | 0 | 0 | 106.8 | A59 N63 | A59-I61 PolarHBondContact O-N 3.03Å; I61-N63 PolarHBondContact O-N 3.02Å | ||
| 62 | K | 41.8 | Very low | 40.4 | Very low | 197 Ų | 197 | 137 Ų | 137 | 86% | 0.857 | 82% | 0.816 | S | S | * | * | trans | -77.3 | 111.2 | 168.3 | -90.7 | -178.7 | 176.4 | -179.8 | 0 | 109.3 | A60 | A60-K62 PolarHBondContact O-N 3.14Š| ||
| 63 | N | 36.6 | Very low | 40.1 | Very low | 149 Ų | 149 | 134.2 Ų | 134.2 | 80% | 0.797 | 81% | 0.812 | S | S | * | * | trans | -49 | 130.1 | 161.7 | -91.2 | -46.6 | 0 | 0 | 0 | 112 | I61 | I61-N63 PolarHBondContact O-N 3.02Š| ||
| 64 | I | 41.6 | Very low | 40 | Very low | 167 Ų | 167 | 138 Ų | 138 | 86% | 0.856 | 81% | 0.811 | S | S | * | * | trans | -127.1 | 124 | 153.4 | -58.9 | 179.1 | 0 | 0 | 0 | 107.1 | ||||
| 65 | H | 45.5 | Very low | 40.5 | Very low | 170 Ų | 170 | 135.4 Ų | 135.4 | 79% | 0.787 | 80% | 0.804 | S | S | * | * | trans | -62.3 | 160 | -172.3 | -104.6 | -115.9 | 0 | 0 | 0 | 115 | ||||
| 66 | P | 49.1 | Very low | 40 | Very low | 114 Ų | 114 | 137.3 Ų | 137.3 | 74% | 0.74 | 81% | 0.807 | S | S | * | * | trans | -88.1 | 136.6 | 164.2 | 35.1 | -28 | 0 | 0 | 0 | 110.5 | ||||
| 67 | S | 35.9 | Very low | 39.6 | Very low | 123 Ų | 123 | 133.5 Ų | 133.5 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -130.6 | 127.5 | 163.2 | 75.7 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 68 | S | 36 | Very low | 39.3 | Very low | 108 Ų | 108 | 131.4 Ų | 131.4 | 76% | 0.755 | 81% | 0.806 | S | S | * | * | trans | -94.1 | 149.8 | -175.9 | -42.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 69 | S | 33.3 | Very low | 39.1 | Very low | 109 Ų | 109 | 132 Ų | 132 | 76% | 0.762 | 80% | 0.802 | S | S | * | * | trans | 85.3 | 161.3 | 142.3 | -54.5 | 0 | 0 | 0 | 0 | 120 | ||||
| 70 | P | 47.3 | Very low | 39.3 | Very low | 115 Ų | 115 | 132.9 Ų | 132.9 | 75% | 0.747 | 80% | 0.8 | S | S | * | * | cis | -141.9 | -179.8 | -43.9 | 39.2 | -21.5 | 0 | 0 | 0 | 115.3 | ||||
| 71 | S | 32.1 | Very low | 39.4 | Very low | 113 Ų | 113 | 134.1 Ų | 134.1 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | 74 | 127 | 154.2 | -75.5 | 0 | 0 | 0 | 0 | 122 | ||||
| 72 | V | 33.9 | Very low | 39.2 | Very low | 142 Ų | 142 | 134.7 Ų | 134.7 | 86% | 0.861 | 80% | 0.797 | S | S | * | * | -174.9 | 137.1 | 107.3 | 154.5 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 73 | V | 37.4 | Very low | 39.2 | Very low | 127 Ų | 127 | 133.8 Ų | 133.8 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -87.6 | 144.3 | 179.8 | 173.7 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 74 | Q | 39.3 | Very low | 39.1 | Very low | 190 Ų | 190 | 136.8 Ų | 136.8 | 89% | 0.888 | 80% | 0.796 | S | S | * | * | trans | -161.1 | 138.6 | 144.6 | -109.1 | 176.8 | 27.7 | 0 | 0 | 112.5 | ||||
| 75 | P | 51.3 | Low | 39.2 | Very low | 105 Ų | 105 | 134.8 Ų | 134.8 | 68% | 0.682 | 79% | 0.794 | S | S | * | * | trans | -109.4 | 155.8 | 175.5 | 38.3 | -28.3 | 0 | 0 | 0 | 113 | ||||
| 76 | T | 34.1 | Very low | 38.9 | Very low | 135 Ų | 135 | 131.3 Ų | 131.3 | 83% | 0.828 | 79% | 0.794 | S | S | * | * | trans | 172.1 | 107.6 | 148.7 | 35.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 77 | S | 37 | Very low | 38.3 | Very low | 118 Ų | 118 | 131.1 Ų | 131.1 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | 76.8 | 118.9 | 97.6 | 72.2 | 0 | 0 | 0 | 0 | 116.9 | |||||
| 78 | G | 32.8 | Very low | 38.8 | Very low | 83 Ų | 83 | 133.5 Ų | 133.5 | 86% | 0.856 | 79% | 0.793 | S | S | * | * | trans | 144.5 | 103.1 | 155.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 79 | I | 37.2 | Very low | 38.8 | Very low | 159 Ų | 159 | 136.7 Ų | 136.7 | 82% | 0.815 | 80% | 0.801 | S | S | * | * | trans | -104.2 | 151.1 | 165.1 | -67.2 | 173.4 | 0 | 0 | 0 | 105.7 | ||||
| 80 | P | 44.9 | Very low | 39.2 | Very low | 112 Ų | 112 | 139.1 Ų | 139.1 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | cis | -149.5 | 157.5 | 49.5 | 26.4 | 0.9 | 0 | 0 | 0 | 121.1 | ||||
| 81 | V | 39.8 | Very low | 39 | Very low | 121 Ų | 121 | 137.7 Ų | 137.7 | 73% | 0.733 | 80% | 0.801 | S | S | * | * | trans | 37.1 | 120 | 131.6 | -169.6 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 82 | Q | 35.7 | Very low | 39.7 | Very low | 172 Ų | 172 | 138 Ų | 138 | 80% | 0.804 | 80% | 0.801 | S | S | * | * | trans | -148.5 | 102.7 | 142.6 | -169.5 | 83.4 | 48.4 | 0 | 0 | 110.9 | ||||
| 83 | Q | 41.8 | Very low | 40 | Very low | 177 Ų | 177 | 138.2 Ų | 138.2 | 83% | 0.827 | 80% | 0.797 | S | S | * | * | trans | -75.9 | 137.3 | 161.5 | -106.6 | 169.5 | -22 | 0 | 0 | 109.7 | ||||
| 84 | R | 35.4 | Very low | 40.6 | Very low | 212 Ų | 212 | 137.4 Ų | 137.4 | 80% | 0.8 | 80% | 0.795 | S | S | * | * | trans | -147.1 | 128 | 154.5 | -171.2 | -177.1 | -67.9 | -166.1 | 0.3 | 109.6 | ||||
| 85 | P | 42.5 | Very low | 41 | Very low | 125 Ų | 125 | 137.1 Ų | 137.1 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | trans | -82.2 | 122.9 | 173.4 | 32 | -28.2 | 0 | 0 | 0 | 108.9 | ||||
| 86 | A | 40.5 | Very low | 40.7 | Very low | 97 Ų | 97 | 137.1 Ų | 137.1 | 80% | 0.802 | 79% | 0.79 | S | S | * | * | trans | -104.7 | 113.4 | 168.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 87 | S | 36.6 | Very low | 41.2 | Very low | 111 Ų | 111 | 136.4 Ų | 136.4 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -58.6 | 154.4 | 176.6 | 32.2 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 88 | H | 46.6 | Very low | 41.1 | Very low | 172 Ų | 172 | 140.8 Ų | 140.8 | 80% | 0.796 | 79% | 0.786 | S | S | * | * | trans | -52.5 | 128.3 | 179.7 | -47.1 | -44.1 | 0 | 0 | 0 | 113.9 | ||||
| 89 | L | 35.5 | Very low | 41.9 | Very low | 175 Ų | 175 | 142.4 Ų | 142.4 | 92% | 0.916 | 78% | 0.779 | S | S | * | * | trans | -134 | 98.7 | 148.4 | -75.2 | 173.7 | 0 | 0 | 0 | 107.1 | A91 | L89-A91 PolarHBondContact O-N 3.32Š| ||
| 90 | I | 40.8 | Very low | 42.2 | Very low | 161 Ų | 161 | 141 Ų | 141 | 83% | 0.826 | 78% | 0.777 | S | S | * | * | trans | -72.7 | 105.1 | 170.3 | -68.8 | 158.9 | 0 | 0 | 0 | 106.1 | ||||
| 91 | A | 44.6 | Very low | 41.9 | Very low | 84 Ų | 84 | 140.8 Ų | 140.8 | 69% | 0.694 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -67 | 132.7 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | L89 N93 | L89-A91 PolarHBondContact O-N 3.32Å; A91-N93 PolarHBondContact O-N 3.27Å |
| 92 | P | 45.2 | Very low | 42.2 | Very low | 121 Ų | 121 | 144.8 Ų | 144.8 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -65 | 122 | 172.7 | 25.2 | -29.8 | 0 | 0 | 0 | 108.9 | P94 | P92-P94 WeakPolarHBondContact O-CD 3.4Š|
| 93 | N | 41.7 | Very low | 42.5 | Very low | 146 Ų | 146 | 142.6 Ų | 142.6 | 78% | 0.781 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -50 | 119.1 | 175.2 | -171.5 | 21.8 | 0 | 0 | 0 | 110.5 | A91 K95 | A91-N93 PolarHBondContact O-N 3.27Å; N93-K95 PolarHBondContact O-N 3.34Å |
| 94 | P | 48.7 | Very low | 42.4 | Very low | 110 Ų | 110 | 137.5 Ų | 137.5 | 71% | 0.714 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 127.3 | 173.1 | 26.5 | -29.9 | 0 | 0 | 0 | 109.1 | P92 | P92-P94 WeakPolarHBondContact O-CD 3.4Š|
| 95 | K | 49.2 | Very low | 42.8 | Very low | 184 Ų | 184 | 133.5 Ų | 133.5 | 80% | 0.8 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 141.2 | 175.9 | -63 | 175.8 | -179.7 | 177 | 0 | 109.9 | N93 V97 | N93-K95 PolarHBondContact O-N 3.34Å; K95-V97 PolarHBondContact O-N 2.97Å |
| 96 | P | 45.1 | Very low | 43.3 | Very low | 104 Ų | 104 | 134 Ų | 134 | 68% | 0.675 | 77% | 0.772 | S | S | * | * | trans | -63 | 110.2 | 175.2 | 25.7 | -31.5 | 0 | 0 | 0 | 108.9 | Y98 | P96-Y98 PolarHBondContact O-N 2.84Š| ||
| 97 | V | 42.9 | Very low | 43.3 | Very low | 121 Ų | 121 | 133.6 Ų | 133.6 | 73% | 0.733 | 77% | 0.769 | S | S | * | * | trans | -75.7 | 111.5 | 166.9 | 177.6 | 0 | 0 | 0 | 0 | 106 | K95 T99 | K95-V97 PolarHBondContact O-N 2.97Å; V97-T99 VanDerWaalsContact C-N 3.32Å; V97-T99 HydrophobicContact CG1-CG2 4.09Å; V97-T99 PolarHBondContact O-N 2.88Å | ||
| 98 | Y | 35 | Very low | 43.6 | Very low | 210 Ų | 210 | 136.3 Ų | 136.3 | 82% | 0.824 | 77% | 0.769 | S | S | * | * | trans | -68.5 | 94.9 | 167.2 | -69.8 | -85.4 | 0 | 0 | 0 | 108 | P96 V100 | P96-Y98 PolarHBondContact O-N 2.84Å; Y98-V100 PolarHBondContact O-N 3.11Å | ||
| 99 | T | 49.6 | Very low | 43.1 | Very low | 117 Ų | 117 | 134.4 Ų | 134.4 | 72% | 0.718 | 77% | 0.77 | S | S | * | * | trans | -77.9 | 109.9 | 163.8 | 46.4 | 0 | 0 | 0 | 0 | 107.7 | V97 P101 | V97-T99 VanDerWaalsContact C-N 3.32Å; V97-T99 HydrophobicContact CG1-CG2 4.09Å; V97-T99 PolarHBondContact O-N 2.88Å; T99-P101 WeakPolarHBondContact O-CD 3.49Å | ||
| 100 | V | 43.3 | Very low | 43.3 | Very low | 128 Ų | 128 | 134.2 Ų | 134.2 | 78% | 0.776 | 76% | 0.761 | S | S | * | * | trans | -54.2 | 125.4 | 166.6 | 179.9 | 0 | 0 | 0 | 0 | 107.8 | Y98 K102 | Y98-V100 PolarHBondContact O-N 3.11Å; V100-K102 PolarHBondContact O-N 3.21Å | ||
| 101 | P | 39 | Very low | 43.2 | Very low | 109 Ų | 109 | 130.3 Ų | 130.3 | 71% | 0.708 | 75% | 0.753 | S | S | * | * | trans | -57.9 | 111.5 | 171.2 | -24.4 | 34.5 | 0 | 0 | 0 | 109.4 | T99 V103 | T99-P101 WeakPolarHBondContact O-CD 3.49Å; P101-V103 VanDerWaalsContact C-N 3.28Å; P101-V103 PolarHBondContact O-N 3.21Å | ||
| 102 | K | 45.9 | Very low | 43.2 | Very low | 205 Ų | 205 | 131.3 Ų | 131.3 | 89% | 0.891 | 76% | 0.755 | S | S | * | * | trans | -70.2 | 91.5 | 168.1 | -176.5 | 166.4 | -179.1 | 171.6 | 0 | 107.2 | V100 A104 | V100-K102 PolarHBondContact O-N 3.21Å; K102-A104 PolarHBondContact O-N 3.28Å | ||
| 103 | V | 42.1 | Very low | 43.3 | Very low | 125 Ų | 125 | 131.1 Ų | 131.1 | 76% | 0.758 | 75% | 0.752 | S | S | * | * | trans | -64.2 | 115.8 | 172 | -169.1 | 0 | 0 | 0 | 0 | 107.2 | P101 | P101-V103 VanDerWaalsContact C-N 3.28Å; P101-V103 PolarHBondContact O-N 3.21Å | ||
| 104 | A | 41.2 | Very low | 43.5 | Very low | 70 Ų | 70 | 130.4 Ų | 130.4 | 58% | 0.579 | 75% | 0.747 | S | S | * | * | trans | -65.2 | 128.6 | 171 | 0 | 0 | 0 | 0 | 0 | 108.9 | K102 T106 | K102-A104 PolarHBondContact O-N 3.28Å; A104-T106 PolarHBondContact O-N 3.05Å | ||
| 105 | P | 43 | Very low | 43.2 | Very low | 128 Ų | 128 | 132.4 Ų | 132.4 | 83% | 0.831 | 75% | 0.749 | S | S | * | * | trans | -79.1 | 92.1 | 172.3 | 30 | -29.2 | 0 | 0 | 0 | 108.8 | ||||
| 106 | T | 51.9 | Low | 42.8 | Very low | 135 Ų | 135 | 130.7 Ų | 130.7 | 83% | 0.828 | 75% | 0.745 | S | S | * | * | trans | -111.5 | 78.8 | 163.5 | -46.2 | 0 | 0 | 0 | 0 | 109.3 | A104 | A104-T106 PolarHBondContact O-N 3.05Š| ||
| 107 | A | 41.7 | Very low | 42.5 | Very low | 89 Ų | 89 | 131.7 Ų | 131.7 | 74% | 0.736 | 75% | 0.751 | S | S | * | * | trans | -160.4 | 86 | 150.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | V109 | A107-V109 VanDerWaalsContact C-N 3.34Å; A107-V109 PolarHBondContact O-N 3.42Å | ||
| 108 | Q | 43.6 | Very low | 42.7 | Very low | 169 Ų | 169 | 131.5 Ų | 131.5 | 79% | 0.79 | 75% | 0.75 | S | S | * | * | trans | -68.7 | 93.8 | 168.3 | -70.7 | -166.6 | -25.4 | 0 | 0 | 108.6 | K110 | Q108-K110 VanDerWaalsContact C-N 3.34Å; Q108-K110 PolarHBondContact O-N 3.43Å | ||
| 109 | V | 34.8 | Very low | 43.4 | Very low | 132 Ų | 132 | 127.6 Ų | 127.6 | 80% | 0.8 | 75% | 0.748 | S | S | * | * | trans | -82.4 | 93.9 | 151 | -177.1 | 0 | 0 | 0 | 0 | 105.6 | A107 A111 | A107-V109 VanDerWaalsContact C-N 3.34Å; A107-V109 PolarHBondContact O-N 3.42Å; V109-A111 PolarHBondContact O-N 2.79Å | ||
| 110 | K | 40.9 | Very low | 43.3 | Very low | 171 Ų | 171 | 128.9 Ų | 128.9 | 74% | 0.743 | 75% | 0.75 | S | S | * | * | trans | -65.1 | 87.6 | 164.4 | -80 | -177.9 | 177.9 | -179 | 0 | 107.9 | Q108 S112 | Q108-K110 VanDerWaalsContact C-N 3.34Å; Q108-K110 PolarHBondContact O-N 3.43Å; K110-S112 VanDerWaalsContact C-N 3.33Å; K110-S112 PolarHBondContact O-N 2.85Å | ||
| 111 | A | 37.4 | Very low | 43.6 | Very low | 78 Ų | 78 | 127.1 Ų | 127.1 | 65% | 0.645 | 76% | 0.758 | S | S | * | * | trans | -79.9 | 90.8 | 155.7 | 0 | 0 | 0 | 0 | 0 | 106.9 | V109 T113 | V109-A111 PolarHBondContact O-N 2.79Å; A111-T113 VanDerWaalsContact C-N 3.3Å; A111-T113 PolarHBondContact O-N 3.34Å | ||
| 112 | S | 46.1 | Very low | 43.7 | Very low | 106 Ų | 106 | 130.8 Ų | 130.8 | 74% | 0.741 | 77% | 0.766 | S | S | * | * | trans | -63.5 | 94.7 | 167 | -71.2 | 0 | 0 | 0 | 0 | 108.3 | K110 I114 | K110-S112 VanDerWaalsContact C-N 3.33Å; K110-S112 PolarHBondContact O-N 2.85Å; S112-I114 PolarHBondContact O-N 3.32Å | ||
| 113 | T | 45.4 | Very low | 43.5 | Very low | 117 Ų | 117 | 127.4 Ų | 127.4 | 72% | 0.718 | 76% | 0.762 | S | S | * | * | trans | -82.9 | 98.3 | 165.7 | -59.6 | 0 | 0 | 0 | 0 | 107.2 | A111 I115 | A111-T113 VanDerWaalsContact C-N 3.3Å; A111-T113 PolarHBondContact O-N 3.34Å; T113-I115 HydrophobicContact CG2-CG1 4.01Å; T113-I115 PolarHBondContact O-N 3.47Å | ||
| 114 | I | 46.9 | Very low | 43.4 | Very low | 131 Ų | 131 | 130.3 Ų | 130.3 | 67% | 0.672 | 76% | 0.764 | S | S | * | * | trans | -76.6 | 104.7 | 165.3 | -65.5 | 173.8 | 0 | 0 | 0 | 106.3 | S112 Q116 | S112-I114 PolarHBondContact O-N 3.32Å; I114-Q116 HydrophobicContact CG2-CG 3.9Å; I114-Q116 PolarHBondContact O-N 3.49Å | ||
| 115 | I | 43 | Very low | 43.3 | Very low | 151 Ų | 151 | 132.6 Ų | 132.6 | 77% | 0.774 | 77% | 0.771 | S | S | * | * | trans | -78.3 | 99.5 | 164.8 | -57.7 | -179.8 | 0 | 0 | 0 | 106.4 | T113 | T113-I115 HydrophobicContact CG2-CG1 4.01Å; T113-I115 PolarHBondContact O-N 3.47Å | ||
| 116 | Q | 40.4 | Very low | 43.4 | Very low | 149 Ų | 149 | 130.9 Ų | 130.9 | 70% | 0.696 | 76% | 0.762 | S | S | * | * | trans | -91.6 | 127.2 | 161.2 | -89.3 | 171.2 | 54.8 | 0 | 0 | 108.4 | I114 T118 | I114-Q116 HydrophobicContact CG2-CG 3.9Å; I114-Q116 PolarHBondContact O-N 3.49Å; Q116-T118 PolarHBondContact O-N 2.9Å | ||
| 117 | P | 37.5 | Very low | 43.1 | Very low | 125 Ų | 125 | 129.2 Ų | 129.2 | 81% | 0.812 | 76% | 0.756 | S | S | * | * | trans | -73.6 | 109.2 | 172.5 | 28.4 | -28.8 | 0 | 0 | 0 | 108.6 | ||||
| 118 | T | 47.6 | Very low | 42.8 | Very low | 116 Ų | 116 | 133.2 Ų | 133.2 | 71% | 0.712 | 76% | 0.759 | S | S | * | * | trans | -97.1 | 113.8 | 164.6 | -60.6 | 0 | 0 | 0 | 0 | 108.7 | Q116 N120 | Q116-T118 PolarHBondContact O-N 2.9Å; T118-N120 PolarHBondContact O-N 3.19Å; T118-N120 VanDerWaalsContact O-N 3.13Å | ||
| 119 | V | 49.8 | Very low | 42.5 | Very low | 128 Ų | 128 | 130.5 Ų | 130.5 | 78% | 0.776 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -60.6 | 106.9 | 160.3 | -103 | 0 | 0 | 0 | 0 | 107.7 | ||
| 120 | N | 46.8 | Very low | 42.8 | Very low | 144 Ų | 144 | 132.6 Ų | 132.6 | 77% | 0.77 | 76% | 0.756 | S | S | * | * | S | Bend | trans | 138.1 | 93.4 | 159 | -67.1 | -6.2 | 0 | 0 | 0 | 109.5 | T118 Q122 | T118-N120 PolarHBondContact O-N 3.19Å; T118-N120 VanDerWaalsContact O-N 3.13Å; N120-Q122 PolarHBondContact O-N 3.04Å |
| 121 | G | 49.8 | Very low | 42.8 | Very low | 91 Ų | 91 | 130.8 Ų | 130.8 | 94% | 0.938 | 75% | 0.753 | S | S | * | * | trans | -65.4 | 84.3 | -168.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 122 | Q | 41.7 | Very low | 43 | Very low | 186 Ų | 186 | 132.9 Ų | 132.9 | 87% | 0.869 | 76% | 0.762 | S | S | * | * | trans | -125.9 | 99.7 | 167.3 | -138.2 | 179.7 | 18.3 | 0 | 0 | 109.8 | N120 K124 | N120-Q122 PolarHBondContact O-N 3.04Å; Q122-K124 PolarHBondContact O-N 3.03Å | ||
| 123 | V | 41.6 | Very low | 42.6 | Very low | 135 Ų | 135 | 133.8 Ų | 133.8 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | trans | -88.1 | 101.4 | 172.5 | 173.9 | 0 | 0 | 0 | 0 | 107.8 | V125 | V123-V125 HydrophobicContact CG1-CG2 3.68Š| ||
| 124 | K | 41.2 | Very low | 42.4 | Very low | 185 Ų | 185 | 131.9 Ų | 131.9 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | -90.3 | 99.1 | 166.7 | -174.6 | -176.7 | 177.9 | -163.6 | 0 | 107.8 | Q122 | Q122-K124 PolarHBondContact O-N 3.03Š| ||
| 125 | V | 39.2 | Very low | 41.8 | Very low | 118 Ų | 118 | 131.9 Ų | 131.9 | 72% | 0.715 | 77% | 0.773 | S | S | * | * | trans | -91.2 | 107.8 | 168 | 172.8 | 0 | 0 | 0 | 0 | 107.2 | V123 | V123-V125 HydrophobicContact CG1-CG2 3.68Š| ||
| 126 | S | 44.2 | Very low | 41.7 | Very low | 93 Ų | 93 | 133.7 Ų | 133.7 | 65% | 0.65 | 78% | 0.781 | S | S | * | * | trans | -99.1 | 109.9 | 163.1 | -70.9 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 127 | S | 44.8 | Very low | 41.5 | Very low | 100 Ų | 100 | 132.9 Ų | 132.9 | 70% | 0.699 | 79% | 0.786 | S | S | * | * | trans | -113.2 | 98.5 | 159.9 | 54.5 | 0 | 0 | 0 | 0 | 107.4 | T129 | S127-T129 PolarHBondContact O-N 3.34Š| ||
| 128 | E | 36 | Very low | 41.8 | Very low | 172 Ų | 172 | 131.5 Ų | 131.5 | 80% | 0.804 | 79% | 0.785 | S | S | * | * | trans | -65.3 | 126.7 | 163.3 | -74.8 | 178.2 | 140.8 | 0 | 0 | 108.2 | ||||
| 129 | T | 36.4 | Very low | 41.3 | Very low | 112 Ų | 112 | 135.3 Ų | 135.3 | 69% | 0.687 | 80% | 0.795 | S | S | * | * | trans | -129 | 100.2 | 160.3 | -63.2 | 0 | 0 | 0 | 0 | 105.7 | S127 I131 | S127-T129 PolarHBondContact O-N 3.34Å; T129-I131 HydrophobicContact CG2-CD1 4.12Å; T129-I131 HydrophobicContact CG2-CG1 3.93Å; T129-I131 PolarHBondContact O-N 3.31Å | ||
| 130 | Q | 42.9 | Very low | 40.9 | Very low | 177 Ų | 177 | 133.2 Ų | 133.2 | 83% | 0.827 | 79% | 0.79 | S | S | * | * | trans | -76.2 | 114 | 172.1 | -66 | -147.9 | 22.7 | 0 | 0 | 108.6 | ||||
| 131 | I | 40.3 | Very low | 40.8 | Very low | 133 Ų | 133 | 133.3 Ų | 133.3 | 68% | 0.682 | 79% | 0.791 | S | S | * | * | trans | -121.1 | 103.5 | 162.8 | -49.2 | 179.6 | 0 | 0 | 0 | 106.7 | T129 T133 | T129-I131 HydrophobicContact CG2-CD1 4.12Å; T129-I131 HydrophobicContact CG2-CG1 3.93Å; T129-I131 PolarHBondContact O-N 3.31Å; I131-T133 PolarHBondContact O-N 3.21Å | ||
| 132 | S | 40.6 | Very low | 40.5 | Very low | 121 Ų | 121 | 138.3 Ų | 138.3 | 85% | 0.846 | 79% | 0.79 | S | S | * | * | trans | -69.6 | 109.8 | 170.7 | -176.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 133 | T | 38.2 | Very low | 40.9 | Very low | 125 Ų | 125 | 134.1 Ų | 134.1 | 77% | 0.767 | 78% | 0.781 | S | S | * | * | trans | -141.7 | 109.4 | 157.6 | 25.7 | 0 | 0 | 0 | 0 | 108.1 | I131 V135 | I131-T133 PolarHBondContact O-N 3.21Å; T133-V135 PolarHBondContact O-N 3.08Å | ||
| 134 | G | 41.6 | Very low | 41.3 | Very low | 77 Ų | 77 | 139.1 Ų | 139.1 | 79% | 0.794 | 79% | 0.785 | S | S | * | * | trans | -76.1 | 119.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 135 | V | 35 | Very low | 41.8 | Very low | 131 Ų | 131 | 141.6 Ų | 141.6 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | trans | -139.1 | 118.2 | 155.3 | -178.3 | 0 | 0 | 0 | 0 | 107.1 | T133 | T133-V135 PolarHBondContact O-N 3.08Š| ||
| 136 | M | 39.1 | Very low | 41.8 | Very low | 189 Ų | 189 | 142.4 Ų | 142.4 | 93% | 0.931 | 80% | 0.795 | S | S | * | * | trans | -79.4 | 122.2 | 176.8 | -64.6 | -121.1 | -68.2 | 0 | 0 | 109.9 | ||||
| 137 | V | 37.8 | Very low | 42.4 | Very low | 133 Ų | 133 | 147.6 Ų | 147.6 | 81% | 0.806 | 81% | 0.806 | S | S | * | * | trans | -137.9 | 120.4 | 153.5 | -173.5 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 138 | A | 42.7 | Very low | 42.2 | Very low | 96 Ų | 96 | 148.2 Ų | 148.2 | 79% | 0.793 | 81% | 0.81 | S | S | * | * | trans | -79.7 | 137.4 | 173.6 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 139 | E | 38.1 | Very low | 43.3 | Very low | 196 Ų | 196 | 146.8 Ų | 146.8 | 92% | 0.916 | 81% | 0.813 | S | S | * | * | trans | -152.3 | 138.7 | 150.1 | -155.3 | 157 | -177 | 0 | 0 | 112 | ||||
| 140 | A | 42.1 | Very low | 43.8 | Very low | 83 Ų | 83 | 145.4 Ų | 145.4 | 69% | 0.686 | 81% | 0.813 | S | S | * | * | trans | -96.1 | 155.1 | -165.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 141 | N | 43.9 | Very low | 44.4 | Very low | 147 Ų | 147 | 142.3 Ų | 142.3 | 79% | 0.786 | 82% | 0.818 | S | S | * | * | trans | 55 | 109.8 | 145.9 | -102.3 | -26.7 | 0 | 0 | 0 | 119.1 | ||||
| 142 | Q | 42.8 | Very low | 44.8 | Very low | 196 Ų | 196 | 141 Ų | 141 | 92% | 0.916 | 82% | 0.82 | S | S | * | * | trans | -142.7 | 105.2 | 132.1 | -146.5 | 132.9 | 84.8 | 0 | 0 | 113 | ||||
| 143 | S | 50.7 | Low | 45.7 | Very low | 97 Ų | 97 | 140.4 Ų | 140.4 | 68% | 0.678 | 81% | 0.814 | S | S | * | * | trans | -58.4 | 129.7 | 158.6 | 173.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 144 | R | 51.1 | Low | 46.5 | Very low | 240 Ų | 240 | 138.1 Ų | 138.1 | 91% | 0.906 | 80% | 0.801 | S | S | * | * | trans | -166.3 | 105.2 | 137.9 | -106.7 | 175.8 | -140.7 | -163.5 | 6.4 | 111.9 | ||||
| 145 | R | 51 | Low | 47.3 | Very low | 237 Ų | 237 | 138 Ų | 138 | 89% | 0.894 | 79% | 0.793 | S | S | * | * | trans | -71.3 | 128.1 | 157.8 | 176.2 | -174.1 | -176.7 | -167.3 | 1.8 | 108.2 | ||||
| 146 | T | 38.3 | Very low | 48.4 | Very low | 136 Ų | 136 | 138.4 Ų | 138.4 | 83% | 0.834 | 79% | 0.785 | S | S | * | * | trans | -170.3 | 130.8 | 133 | 41 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 147 | K | 57.8 | Low | 49.4 | Very low | 202 Ų | 202 | 133.6 Ų | 133.6 | 88% | 0.878 | 76% | 0.764 | S | S | * | * | trans | -55.8 | 128.6 | 170.6 | -168.4 | 173.3 | -172.6 | 177.1 | 0 | 111.2 | ||||
| 148 | S | 40.4 | Very low | 50.6 | Low | 112 Ų | 112 | 131.5 Ų | 131.5 | 78% | 0.783 | 75% | 0.751 | S | S | * | * | trans | -146 | 122.7 | 151.5 | 69 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 149 | V | 59.6 | Low | 51.7 | Low | 143 Ų | 143 | 132.4 Ų | 132.4 | 87% | 0.867 | 74% | 0.741 | S | S | * | * | trans | -81.1 | 111 | 169.4 | 168.1 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 150 | A | 45.4 | Very low | 53.9 | Low | 82 Ų | 82 | 126.5 Ų | 126.5 | 68% | 0.678 | 72% | 0.716 | S | S | * | * | trans | -153.2 | 116.4 | 162.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | S152 | A150-S152 PolarHBondContact O-N 2.88Š| ||
| 151 | A | 55.9 | Low | 56.2 | Low | 113 Ų | 113 | 126.8 Ų | 126.8 | 93% | 0.934 | 71% | 0.705 | S | S | * | * | trans | -60 | 107.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 152 | S | 49.2 | Very low | 58.6 | Low | 106 Ų | 106 | 124.1 Ų | 124.1 | 74% | 0.741 | 69% | 0.691 | S | S | * | * | trans | -113.8 | 131 | 168.9 | -162.7 | 0 | 0 | 0 | 0 | 108.4 | A150 | A150-S152 PolarHBondContact O-N 2.88Š| ||
| 153 | P | 60 | Low | 61 | Low | 108 Ų | 108 | 118.8 Ų | 118.8 | 70% | 0.701 | 67% | 0.669 | S | S | * | * | trans | -64.8 | 164.4 | 178 | -12.2 | 27.6 | 0 | 0 | 0 | 111.5 | A155 | P153-A155 PolarHBondContact O-N 3.42Š| ||
| 154 | P | 54.5 | Low | 63.1 | Low | 76 Ų | 76 | 121 Ų | 121 | 49% | 0.494 | 67% | 0.666 | S | S | . | * | trans | -79.3 | 92 | -150.6 | 33.2 | -36.1 | 0 | 0 | 0 | 113.3 | H156 N157 | P154-H156 PolarHBondContact O-N 2.84Å; P154-H156 VanDerWaalsContact O-N 3.16Å; P154-N157 HydrophobicContact CB-CB 4.46Å; P154-N157 VanDerWaalsContact CB-ND2 3.27Å; P154-N157 WeakPolarHBondContact CB-ND2 3.4Å; P154-N157 WeakPolarHBondContact CG-ND2 3.32Å; P154-N157 PolarHBondContact O-N 3.49Å | ||
| 155 | A | 57.3 | Low | 65.2 | Low | 76 Ų | 76 | 114.5 Ų | 114.5 | 63% | 0.628 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -62.3 | -12.4 | 162.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | P153 N157 | P153-A155 PolarHBondContact O-N 3.42Å; A155-N157 VanDerWaalsContact C-N 3.28Å; A155-N157 PolarHBondContact O-N 3.19Å |
| 156 | H | 59.2 | Low | 67.4 | Low | 139 Ų | 139 | 108.1 Ų | 108.1 | 64% | 0.644 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -72.4 | -18.9 | 175 | -155.4 | 45.3 | 0 | 0 | 0 | 113.3 | P154 N160 | P154-H156 PolarHBondContact O-N 2.84Å; P154-H156 VanDerWaalsContact O-N 3.16Å; H156-N160 PolarHBondContact O-OD1 2.94Å |
| 157 | N | 60.3 | Low | 70.2 | Confident | 88 Ų | 88 | 107.8 Ų | 107.8 | 47% | 0.471 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -88.9 | -32 | -177.3 | -64 | -20.5 | 0 | 0 | 0 | 112.8 | P154 A155 N160 I161 | P154-N157 HydrophobicContact CB-CB 4.46Å; P154-N157 VanDerWaalsContact CB-ND2 3.27Å; P154-N157 WeakPolarHBondContact CB-ND2 3.4Å; P154-N157 WeakPolarHBondContact CG-ND2 3.32Å; P154-N157 PolarHBondContact O-N 3.49Å; A155-N157 VanDerWaalsContact C-N 3.28Å; A155-N157 PolarHBondContact O-N 3.19Å; N157-N160 PolarHBondContact O-N 3.08Å; N157-I161 WeakPolarHBondContact O-CD1 3.42Å; N157-I161 VanDerWaalsContact O-CG1 3.25Å; N157-I161 WeakPolarHBondContact O-CG1 3.27Å; N157-I161 PolarHBondContact O-N 2.92Å; N157-I161 VanDerWaalsContact O-N 3.08Å |
| 158 | V | 62.3 | Low | 72 | Confident | 89 Ų | 89 | 100.8 Ų | 100.8 | 54% | 0.539 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -71.3 | -45.4 | -177 | -178.1 | 0 | 0 | 0 | 0 | 110.9 | N160 I161 D162 | V158-N160 PolarHBondContact O-N 3.45Å; V158-I161 PolarHBondContact O-N 3.43Å; V158-D162 PolarHBondContact O-N 2.78Å |
| 159 | L | 66.9 | Low | 74.8 | Confident | 114 Ų | 114 | 100.4 Ų | 100.4 | 60% | 0.597 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -60.5 | -28.2 | 173.4 | -62.1 | 177.6 | 0 | 0 | 0 | 112.5 | N163 | L159-N163 VanDerWaalsContact O-CG 3.23Å; L159-N163 PolarHBondContact O-N 3.08Å; L159-N163 PolarHBondContact O-ND2 3.37Å; L159-N163 VanDerWaalsContact O-ND2 3.16Å |
| 160 | N | 83.1 | Confident | 76.6 | Confident | 72 Ų | 72 | 96.6 Ų | 96.6 | 39% | 0.385 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -82.4 | -21.5 | 178.1 | -72 | 35.4 | 0 | 0 | 0 | 112.9 | H156 N157 V158 K164 | H156-N160 PolarHBondContact O-OD1 2.94Å; N157-N160 PolarHBondContact O-N 3.08Å; V158-N160 PolarHBondContact O-N 3.45Å; N160-K164 VanDerWaalsContact O-CG 3.24Å; N160-K164 WeakPolarHBondContact O-CG 2.93Å; N160-K164 PolarHBondContact O-N 2.96Å |
| 161 | I | 91.1 | Very high | 79.1 | Confident | 90 Ų | 90 | 98.7 Ų | 98.7 | 46% | 0.462 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -75.9 | -45.7 | 175.7 | -70.7 | 160.6 | 0 | 0 | 0 | 109.7 | N157 V158 N163 K164 I165 | N157-I161 WeakPolarHBondContact O-CD1 3.42Å; N157-I161 VanDerWaalsContact O-CG1 3.25Å; N157-I161 WeakPolarHBondContact O-CG1 3.27Å; N157-I161 PolarHBondContact O-N 2.92Å; N157-I161 VanDerWaalsContact O-N 3.08Å; V158-I161 PolarHBondContact O-N 3.43Å; I161-N163 VanDerWaalsContact C-N 3.29Å; I161-N163 PolarHBondContact O-N 3.04Å; I161-K164 CarbonylContact O-C 3.58Å; I161-K164 WeakPolarHBondContact O-CA 3.2Å; I161-K164 WeakPolarHBondContact O-CB 3.29Å; I161-K164 PolarHBondContact O-N 3.31Å; I161-I165 HydrophobicContact CG2-CD1 3.78Å; I161-I165 HydrophobicContact CG2-CG1 4.3Å; I161-I165 WeakPolarHBondContact O-CG1 3.15Å; I161-I165 PolarHBondContact O-N 3.2Å |
| 162 | D | 94.3 | Very high | 81.1 | Confident | 91 Ų | 91 | 98.1 Ų | 98.1 | 49% | 0.487 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -58.8 | -43.4 | 178.1 | -63.5 | -22.8 | 0 | 0 | 0 | 110.9 | V158 K164 I165 E166 | V158-D162 PolarHBondContact O-N 2.78Å; D162-K164 VanDerWaalsContact C-N 3.28Å; D162-K164 PolarHBondContact O-N 3.35Å; D162-I165 PolarHBondContact O-N 3.27Å; D162-E166 WeakPolarHBondContact O-CB 3.41Å; D162-E166 PolarHBondContact O-N 3.32Å |
| 163 | N | 93.1 | Very high | 83.5 | Confident | 83 Ų | 83 | 98 Ų | 98 | 44% | 0.444 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.6 | -32.5 | 174.2 | -69 | -16 | 0 | 0 | 0 | 113.3 | L159 I161 Q167 | L159-N163 VanDerWaalsContact O-CG 3.23Å; L159-N163 PolarHBondContact O-N 3.08Å; L159-N163 PolarHBondContact O-ND2 3.37Å; L159-N163 VanDerWaalsContact O-ND2 3.16Å; I161-N163 VanDerWaalsContact C-N 3.29Å; I161-N163 PolarHBondContact O-N 3.04Å; N163-Q167 WeakPolarHBondContact O-CB 3.49Å; N163-Q167 WeakPolarHBondContact O-CG 3.37Å; N163-Q167 PolarHBondContact O-N 3.37Å; N163-Q167 PolarHBondContact O-NE2 3.01Å |
| 164 | K | 94.9 | Very high | 85.3 | Confident | 145 Ų | 145 | 95.9 Ų | 95.9 | 63% | 0.63 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -76.2 | -35.1 | 176.7 | -79.4 | 179.9 | 174.9 | -144.6 | 0 | 111.9 | N160 I161 D162 A168 | N160-K164 VanDerWaalsContact O-CG 3.24Å; N160-K164 WeakPolarHBondContact O-CG 2.93Å; N160-K164 PolarHBondContact O-N 2.96Å; I161-K164 CarbonylContact O-C 3.58Å; I161-K164 WeakPolarHBondContact O-CA 3.2Å; I161-K164 WeakPolarHBondContact O-CB 3.29Å; I161-K164 PolarHBondContact O-N 3.31Å; D162-K164 VanDerWaalsContact C-N 3.28Å; D162-K164 PolarHBondContact O-N 3.35Å; K164-A168 WeakPolarHBondContact O-CB 3.41Å; K164-A168 PolarHBondContact O-N 3.44Å |
| 165 | I | 95.5 | Very high | 87.4 | Confident | 102 Ų | 102 | 98.7 Ų | 98.7 | 52% | 0.523 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.6 | -45.7 | 172.9 | -67.1 | 168.1 | 0 | 0 | 0 | 109.4 | I161 D162 Q167 A168 M169 | I161-I165 HydrophobicContact CG2-CD1 3.78Å; I161-I165 HydrophobicContact CG2-CG1 4.3Å; I161-I165 WeakPolarHBondContact O-CG1 3.15Å; I161-I165 PolarHBondContact O-N 3.2Å; D162-I165 PolarHBondContact O-N 3.27Å; I165-Q167 PolarHBondContact O-N 2.93Å; I165-A168 PolarHBondContact O-N 2.74Å; I165-M169 WeakPolarHBondContact O-CB 3.45Å; I165-M169 PolarHBondContact O-N 2.89Å |
| 166 | E | 96.1 | Very high | 89.3 | Confident | 103 Ų | 103 | 100.2 Ų | 100.2 | 48% | 0.481 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.4 | -46.1 | 177.4 | -171.5 | 169.9 | -154.1 | 0 | 0 | 111.4 | D162 A168 M169 D170 | D162-E166 WeakPolarHBondContact O-CB 3.41Å; D162-E166 PolarHBondContact O-N 3.32Å; E166-A168 PolarHBondContact O-N 3.21Å; E166-M169 PolarHBondContact O-N 3.49Å; E166-D170 WeakPolarHBondContact O-CB 3.12Å; E166-D170 PolarHBondContact O-N 3.18Å |
| 167 | Q | 96.5 | Very high | 91.2 | Very high | 129 Ų | 129 | 99.7 Ų | 99.7 | 60% | 0.603 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -59.3 | -44.6 | 174.6 | -78.7 | 168.8 | 67.7 | 0 | 0 | 113.1 | N163 I165 M169 D170 L171 | N163-Q167 WeakPolarHBondContact O-CB 3.49Å; N163-Q167 WeakPolarHBondContact O-CG 3.37Å; N163-Q167 PolarHBondContact O-N 3.37Å; N163-Q167 PolarHBondContact O-NE2 3.01Å; I165-Q167 PolarHBondContact O-N 2.93Å; Q167-M169 VanDerWaalsContact C-N 3.31Å; Q167-M169 PolarHBondContact O-N 3.44Å; Q167-D170 PolarHBondContact O-N 3.06Å; Q167-L171 WeakPolarHBondContact O-CB 3.2Å; Q167-L171 PolarHBondContact O-N 2.95Å |
| 168 | A | 97.6 | Very high | 93 | Very high | 55 Ų | 55 | 101.4 Ų | 101.4 | 46% | 0.455 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.4 | -40.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | K164 I165 E166 L171 V172 | K164-A168 WeakPolarHBondContact O-CB 3.41Å; K164-A168 PolarHBondContact O-N 3.44Å; I165-A168 PolarHBondContact O-N 2.74Å; E166-A168 PolarHBondContact O-N 3.21Å; A168-L171 PolarHBondContact O-N 3.13Å; A168-V172 VanDerWaalsContact O-CG2 3.27Å; A168-V172 WeakPolarHBondContact O-CG2 3.32Å; A168-V172 PolarHBondContact O-N 3.26Å |
| 169 | M | 98.3 | Very high | 94.7 | Very high | 105 Ų | 105 | 99 Ų | 99 | 52% | 0.517 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.4 | -44 | 177.7 | -174.5 | 179.8 | 60.1 | 0 | 0 | 111.9 | I165 E166 Q167 L171 V172 K173 | I165-M169 WeakPolarHBondContact O-CB 3.45Å; I165-M169 PolarHBondContact O-N 2.89Å; E166-M169 PolarHBondContact O-N 3.49Å; Q167-M169 VanDerWaalsContact C-N 3.31Å; Q167-M169 PolarHBondContact O-N 3.44Å; M169-L171 VanDerWaalsContact C-N 3.32Å; M169-L171 PolarHBondContact O-N 2.99Å; M169-V172 PolarHBondContact O-N 2.98Å; M169-K173 WeakPolarHBondContact O-CB 3.49Å; M169-K173 PolarHBondContact O-N 2.86Å |
| 170 | D | 97.8 | Very high | 96.2 | Very high | 63 Ų | 63 | 97.3 Ų | 97.3 | 34% | 0.337 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.7 | -33.9 | 177.9 | -79.1 | -21.9 | 0 | 0 | 0 | 112.4 | E166 Q167 K173 T174 | E166-D170 WeakPolarHBondContact O-CB 3.12Å; E166-D170 PolarHBondContact O-N 3.18Å; Q167-D170 PolarHBondContact O-N 3.06Å; D170-K173 PolarHBondContact O-N 2.97Å; D170-K173 IonicContact OD1-NZ 2.77Å; D170-K173 PolarHBondContact OD1-NZ 2.85Å; D170-T174 VanDerWaalsContact O-CB 3.26Å; D170-T174 WeakPolarHBondContact O-CB 3.34Å; D170-T174 PolarHBondContact O-N 3.27Å; D170-T174 PolarHBondContact O-OG1 3.35Å |
| 171 | L | 98 | Very high | 96.9 | Very high | 125 Ų | 125 | 101.6 Ų | 101.6 | 65% | 0.654 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.3 | -47.6 | 170.7 | -178.2 | 63.7 | 0 | 0 | 0 | 111.2 | Q167 A168 M169 K173 T174 H175 | Q167-L171 WeakPolarHBondContact O-CB 3.2Å; Q167-L171 PolarHBondContact O-N 2.95Å; A168-L171 PolarHBondContact O-N 3.13Å; M169-L171 VanDerWaalsContact C-N 3.32Å; M169-L171 PolarHBondContact O-N 2.99Å; L171-K173 VanDerWaalsContact C-N 3.34Å; L171-K173 PolarHBondContact O-N 3.35Å; L171-T174 PolarHBondContact O-N 2.99Å; L171-H175 WeakPolarHBondContact O-CB 3.32Å; L171-H175 PolarHBondContact O-N 3.46Å |
| 172 | V | 98.3 | Very high | 97.3 | Very high | 101 Ų | 101 | 104.1 Ų | 104.1 | 61% | 0.612 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.1 | -45.5 | 177 | 168.5 | 0 | 0 | 0 | 0 | 111 | A168 M169 T174 H175 L176 | A168-V172 VanDerWaalsContact O-CG2 3.27Å; A168-V172 WeakPolarHBondContact O-CG2 3.32Å; A168-V172 PolarHBondContact O-N 3.26Å; M169-V172 PolarHBondContact O-N 2.98Å; V172-T174 PolarHBondContact O-N 2.93Å; V172-H175 PolarHBondContact O-N 3.46Å; V172-L176 WeakPolarHBondContact O-CB 3.34Å; V172-L176 PolarHBondContact O-N 2.96Å |
| 173 | K | 98.5 | Very high | 97.5 | Very high | 103 Ų | 103 | 106 Ų | 106 | 45% | 0.448 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -58.2 | -49.3 | 177.2 | -175.9 | -170.7 | -63.6 | 151.5 | 0 | 110.9 | M169 D170 L171 L176 M177 | M169-K173 WeakPolarHBondContact O-CB 3.49Å; M169-K173 PolarHBondContact O-N 2.86Å; D170-K173 PolarHBondContact O-N 2.97Å; D170-K173 IonicContact OD1-NZ 2.77Å; D170-K173 PolarHBondContact OD1-NZ 2.85Å; L171-K173 VanDerWaalsContact C-N 3.34Å; L171-K173 PolarHBondContact O-N 3.35Å; K173-L176 PolarHBondContact O-N 3.49Å; K173-M177 HydrophobicContact CG-SD 4.38Å; K173-M177 WeakPolarHBondContact O-CB 3.4Å; K173-M177 VanDerWaalsContact O-CG 3.25Å; K173-M177 WeakPolarHBondContact O-CG 3.48Å; K173-M177 PolarHBondContact O-N 2.9Å |
| 174 | T | 98.1 | Very high | 97.7 | Very high | 64 Ų | 64 | 104.7 Ų | 104.7 | 39% | 0.393 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63 | -44.2 | 179.2 | -60.7 | 0 | 0 | 0 | 0 | 111.4 | D170 L171 V172 M177 F178 | D170-T174 VanDerWaalsContact O-CB 3.26Å; D170-T174 WeakPolarHBondContact O-CB 3.34Å; D170-T174 PolarHBondContact O-N 3.27Å; D170-T174 PolarHBondContact O-OG1 3.35Å; L171-T174 PolarHBondContact O-N 2.99Å; V172-T174 PolarHBondContact O-N 2.93Å; T174-M177 PolarHBondContact O-N 3.44Å; T174-F178 HydrophobicContact CG2-CD2 3.68Å; T174-F178 HydrophobicContact CG2-CE2 3.24Å; T174-F178 HydrophobicContact CG2-CZ 4.19Å; T174-F178 WeakPolarHBondContact O-CD2 3.37Å; T174-F178 PolarHBondContact O-N 3.4Å |
| 175 | H | 98.3 | Very high | 97.9 | Very high | 135 Ų | 135 | 101.6 Ų | 101.6 | 63% | 0.625 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.5 | -43.7 | 178.3 | -165 | 61.7 | 0 | 0 | 0 | 112 | L171 V172 F178 A179 | L171-H175 WeakPolarHBondContact O-CB 3.32Å; L171-H175 PolarHBondContact O-N 3.46Å; V172-H175 PolarHBondContact O-N 3.46Å; H175-F178 PolarHBondContact O-N 3.27Å; H175-A179 WeakPolarHBondContact O-CB 3.43Å; H175-A179 PolarHBondContact O-N 2.87Å |
| 176 | L | 98.4 | Very high | 98 | Very high | 109 Ų | 109 | 98.9 Ų | 98.9 | 57% | 0.571 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.7 | -43.6 | 176.2 | -178.1 | 63 | 0 | 0 | 0 | 111.5 | V172 K173 F178 A179 V180 | V172-L176 WeakPolarHBondContact O-CB 3.34Å; V172-L176 PolarHBondContact O-N 2.96Å; K173-L176 PolarHBondContact O-N 3.49Å; L176-F178 VanDerWaalsContact C-N 3.28Å; L176-F178 PolarHBondContact O-N 3.38Å; L176-A179 PolarHBondContact O-N 2.94Å; L176-V180 HydrophobicContact CD1-CG2 3.69Å; L176-V180 HydrophobicContact CG-CG2 4.1Å; L176-V180 VanDerWaalsContact O-CB 3.29Å; L176-V180 WeakPolarHBondContact O-CB 3.18Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 3.48Å |
| 177 | M | 97.9 | Very high | 98.2 | Very high | 128 Ų | 128 | 99.1 Ų | 99.1 | 63% | 0.631 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -58.1 | -42.3 | 176.5 | -76.6 | -178.7 | 65.5 | 0 | 0 | 111.9 | K173 T174 R181 | K173-M177 HydrophobicContact CG-SD 4.38Å; K173-M177 WeakPolarHBondContact O-CB 3.4Å; K173-M177 VanDerWaalsContact O-CG 3.25Å; K173-M177 WeakPolarHBondContact O-CG 3.48Å; K173-M177 PolarHBondContact O-N 2.9Å; T174-M177 PolarHBondContact O-N 3.44Å; M177-R181 VanDerWaalsContact O-CB 3.32Å; M177-R181 WeakPolarHBondContact O-CB 3.48Å; M177-R181 PolarHBondContact O-N 2.81Å; M177-R181 VanDerWaalsContact O-N 3.1Å |
| 178 | F | 98.2 | Very high | 98.3 | Very high | 123 Ų | 123 | 100.5 Ų | 100.5 | 54% | 0.539 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -68.7 | -50 | 176.9 | -72 | -53.3 | 0 | 0 | 0 | 112.4 | T174 H175 L176 V180 R181 E182 | T174-F178 HydrophobicContact CG2-CD2 3.68Å; T174-F178 HydrophobicContact CG2-CE2 3.24Å; T174-F178 HydrophobicContact CG2-CZ 4.19Å; T174-F178 WeakPolarHBondContact O-CD2 3.37Å; T174-F178 PolarHBondContact O-N 3.4Å; H175-F178 PolarHBondContact O-N 3.27Å; L176-F178 VanDerWaalsContact C-N 3.28Å; L176-F178 PolarHBondContact O-N 3.38Å; F178-V180 VanDerWaalsContact C-N 3.33Å; F178-V180 PolarHBondContact O-N 2.96Å; F178-R181 PolarHBondContact O-N 3.37Å; F178-E182 WeakPolarHBondContact O-CB 3.38Å; F178-E182 PolarHBondContact O-N 3.41Å |
| 179 | A | 98.2 | Very high | 98.3 | Very high | 40 Ų | 40 | 99.5 Ų | 99.5 | 33% | 0.331 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -58.6 | -45.6 | 180 | 0 | 0 | 0 | 0 | 0 | 111.5 | H175 L176 R181 E182 E183 | H175-A179 WeakPolarHBondContact O-CB 3.43Å; H175-A179 PolarHBondContact O-N 2.87Å; L176-A179 PolarHBondContact O-N 2.94Å; A179-R181 PolarHBondContact O-N 2.96Å; A179-E182 PolarHBondContact O-N 2.98Å; A179-E183 WeakPolarHBondContact O-CG 3.44Å; A179-E183 PolarHBondContact O-N 2.9Å |
| 180 | V | 98.6 | Very high | 98.3 | Very high | 78 Ų | 78 | 100.2 Ų | 100.2 | 47% | 0.473 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 178.4 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | L176 F178 V184 | L176-V180 HydrophobicContact CD1-CG2 3.69Å; L176-V180 HydrophobicContact CG-CG2 4.1Å; L176-V180 VanDerWaalsContact O-CB 3.29Å; L176-V180 WeakPolarHBondContact O-CB 3.18Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 3.48Å; F178-V180 VanDerWaalsContact C-N 3.33Å; F178-V180 PolarHBondContact O-N 2.96Å; V180-V184 HydrophobicContact CG1-CG2 4.41Å; V180-V184 WeakPolarHBondContact O-CB 3.49Å; V180-V184 VanDerWaalsContact O-CG2 3.25Å; V180-V184 WeakPolarHBondContact O-CG2 3.25Å; V180-V184 PolarHBondContact O-N 2.89Å |
| 181 | R | 98 | Very high | 98.4 | Very high | 162 Ų | 162 | 101.7 Ų | 101.7 | 61% | 0.611 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61 | -47.8 | 175.5 | 173.7 | 177.8 | -91.9 | 157.2 | -6.9 | 110.9 | M177 F178 A179 E183 V184 D185 | M177-R181 VanDerWaalsContact O-CB 3.32Å; M177-R181 WeakPolarHBondContact O-CB 3.48Å; M177-R181 PolarHBondContact O-N 2.81Å; M177-R181 VanDerWaalsContact O-N 3.1Å; F178-R181 PolarHBondContact O-N 3.37Å; A179-R181 PolarHBondContact O-N 2.96Å; R181-E183 PolarHBondContact O-N 3.28Å; R181-V184 PolarHBondContact O-N 3.4Å; R181-D185 WeakPolarHBondContact CG-OD2 3.34Å; R181-D185 WeakPolarHBondContact O-CB 3.44Å; R181-D185 PolarHBondContact O-N 2.88Å |
| 182 | E | 98.3 | Very high | 98.4 | Very high | 143 Ų | 143 | 101.5 Ų | 101.5 | 67% | 0.668 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59.9 | -46.1 | 180 | -174.2 | 176.5 | 179.6 | 0 | 0 | 111.6 | F178 A179 V184 D185 G186 | F178-E182 WeakPolarHBondContact O-CB 3.38Å; F178-E182 PolarHBondContact O-N 3.41Å; A179-E182 PolarHBondContact O-N 2.98Å; E182-V184 PolarHBondContact O-N 3.34Å; E182-D185 PolarHBondContact O-N 3.39Å; E182-G186 PolarHBondContact O-N 3.39Å |
| 183 | E | 98.3 | Very high | 98.4 | Very high | 129 Ų | 129 | 101.3 Ų | 101.3 | 60% | 0.603 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.2 | -42.9 | 176.6 | -69.8 | -61.5 | 146.1 | 0 | 0 | 111.9 | A179 R181 G186 L187 | A179-E183 WeakPolarHBondContact O-CG 3.44Å; A179-E183 PolarHBondContact O-N 2.9Å; R181-E183 PolarHBondContact O-N 3.28Å; E183-G186 PolarHBondContact O-N 2.89Å; E183-L187 WeakPolarHBondContact O-CB 3.28Å; E183-L187 VanDerWaalsContact O-CG 3.25Å; E183-L187 WeakPolarHBondContact O-CG 3.45Å; E183-L187 PolarHBondContact O-N 3.1Å |
| 184 | V | 98.7 | Very high | 98.4 | Very high | 57 Ų | 57 | 100.5 Ų | 100.5 | 35% | 0.345 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.8 | -45.7 | 178 | 168.4 | 0 | 0 | 0 | 0 | 111.4 | V180 R181 E182 G186 L187 R188 | V180-V184 HydrophobicContact CG1-CG2 4.41Å; V180-V184 WeakPolarHBondContact O-CB 3.49Å; V180-V184 VanDerWaalsContact O-CG2 3.25Å; V180-V184 WeakPolarHBondContact O-CG2 3.25Å; V180-V184 PolarHBondContact O-N 2.89Å; R181-V184 PolarHBondContact O-N 3.4Å; E182-V184 PolarHBondContact O-N 3.34Å; V184-G186 VanDerWaalsContact C-N 3.34Å; V184-L187 PolarHBondContact O-N 3.35Å; V184-R188 WeakPolarHBondContact O-CB 3.27Å; V184-R188 VanDerWaalsContact O-CG 3.27Å; V184-R188 WeakPolarHBondContact O-CG 3.45Å; V184-R188 PolarHBondContact O-N 3.48Å |
| 185 | D | 98.4 | Very high | 98.4 | Very high | 79 Ų | 79 | 102.4 Ų | 102.4 | 42% | 0.422 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68.4 | -36 | 179.6 | -70 | -22.6 | 0 | 0 | 0 | 111.1 | R181 E182 R188 G189 | R181-D185 WeakPolarHBondContact CG-OD2 3.34Å; R181-D185 WeakPolarHBondContact O-CB 3.44Å; R181-D185 PolarHBondContact O-N 2.88Å; E182-D185 PolarHBondContact O-N 3.39Å; D185-R188 PolarHBondContact O-N 3.31Å; D185-R188 IonicContact OD1-NH1 3.28Å; D185-R188 PolarHBondContact OD1-NH1 3.32Å; D185-G189 PolarHBondContact O-N 2.89Å |
| 186 | G | 98.5 | Very high | 98.4 | Very high | 46 Ų | 46 | 98.3 Ų | 98.3 | 47% | 0.474 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.6 | -46.2 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | E182 E183 V184 G189 K190 | E182-G186 PolarHBondContact O-N 3.39Å; E183-G186 PolarHBondContact O-N 2.89Å; V184-G186 VanDerWaalsContact C-N 3.34Å; G186-G189 PolarHBondContact O-N 3.47Å; G186-K190 PolarHBondContact O-N 3.19Å |
| 187 | L | 98.8 | Very high | 98.4 | Very high | 107 Ų | 107 | 96.8 Ų | 96.8 | 56% | 0.56 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -63.5 | -42.6 | 175.8 | -72.6 | 173.9 | 0 | 0 | 0 | 112.1 | E183 V184 G189 K190 I191 | E183-L187 WeakPolarHBondContact O-CB 3.28Å; E183-L187 VanDerWaalsContact O-CG 3.25Å; E183-L187 WeakPolarHBondContact O-CG 3.45Å; E183-L187 PolarHBondContact O-N 3.1Å; V184-L187 PolarHBondContact O-N 3.35Å; L187-G189 PolarHBondContact O-N 2.92Å; L187-K190 PolarHBondContact O-N 3.37Å; L187-I191 VanDerWaalsContact O-CG1 3.28Å; L187-I191 WeakPolarHBondContact O-CG1 3.44Å; L187-I191 PolarHBondContact O-N 2.77Å |
| 188 | R | 98.5 | Very high | 98.4 | Very high | 159 Ų | 159 | 94 Ų | 94 | 60% | 0.6 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -59.7 | -45.2 | 175.5 | -75.6 | 168.8 | 171.5 | 174 | -4.6 | 111.9 | V184 D185 K190 I191 F192 | V184-R188 WeakPolarHBondContact O-CB 3.27Å; V184-R188 VanDerWaalsContact O-CG 3.27Å; V184-R188 WeakPolarHBondContact O-CG 3.45Å; V184-R188 PolarHBondContact O-N 3.48Å; D185-R188 PolarHBondContact O-N 3.31Å; D185-R188 IonicContact OD1-NH1 3.28Å; D185-R188 PolarHBondContact OD1-NH1 3.32Å; R188-K190 VanDerWaalsContact C-N 3.33Å; R188-K190 PolarHBondContact O-N 2.94Å; R188-I191 PolarHBondContact O-N 3.27Å; R188-F192 WeakPolarHBondContact O-CB 3.41Å; R188-F192 PolarHBondContact O-N 2.87Å |
| 189 | G | 98.6 | Very high | 98.4 | Very high | 33 Ų | 33 | 94.9 Ų | 94.9 | 34% | 0.34 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -59.5 | -44.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | D185 G186 L187 I191 F192 D193 | D185-G189 PolarHBondContact O-N 2.89Å; G186-G189 PolarHBondContact O-N 3.47Å; L187-G189 PolarHBondContact O-N 2.92Å; G189-I191 PolarHBondContact O-N 3.49Å; G189-F192 PolarHBondContact O-N 3.26Å; G189-D193 PolarHBondContact O-N 3.47Å |
| 190 | K | 98.4 | Very high | 98.4 | Very high | 121 Ų | 121 | 99.6 Ų | 99.6 | 53% | 0.526 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 178.7 | -174.1 | 57.3 | 174.3 | 179.4 | 0 | 112.9 | G186 L187 R188 L194 | G186-K190 PolarHBondContact O-N 3.19Å; L187-K190 PolarHBondContact O-N 3.37Å; R188-K190 VanDerWaalsContact C-N 3.33Å; R188-K190 PolarHBondContact O-N 2.94Å; K190-L194 HydrophobicContact CD-CD1 4.33Å; K190-L194 HydrophobicContact CD-CG 4.36Å; K190-L194 HydrophobicContact CG-CD1 4.13Å; K190-L194 WeakPolarHBondContact O-CB 3.46Å; K190-L194 VanDerWaalsContact O-CG 3.27Å; K190-L194 WeakPolarHBondContact O-CG 3.25Å; K190-L194 PolarHBondContact O-N 3.47Å |
| 191 | I | 98.6 | Very high | 98.4 | Very high | 93 Ų | 93 | 99.6 Ų | 99.6 | 48% | 0.477 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -60.3 | -50.8 | 175 | -70.1 | 164 | 0 | 0 | 0 | 109.5 | L187 R188 G189 D193 L194 E195 | L187-I191 VanDerWaalsContact O-CG1 3.28Å; L187-I191 WeakPolarHBondContact O-CG1 3.44Å; L187-I191 PolarHBondContact O-N 2.77Å; R188-I191 PolarHBondContact O-N 3.27Å; G189-I191 PolarHBondContact O-N 3.49Å; I191-D193 VanDerWaalsContact C-N 3.34Å; I191-D193 PolarHBondContact O-N 2.97Å; I191-L194 PolarHBondContact O-N 2.82Å; I191-E195 HydrophobicContact CG2-CG 4.21Å; I191-E195 WeakPolarHBondContact CG2-OE1 3.27Å; I191-E195 WeakPolarHBondContact O-CB 3.35Å; I191-E195 WeakPolarHBondContact O-CG 3Å; I191-E195 PolarHBondContact O-N 3.19Å |
| 192 | F | 98.5 | Very high | 98.4 | Very high | 121 Ų | 121 | 97.8 Ų | 97.8 | 53% | 0.531 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -56.7 | -45.6 | 179.8 | 179.2 | -102.6 | 0 | 0 | 0 | 112.6 | R188 G189 E195 N196 | R188-F192 WeakPolarHBondContact O-CB 3.41Å; R188-F192 PolarHBondContact O-N 2.87Å; G189-F192 PolarHBondContact O-N 3.26Å; F192-E195 PolarHBondContact O-N 2.84Å; F192-N196 VanDerWaalsContact CD1-ND2 3.35Å; F192-N196 WeakPolarHBondContact CD1-ND2 3.16Å; F192-N196 WeakPolarHBondContact CE1-ND2 3.42Å; F192-N196 WeakPolarHBondContact CZ-ND2 3.2Å; F192-N196 WeakPolarHBondContact O-CB 3.48Å; F192-N196 VanDerWaalsContact O-CG 3.22Å; F192-N196 PolarHBondContact O-N 2.98Å; F192-N196 PolarHBondContact O-ND2 3.49Å; F192-N196 VanDerWaalsContact O-ND2 3.13Å |
| 193 | D | 98.5 | Very high | 98.3 | Very high | 98 Ų | 98 | 93.6 Ų | 93.6 | 52% | 0.524 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64 | -42.2 | 178.3 | -73.2 | -18.9 | 0 | 0 | 0 | 112.5 | G189 I191 N196 H197 | G189-D193 PolarHBondContact O-N 3.47Å; I191-D193 VanDerWaalsContact C-N 3.34Å; I191-D193 PolarHBondContact O-N 2.97Å; D193-N196 PolarHBondContact O-N 2.91Å; D193-H197 WeakPolarHBondContact O-CB 3.29Å; D193-H197 PolarHBondContact O-N 3.47Å |
| 194 | L | 98.7 | Very high | 98.1 | Very high | 86 Ų | 86 | 91.8 Ų | 91.8 | 45% | 0.45 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -66.2 | -43.5 | 177.7 | -74 | 173.3 | 0 | 0 | 0 | 111.5 | K190 I191 N196 H197 V198 | K190-L194 HydrophobicContact CD-CD1 4.33Å; K190-L194 HydrophobicContact CD-CG 4.36Å; K190-L194 HydrophobicContact CG-CD1 4.13Å; K190-L194 WeakPolarHBondContact O-CB 3.46Å; K190-L194 VanDerWaalsContact O-CG 3.27Å; K190-L194 WeakPolarHBondContact O-CG 3.25Å; K190-L194 PolarHBondContact O-N 3.47Å; I191-L194 PolarHBondContact O-N 2.82Å; L194-N196 VanDerWaalsContact C-N 3.33Å; L194-N196 PolarHBondContact O-N 2.84Å; L194-H197 PolarHBondContact O-N 3.5Å; L194-V198 WeakPolarHBondContact O-CG2 3.38Å; L194-V198 PolarHBondContact O-N 2.78Å |
| 195 | E | 98.5 | Very high | 97.9 | Very high | 103 Ų | 103 | 92.5 Ų | 92.5 | 48% | 0.481 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -60.5 | -43.1 | 175.9 | -73.9 | 178.3 | 168.7 | 0 | 0 | 111.6 | I191 F192 H197 V198 R199 | I191-E195 HydrophobicContact CG2-CG 4.21Å; I191-E195 WeakPolarHBondContact CG2-OE1 3.27Å; I191-E195 WeakPolarHBondContact O-CB 3.35Å; I191-E195 WeakPolarHBondContact O-CG 3Å; I191-E195 PolarHBondContact O-N 3.19Å; F192-E195 PolarHBondContact O-N 2.84Å; E195-H197 VanDerWaalsContact C-N 3.34Å; E195-H197 PolarHBondContact O-N 3.32Å; E195-V198 PolarHBondContact O-N 3.04Å; E195-R199 WeakPolarHBondContact O-CB 3.32Å; E195-R199 PolarHBondContact O-N 3.18Å |
| 196 | N | 98.3 | Very high | 97.6 | Very high | 49 Ų | 49 | 91.5 Ų | 91.5 | 26% | 0.262 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -64.9 | -38.8 | 175.6 | -71.5 | -30.3 | 0 | 0 | 0 | 112.1 | F192 D193 L194 R199 R200 | F192-N196 VanDerWaalsContact CD1-ND2 3.35Å; F192-N196 WeakPolarHBondContact CD1-ND2 3.16Å; F192-N196 WeakPolarHBondContact CE1-ND2 3.42Å; F192-N196 WeakPolarHBondContact CZ-ND2 3.2Å; F192-N196 WeakPolarHBondContact O-CB 3.48Å; F192-N196 VanDerWaalsContact O-CG 3.22Å; F192-N196 PolarHBondContact O-N 2.98Å; F192-N196 PolarHBondContact O-ND2 3.49Å; F192-N196 VanDerWaalsContact O-ND2 3.13Å; D193-N196 PolarHBondContact O-N 2.91Å; L194-N196 VanDerWaalsContact C-N 3.33Å; L194-N196 PolarHBondContact O-N 2.84Å; N196-R199 PolarHBondContact OD1-NH1 3.21Å; N196-R200 WeakPolarHBondContact O-CB 3.33Å; N196-R200 PolarHBondContact O-N 3.19Å; N196-R200 VanDerWaalsContact O-N 3.08Å |
| 197 | H | 98.4 | Very high | 97.4 | Very high | 78 Ų | 78 | 93.6 Ų | 93.6 | 36% | 0.361 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -65 | -47.1 | 175.6 | -175 | 47.6 | 0 | 0 | 0 | 111.7 | D193 L194 E195 R200 L201 | D193-H197 WeakPolarHBondContact O-CB 3.29Å; D193-H197 PolarHBondContact O-N 3.47Å; L194-H197 PolarHBondContact O-N 3.5Å; E195-H197 VanDerWaalsContact C-N 3.34Å; E195-H197 PolarHBondContact O-N 3.32Å; H197-R200 PolarHBondContact ND1-NH2 3.49Å; H197-R200 PolarHBondContact O-N 3.27Å; H197-L201 WeakPolarHBondContact NE2-CD1 3.25Å; H197-L201 WeakPolarHBondContact O-CG 3.37Å; H197-L201 PolarHBondContact O-N 3.26Å |
| 198 | V | 98.4 | Very high | 97.1 | Very high | 70 Ų | 70 | 93.2 Ų | 93.2 | 42% | 0.424 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -58.1 | -50.1 | 175.5 | 169 | 0 | 0 | 0 | 0 | 110.3 | L194 E195 R200 L201 E202 | L194-V198 WeakPolarHBondContact O-CG2 3.38Å; L194-V198 PolarHBondContact O-N 2.78Å; E195-V198 PolarHBondContact O-N 3.04Å; V198-R200 VanDerWaalsContact C-N 3.29Å; V198-R200 PolarHBondContact O-N 3.03Å; V198-L201 CarbonylContact O-C 3.59Å; V198-L201 PolarHBondContact O-N 3.35Å; V198-L201 VanDerWaalsContact O-N 3.08Å; V198-E202 HydrophobicContact CG1-CG 4.09Å; V198-E202 WeakPolarHBondContact CG1-OE1 3.35Å; V198-E202 WeakPolarHBondContact O-CB 3.45Å; V198-E202 WeakPolarHBondContact O-CG 3.38Å; V198-E202 PolarHBondContact O-N 3.2Å |
| 199 | R | 98 | Very high | 96.6 | Very high | 140 Ų | 140 | 91.1 Ų | 91.1 | 53% | 0.528 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -57.7 | -41.6 | -179.8 | -166.9 | -173.5 | -56.6 | 117.7 | 6.2 | 112.5 | E195 N196 A203 | E195-R199 WeakPolarHBondContact O-CB 3.32Å; E195-R199 PolarHBondContact O-N 3.18Å; N196-R199 PolarHBondContact OD1-NH1 3.21Å; R199-A203 WeakPolarHBondContact O-CB 3.41Å; R199-A203 PolarHBondContact O-N 3.47Å |
| 200 | R | 98.1 | Very high | 96.1 | Very high | 140 Ų | 140 | 98.3 Ų | 98.3 | 53% | 0.528 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.1 | -48.4 | 174.8 | 168.8 | 174.5 | 42.3 | 139.7 | -3.7 | 111.4 | N196 H197 V198 E202 A203 E204 | N196-R200 WeakPolarHBondContact O-CB 3.33Å; N196-R200 PolarHBondContact O-N 3.19Å; N196-R200 VanDerWaalsContact O-N 3.08Å; H197-R200 PolarHBondContact ND1-NH2 3.49Å; H197-R200 PolarHBondContact O-N 3.27Å; V198-R200 VanDerWaalsContact C-N 3.29Å; V198-R200 PolarHBondContact O-N 3.03Å; R200-E202 VanDerWaalsContact C-N 3.31Å; R200-E202 PolarHBondContact O-N 2.86Å; R200-A203 WeakPolarHBondContact O-CB 3.49Å; R200-A203 PolarHBondContact O-N 3.32Å; R200-E204 WeakPolarHBondContact CG-OE1 3.35Å; R200-E204 WeakPolarHBondContact O-CG 3.42Å; R200-E204 PolarHBondContact O-N 2.97Å |
| 201 | L | 98.1 | Very high | 95.6 | Very high | 78 Ų | 78 | 97.7 Ų | 97.7 | 41% | 0.408 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.2 | -38.8 | 178.3 | -72.8 | 178.5 | 0 | 0 | 0 | 111.9 | H197 V198 E204 N205 | H197-L201 WeakPolarHBondContact NE2-CD1 3.25Å; H197-L201 WeakPolarHBondContact O-CG 3.37Å; H197-L201 PolarHBondContact O-N 3.26Å; V198-L201 CarbonylContact O-C 3.59Å; V198-L201 PolarHBondContact O-N 3.35Å; V198-L201 VanDerWaalsContact O-N 3.08Å; L201-E204 PolarHBondContact O-N 3.49Å; L201-N205 WeakPolarHBondContact O-CB 3.35Å; L201-N205 PolarHBondContact O-N 2.84Å |
| 202 | E | 96.9 | Very high | 95.2 | Very high | 124 Ų | 124 | 95.8 Ų | 95.8 | 58% | 0.579 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -63.7 | -41 | 175 | -74 | 175.8 | 161.4 | 0 | 0 | 111.7 | V198 R200 N205 S206 | V198-E202 HydrophobicContact CG1-CG 4.09Å; V198-E202 WeakPolarHBondContact CG1-OE1 3.35Å; V198-E202 WeakPolarHBondContact O-CB 3.45Å; V198-E202 WeakPolarHBondContact O-CG 3.38Å; V198-E202 PolarHBondContact O-N 3.2Å; R200-E202 VanDerWaalsContact C-N 3.31Å; R200-E202 PolarHBondContact O-N 2.86Å; E202-N205 PolarHBondContact O-N 3.04Å; E202-S206 WeakPolarHBondContact O-CB 3.07Å; E202-S206 PolarHBondContact O-N 3.06Å |
| 203 | A | 96.2 | Very high | 94.5 | Very high | 54 Ų | 54 | 94 Ų | 94 | 45% | 0.446 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64 | -47.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | R199 R200 S206 I207 | R199-A203 WeakPolarHBondContact O-CB 3.41Å; R199-A203 PolarHBondContact O-N 3.47Å; R200-A203 WeakPolarHBondContact O-CB 3.49Å; R200-A203 PolarHBondContact O-N 3.32Å; A203-S206 PolarHBondContact O-N 3.22Å; A203-I207 WeakPolarHBondContact O-CG1 3.27Å; A203-I207 PolarHBondContact O-N 3.16Å |
| 204 | E | 95.8 | Very high | 93.7 | Very high | 92 Ų | 92 | 95 Ų | 95 | 43% | 0.43 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -60 | -46.9 | 175.6 | -71.8 | 172.5 | -159.8 | 0 | 0 | 111.1 | R200 L201 S206 I207 L208 | R200-E204 WeakPolarHBondContact CG-OE1 3.35Å; R200-E204 WeakPolarHBondContact O-CG 3.42Å; R200-E204 PolarHBondContact O-N 2.97Å; L201-E204 PolarHBondContact O-N 3.49Å; E204-S206 VanDerWaalsContact C-N 3.34Å; E204-S206 PolarHBondContact O-N 3.43Å; E204-I207 PolarHBondContact O-N 3.08Å; E204-L208 VanDerWaalsContact O-CG 3.32Å; E204-L208 WeakPolarHBondContact O-CG 3.26Å; E204-L208 PolarHBondContact O-N 3.42Å |
| 205 | N | 94.4 | Very high | 92.9 | Very high | 72 Ų | 72 | 96.2 Ų | 96.2 | 39% | 0.385 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63.3 | -40.2 | 178.8 | -164.8 | -66 | 0 | 0 | 0 | 111.5 | L201 E202 I207 L208 K209 | L201-N205 WeakPolarHBondContact O-CB 3.35Å; L201-N205 PolarHBondContact O-N 2.84Å; E202-N205 PolarHBondContact O-N 3.04Å; N205-I207 VanDerWaalsContact C-N 3.33Å; N205-I207 PolarHBondContact O-N 3.04Å; N205-L208 PolarHBondContact O-N 2.94Å; N205-K209 WeakPolarHBondContact O-CB 3.4Å; N205-K209 VanDerWaalsContact O-CG 3.29Å; N205-K209 WeakPolarHBondContact O-CG 3.48Å; N205-K209 PolarHBondContact O-N 3.47Å; N205-K209 WeakPolarHBondContact OD1-CD 3.44Å; N205-K209 WeakPolarHBondContact OD1-CE 3.46Å; N205-K209 PolarHBondContact OD1-NZ 3.2Å; N205-K209 VanDerWaalsContact OD1-NZ 3.14Å |
| 206 | S | 92.2 | Very high | 92.1 | Very high | 57 Ų | 57 | 94.6 Ų | 94.6 | 40% | 0.399 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63 | -37.6 | 174.9 | 177.9 | 0 | 0 | 0 | 0 | 112.6 | E202 A203 E204 R210 | E202-S206 WeakPolarHBondContact O-CB 3.07Å; E202-S206 PolarHBondContact O-N 3.06Å; A203-S206 PolarHBondContact O-N 3.22Å; E204-S206 VanDerWaalsContact C-N 3.34Å; E204-S206 PolarHBondContact O-N 3.43Å; S206-R210 WeakPolarHBondContact O-CG 3.43Å; S206-R210 PolarHBondContact O-N 2.92Å; S206-R210 PolarHBondContact O-NE 3.36Å |
| 207 | I | 93.1 | Very high | 91.4 | Very high | 91 Ų | 91 | 93.8 Ų | 93.8 | 47% | 0.467 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -66.5 | -51.7 | 173 | -66.7 | 164.1 | 0 | 0 | 0 | 109.7 | A203 E204 N205 K209 R210 T211 | A203-I207 WeakPolarHBondContact O-CG1 3.27Å; A203-I207 PolarHBondContact O-N 3.16Å; E204-I207 PolarHBondContact O-N 3.08Å; N205-I207 VanDerWaalsContact C-N 3.33Å; N205-I207 PolarHBondContact O-N 3.04Å; I207-K209 VanDerWaalsContact C-N 3.34Å; I207-K209 PolarHBondContact O-N 3.16Å; I207-R210 PolarHBondContact O-N 3.32Å; I207-T211 PolarHBondContact O-N 2.89Å; I207-T211 PolarHBondContact O-OG1 3.49Å; I207-T211 VanDerWaalsContact O-OG1 3.04Å |
| 208 | L | 92.1 | Very high | 90.6 | Very high | 99 Ų | 99 | 95.9 Ų | 95.9 | 52% | 0.518 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -56.4 | -46.4 | -179.6 | -70.1 | 170.3 | 0 | 0 | 0 | 111.9 | E204 N205 R210 T211 I212 | E204-L208 VanDerWaalsContact O-CG 3.32Å; E204-L208 WeakPolarHBondContact O-CG 3.26Å; E204-L208 PolarHBondContact O-N 3.42Å; N205-L208 PolarHBondContact O-N 2.94Å; L208-R210 PolarHBondContact O-N 3.37Å; L208-T211 PolarHBondContact O-N 2.99Å; L208-T211 VanDerWaalsContact O-N 3.11Å; L208-I212 HydrophobicContact CB-CD1 4.17Å; L208-I212 WeakPolarHBondContact O-CB 3.44Å; L208-I212 WeakPolarHBondContact O-CD1 3.36Å; L208-I212 WeakPolarHBondContact O-CG1 3.21Å; L208-I212 PolarHBondContact O-N 2.97Å |
| 209 | K | 89.3 | Confident | 89.7 | Confident | 114 Ų | 114 | 98.4 Ų | 98.4 | 50% | 0.496 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -59.3 | -33.3 | 176.8 | -76.3 | 177.8 | 168.6 | 161.5 | 0 | 113.2 | N205 I207 L217 | N205-K209 WeakPolarHBondContact O-CB 3.4Å; N205-K209 VanDerWaalsContact O-CG 3.29Å; N205-K209 WeakPolarHBondContact O-CG 3.48Å; N205-K209 PolarHBondContact O-N 3.47Å; N205-K209 WeakPolarHBondContact OD1-CD 3.44Å; N205-K209 WeakPolarHBondContact OD1-CE 3.46Å; N205-K209 PolarHBondContact OD1-NZ 3.2Å; N205-K209 VanDerWaalsContact OD1-NZ 3.14Å; I207-K209 VanDerWaalsContact C-N 3.34Å; I207-K209 PolarHBondContact O-N 3.16Å; K209-L217 HydrophobicContact CB-CD1 4.16Å; K209-L217 HydrophobicContact CG-CD1 4.03Å |
| 210 | R | 88 | Confident | 88.9 | Confident | 185 Ų | 185 | 95.9 Ų | 95.9 | 70% | 0.698 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -78.8 | -28.8 | 176.6 | -72.8 | -178.7 | -70.9 | 161.5 | -2.6 | 112.9 | S206 I207 L208 | S206-R210 WeakPolarHBondContact O-CG 3.43Å; S206-R210 PolarHBondContact O-N 2.92Å; S206-R210 PolarHBondContact O-NE 3.36Å; I207-R210 PolarHBondContact O-N 3.32Å; L208-R210 PolarHBondContact O-N 3.37Å |
| 211 | T | 88.7 | Confident | 88 | Confident | 108 Ų | 108 | 94.8 Ų | 94.8 | 66% | 0.663 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -89.9 | -26.3 | -176.8 | -52.4 | 0 | 0 | 0 | 0 | 112.9 | I207 L208 | I207-T211 PolarHBondContact O-N 2.89Å; I207-T211 PolarHBondContact O-OG1 3.49Å; I207-T211 VanDerWaalsContact O-OG1 3.04Å; L208-T211 PolarHBondContact O-N 2.99Å; L208-T211 VanDerWaalsContact O-N 3.11Å |
| 212 | I | 88.4 | Confident | 87.1 | Confident | 52 Ų | 52 | 98.1 Ų | 98.1 | 27% | 0.267 | 50% | 0.504 | S | S | . | . | S | Bend | trans | -78.1 | 133.5 | -178.8 | -66.7 | 164.5 | 0 | 0 | 0 | 110.3 | L208 T216 L217 | L208-I212 HydrophobicContact CB-CD1 4.17Å; L208-I212 WeakPolarHBondContact O-CB 3.44Å; L208-I212 WeakPolarHBondContact O-CD1 3.36Å; L208-I212 WeakPolarHBondContact O-CG1 3.21Å; L208-I212 PolarHBondContact O-N 2.97Å; I212-T216 HydrophobicContact CG2-CG2 4.05Å; I212-L217 HydrophobicContact CG2-CB 4.2Å |
| 213 | P | 84.6 | Confident | 85.8 | Confident | 85 Ų | 85 | 100.7 Ų | 100.7 | 55% | 0.552 | 51% | 0.514 | S | S | * | . | trans | -56.5 | 139.1 | 173.3 | -25 | 34.1 | 0 | 0 | 0 | 112.4 | D215 T216 L217 | P213-D215 PolarHBondContact O-N 3.13Å; P213-D215 VanDerWaalsContact O-N 3.11Å; P213-T216 PolarHBondContact O-N 3.19Å; P213-L217 PolarHBondContact O-N 3.24Å | ||
| 214 | N | 82.4 | Confident | 84.1 | Confident | 118 Ų | 118 | 107.9 Ų | 107.9 | 63% | 0.631 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -54.2 | -35.7 | -174.8 | -78.2 | -70 | 0 | 0 | 0 | 113.9 | L217 K218 | N214-L217 PolarHBondContact O-N 3.4Å; N214-K218 VanDerWaalsContact O-CG 3.27Å; N214-K218 WeakPolarHBondContact O-CG 3.24Å; N214-K218 PolarHBondContact O-N 3.02Å |
| 215 | D | 81.2 | Confident | 83.5 | Confident | 112 Ų | 112 | 108.7 Ų | 108.7 | 60% | 0.599 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -70.5 | -38.3 | -179.4 | -63.5 | -29.8 | 0 | 0 | 0 | 112.3 | P213 K218 Q219 | P213-D215 PolarHBondContact O-N 3.13Å; P213-D215 VanDerWaalsContact O-N 3.11Å; D215-K218 IonicContact OD1-NZ 3.69Å; D215-Q219 WeakPolarHBondContact O-CG 3.46Å; D215-Q219 PolarHBondContact O-N 3.3Å |
| 216 | T | 82.6 | Confident | 82.9 | Confident | 68 Ų | 68 | 110.6 Ų | 110.6 | 42% | 0.417 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -66.7 | -41.3 | 172.5 | -50.7 | 0 | 0 | 0 | 0 | 111 | I212 P213 K218 Q219 L220 | I212-T216 HydrophobicContact CG2-CG2 4.05Å; P213-T216 PolarHBondContact O-N 3.19Å; T216-K218 PolarHBondContact O-N 3.28Å; T216-Q219 PolarHBondContact O-N 2.91Å; T216-L220 WeakPolarHBondContact O-CG 3.25Å; T216-L220 PolarHBondContact O-N 3.26Å; T216-L220 VanDerWaalsContact O-N 3.07Å |
| 217 | L | 82.1 | Confident | 82.4 | Confident | 33 Ų | 33 | 113.6 Ų | 113.6 | 17% | 0.173 | 57% | 0.567 | C | S | . | * | H | α-helix | trans | -62.4 | -41.9 | 178 | -167.8 | 122.7 | 0 | 0 | 0 | 112.2 | K209 I212 P213 N214 L220 H221 | K209-L217 HydrophobicContact CB-CD1 4.16Å; K209-L217 HydrophobicContact CG-CD1 4.03Å; I212-L217 HydrophobicContact CG2-CB 4.2Å; P213-L217 PolarHBondContact O-N 3.24Å; N214-L217 PolarHBondContact O-N 3.4Å; L217-L220 PolarHBondContact O-N 3.31Å; L217-H221 PolarHBondContact O-N 3.43Å |
| 218 | K | 81.8 | Confident | 81.7 | Confident | 121 Ų | 121 | 114.9 Ų | 114.9 | 53% | 0.526 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -60.9 | -43.7 | 173.9 | -72.4 | 168.4 | -171.1 | 168.6 | 0 | 112.1 | N214 D215 T216 L220 H221 L222 | N214-K218 VanDerWaalsContact O-CG 3.27Å; N214-K218 WeakPolarHBondContact O-CG 3.24Å; N214-K218 PolarHBondContact O-N 3.02Å; D215-K218 IonicContact OD1-NZ 3.69Å; T216-K218 PolarHBondContact O-N 3.28Å; K218-L220 VanDerWaalsContact C-N 3.28Å; K218-L220 PolarHBondContact O-N 3.3Å; K218-H221 PolarHBondContact O-N 2.88Å; K218-L222 WeakPolarHBondContact O-CD1 3.27Å; K218-L222 WeakPolarHBondContact O-CG 3.05Å; K218-L222 PolarHBondContact O-N 3.49Å; K218-L222 VanDerWaalsContact O-N 3.09Å |
| 219 | Q | 80.4 | Confident | 81.1 | Confident | 123 Ų | 123 | 115.9 Ų | 115.9 | 58% | 0.575 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.1 | -33.5 | 177.2 | -72.5 | -178.6 | 12 | 0 | 0 | 112.9 | D215 T216 | D215-Q219 WeakPolarHBondContact O-CG 3.46Å; D215-Q219 PolarHBondContact O-N 3.3Å; T216-Q219 PolarHBondContact O-N 2.91Å |
| 220 | L | 80.1 | Confident | 80.6 | Confident | 88 Ų | 88 | 116.1 Ų | 116.1 | 46% | 0.461 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -71.3 | -42.3 | 175 | -67.6 | 172.8 | 0 | 0 | 0 | 111.8 | T216 L217 K218 L222 K223 | T216-L220 WeakPolarHBondContact O-CG 3.25Å; T216-L220 PolarHBondContact O-N 3.26Å; T216-L220 VanDerWaalsContact O-N 3.07Å; L217-L220 PolarHBondContact O-N 3.31Å; K218-L220 VanDerWaalsContact C-N 3.28Å; K218-L220 PolarHBondContact O-N 3.3Å; L220-L222 VanDerWaalsContact C-N 3.25Å; L220-L222 PolarHBondContact O-N 3.41Å; L220-K223 PolarHBondContact O-N 3.48Å; L220-K223 VanDerWaalsContact O-N 3.15Å |
| 221 | H | 79.5 | Confident | 80 | Confident | 116 Ų | 116 | 111.1 Ų | 111.1 | 54% | 0.537 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64.2 | -26.8 | 175.6 | -78.4 | -178.7 | 0 | 0 | 0 | 113.8 | L217 K218 K223 | L217-H221 PolarHBondContact O-N 3.43Å; K218-H221 PolarHBondContact O-N 2.88Å; H221-K223 VanDerWaalsContact C-N 3.28Å |
| 222 | L | 78.6 | Confident | 79.4 | Confident | 148 Ų | 148 | 111.4 Ų | 111.4 | 78% | 0.775 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | -10.5 | 176 | -79.2 | 154.5 | 0 | 0 | 0 | 113.6 | K218 L220 | K218-L222 WeakPolarHBondContact O-CD1 3.27Å; K218-L222 WeakPolarHBondContact O-CG 3.05Å; K218-L222 PolarHBondContact O-N 3.49Å; K218-L222 VanDerWaalsContact O-N 3.09Å; L220-L222 VanDerWaalsContact C-N 3.25Å; L220-L222 PolarHBondContact O-N 3.41Å |
| 223 | K | 71.3 | Confident | 78.6 | Confident | 178 Ų | 178 | 116.3 Ų | 116.3 | 77% | 0.774 | 59% | 0.591 | S | S | * | * | trans | -109.4 | -4.6 | -174.6 | -77.3 | -177.8 | 174.7 | 179.3 | 0 | 114.5 | L220 H221 | L220-K223 PolarHBondContact O-N 3.48Å; L220-K223 VanDerWaalsContact O-N 3.15Å; H221-K223 VanDerWaalsContact C-N 3.28Å | ||
| 224 | L | 58.7 | Low | 78.1 | Confident | 206 Ų | 206 | 119.2 Ų | 119.2 | 100% | 1.079 | 60% | 0.595 | S | S | * | * | trans | -105.9 | 0 | 175.7 | -91.3 | 139.4 | 0 | 0 | 0 | 109.5 |
Retrieved 224 of 224 residues in 75.1 ms
(Link to these results)