| 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 | 39.4 | Very low | 48.1 | Very low | 244 Ų | 244 | 180.2 Ų | 180.2 | 100% | 1.202 | 87% | 0.869 | S | S | * | * | 0 | 124.4 | 0 | -68.8 | 180 | -137.9 | 0 | 0 | 108.7 | |||||
| 2 | R | 38.6 | Very low | 48.7 | Very low | 247 Ų | 247 | 171.4 Ų | 171.4 | 93% | 0.932 | 83% | 0.829 | S | S | * | * | trans | -69.8 | 126.1 | -179.7 | -89.3 | 178 | 170.4 | 144.7 | -3.2 | 110 | M4 | R2-M4 PolarHBondContact O-N 3.26Š| ||
| 3 | K | 45.7 | Very low | 49.1 | Very low | 210 Ų | 210 | 164.5 Ų | 164.5 | 91% | 0.913 | 81% | 0.806 | S | S | * | * | trans | -68.3 | 111.4 | 168.6 | -73.2 | -176.9 | 175 | -177.3 | 0 | 108.6 | A5 | K3-A5 PolarHBondContact O-N 3.08Š| ||
| 4 | M | 42.2 | Very low | 49.5 | Very low | 174 Ų | 174 | 161.8 Ų | 161.8 | 86% | 0.857 | 79% | 0.788 | S | S | * | * | trans | -84.1 | 102.8 | 168.4 | -68.5 | -101.5 | -99 | 0 | 0 | 107.2 | R2 L6 | R2-M4 PolarHBondContact O-N 3.26Å; M4-L6 PolarHBondContact O-N 3.08Å; M4-L6 VanDerWaalsContact O-N 3.14Å | ||
| 5 | A | 48 | Very low | 50 | Low | 95 Ų | 95 | 160 Ų | 160 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | trans | -71.4 | 102.7 | 171.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | K3 K7 | K3-A5 PolarHBondContact O-N 3.08Å; A5-K7 PolarHBondContact O-N 3Å; A5-K7 VanDerWaalsContact O-N 3.11Å | ||
| 6 | L | 49.5 | Very low | 50.4 | Low | 154 Ų | 154 | 153.6 Ų | 153.6 | 81% | 0.806 | 75% | 0.754 | S | S | * | * | trans | -69 | 107.9 | 168.8 | -83.7 | 102.4 | 0 | 0 | 0 | 108.3 | M4 K8 | M4-L6 PolarHBondContact O-N 3.08Å; M4-L6 VanDerWaalsContact O-N 3.14Å; L6-K8 PolarHBondContact O-N 3.42Å | ||
| 7 | K | 57.1 | Low | 50.7 | Low | 192 Ų | 192 | 149.4 Ų | 149.4 | 84% | 0.835 | 73% | 0.728 | S | S | * | * | trans | -54.3 | 127.8 | 167.2 | -67.9 | 176.9 | 178.9 | 178.7 | 0 | 107.7 | A5 L9 | A5-K7 PolarHBondContact O-N 3Å; A5-K7 VanDerWaalsContact O-N 3.11Å; K7-L9 PolarHBondContact O-N 3.28Å | ||
| 8 | K | 52.5 | Low | 51.1 | Low | 213 Ų | 213 | 144.9 Ų | 144.9 | 93% | 0.926 | 71% | 0.708 | S | S | * | * | trans | -58.1 | 107.5 | 171.7 | -66.9 | -169 | 177.3 | -172.2 | 0 | 108 | L6 K10 | L6-K8 PolarHBondContact O-N 3.42Å; K8-K10 PolarHBondContact O-N 3.32Å | ||
| 9 | L | 50.4 | Low | 51.4 | Low | 136 Ų | 136 | 144.5 Ų | 144.5 | 71% | 0.712 | 71% | 0.708 | S | S | * | * | trans | -77.6 | 123 | 177.9 | -152.9 | 72.3 | 0 | 0 | 0 | 107.9 | K7 V11 | K7-L9 PolarHBondContact O-N 3.28Å; L9-V11 PolarHBondContact O-N 3.34Å | ||
| 10 | K | 54.6 | Low | 51.6 | Low | 191 Ų | 191 | 144.7 Ų | 144.7 | 83% | 0.83 | 71% | 0.712 | S | S | * | * | trans | -55.5 | 130.1 | 177 | -96.4 | 175.6 | 172.2 | 176.9 | 0 | 109 | K8 I12 | K8-K10 PolarHBondContact O-N 3.32Å; K10-I12 PolarHBondContact O-N 2.94Å | ||
| 11 | V | 51.3 | Low | 51.7 | Low | 126 Ų | 126 | 141 Ų | 141 | 76% | 0.764 | 70% | 0.695 | S | S | * | * | trans | -57.4 | 110.7 | 165.1 | 179 | 0 | 0 | 0 | 0 | 106.6 | L9 | L9-V11 PolarHBondContact O-N 3.34Š| ||
| 12 | I | 55.5 | Low | 52.2 | Low | 75 Ų | 75 | 133.2 Ų | 133.2 | 39% | 0.385 | 66% | 0.658 | S | S | . | * | trans | -71.2 | 131.2 | 175.7 | -61.6 | 166.6 | 0 | 0 | 0 | 107.1 | K10 Y17 | K10-I12 PolarHBondContact O-N 2.94Å; I12-Y17 HydrophobicContact CB-CE2 3.75Å; I12-Y17 WeakPolarHBondContact CB-OH 3.48Å; I12-Y17 HydrophobicContact CG2-CD2 4.28Å; I12-Y17 HydrophobicContact CG2-CE1 4.4Å; I12-Y17 HydrophobicContact CG2-CE2 3.58Å; I12-Y17 WeakPolarHBondContact O-CE2 3.43Å | ||
| 13 | P | 53.9 | Low | 52.6 | Low | 81 Ų | 81 | 129.8 Ų | 129.8 | 53% | 0.526 | 65% | 0.65 | S | S | . | * | trans | -61.7 | 148 | -179.6 | -22.7 | 33.5 | 0 | 0 | 0 | 113 | E15 S16 Y17 | P13-E15 PolarHBondContact O-N 3.39Å; P13-S16 WeakPolarHBondContact O-CB 3.29Å; P13-S16 PolarHBondContact O-N 3.45Å; P13-S16 VanDerWaalsContact O-N 3.08Å; P13-Y17 WeakPolarHBondContact O-CD2 3.41Å | ||
| 14 | K | 54.6 | Low | 52.7 | Low | 127 Ų | 127 | 127.1 Ų | 127.1 | 55% | 0.552 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.8 | -34.7 | -177.6 | -72 | -177.7 | 177 | -175.2 | 0 | 112.6 | S16 Y17 | K14-S16 PolarHBondContact O-N 3.09Å; K14-Y17 PolarHBondContact O-N 3.2Å |
| 15 | E | 56.5 | Low | 53.3 | Low | 135 Ų | 135 | 124.4 Ų | 124.4 | 63% | 0.631 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -61.4 | -30 | 178.5 | -69.1 | 74.3 | -161.2 | 0 | 0 | 112.9 | P13 Y17 | P13-E15 PolarHBondContact O-N 3.39Å; E15-Y17 VanDerWaalsContact C-N 3.3Å; E15-Y17 PolarHBondContact O-N 3.11Å |
| 16 | S | 56.6 | Low | 53.4 | Low | 58 Ų | 58 | 128 Ų | 128 | 41% | 0.406 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -72.1 | -22.4 | -179.3 | -174.3 | 0 | 0 | 0 | 0 | 113.4 | P13 K14 | P13-S16 WeakPolarHBondContact O-CB 3.29Å; P13-S16 PolarHBondContact O-N 3.45Å; P13-S16 VanDerWaalsContact O-N 3.08Å; K14-S16 PolarHBondContact O-N 3.09Å |
| 17 | Y | 55.9 | Low | 53.5 | Low | 82 Ų | 82 | 127.4 Ų | 127.4 | 32% | 0.322 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -89.8 | -32.1 | -177.5 | -64.7 | -77.5 | 0 | 0 | 0 | 112.6 | I12 P13 K14 E15 L19 L20 I125 | I12-Y17 HydrophobicContact CB-CE2 3.75Å; I12-Y17 WeakPolarHBondContact CB-OH 3.48Å; I12-Y17 HydrophobicContact CG2-CD2 4.28Å; I12-Y17 HydrophobicContact CG2-CE1 4.4Å; I12-Y17 HydrophobicContact CG2-CE2 3.58Å; I12-Y17 WeakPolarHBondContact O-CE2 3.43Å; P13-Y17 WeakPolarHBondContact O-CD2 3.41Å; K14-Y17 PolarHBondContact O-N 3.2Å; E15-Y17 VanDerWaalsContact C-N 3.3Å; E15-Y17 PolarHBondContact O-N 3.11Å; Y17-L19 VanDerWaalsContact C-N 3.35Å; Y17-L20 PolarHBondContact O-N 3.17Å; Y17-I125 HydrophobicContact CG-CD1 4.26Å |
| 18 | L | 57.2 | Low | 53.1 | Low | 69 Ų | 69 | 125.3 Ų | 125.3 | 36% | 0.361 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -69.4 | -34.8 | 178.2 | -66.2 | 176.5 | 0 | 0 | 0 | 111.6 | L20 | L18-L20 VanDerWaalsContact C-N 3.31Å; L18-L20 PolarHBondContact O-N 3.47Å |
| 19 | L | 57.5 | Low | 52.8 | Low | 136 Ų | 136 | 122 Ų | 122 | 71% | 0.712 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.2 | -24.5 | 175.8 | -81.7 | 160.1 | 0 | 0 | 0 | 113.9 | Y17 L21 | Y17-L19 VanDerWaalsContact C-N 3.35Å; L19-L21 VanDerWaalsContact C-N 3.35Å |
| 20 | L | 55.7 | Low | 52.5 | Low | 149 Ų | 149 | 122.4 Ų | 122.4 | 78% | 0.78 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.2 | -8.8 | -175.3 | -133.8 | 118.7 | 0 | 0 | 0 | 113.3 | Y17 L18 | Y17-L20 PolarHBondContact O-N 3.17Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-L20 PolarHBondContact O-N 3.47Å |
| 21 | L | 52.3 | Low | 52 | Low | 68 Ų | 68 | 122.7 Ų | 122.7 | 36% | 0.356 | 63% | 0.626 | S | S | . | * | S | Bend | trans | -116 | 3.5 | -176.6 | -87.1 | 146.2 | 0 | 0 | 0 | 113 | L19 F23 | L19-L21 VanDerWaalsContact C-N 3.35Å; L21-F23 HydrophobicContact CD2-CE2 4.13Å; L21-F23 WeakPolarHBondContact O-CD2 3.37Å; L21-F23 PolarHBondContact O-N 2.65Å |
| 22 | D | 50 | Low | 51.2 | Low | 80 Ų | 80 | 122.4 Ų | 122.4 | 43% | 0.428 | 62% | 0.624 | S | S | . | * | trans | -70.6 | 89.8 | 158.8 | -86.6 | -7.2 | 0 | 0 | 0 | 106.3 | D24 K114 | D22-D24 PolarHBondContact O-N 3Å; D22-D24 VanDerWaalsContact O-N 3.1Å; D22-K114 VanDerWaalsContact CG-NZ 3.27Å; D22-K114 WeakPolarHBondContact OD1-CE 3.44Å; D22-K114 IonicContact OD1-NZ 2.75Å; D22-K114 PolarHBondContact OD1-NZ 3.06Å; D22-K114 IonicContact OD2-NZ 3.99Å; D22-K114 PolarHBondContact OD2-NZ 2.91Å | ||
| 23 | F | 47.1 | Very low | 50.5 | Low | 175 Ų | 175 | 123.3 Ų | 123.3 | 77% | 0.768 | 64% | 0.637 | S | S | * | * | trans | -60.3 | 110.6 | 161.8 | -69.5 | -87.6 | 0 | 0 | 0 | 105.9 | L21 D25 | L21-F23 HydrophobicContact CD2-CE2 4.13Å; L21-F23 WeakPolarHBondContact O-CD2 3.37Å; L21-F23 PolarHBondContact O-N 2.65Å; F23-D25 PolarHBondContact O-N 3.04Å; F23-D25 VanDerWaalsContact O-N 3.17Å | ||
| 24 | D | 49.5 | Very low | 49.8 | Very low | 154 Ų | 154 | 128.7 Ų | 128.7 | 82% | 0.824 | 66% | 0.655 | S | S | * | * | trans | -51.6 | 120 | 168.3 | -105.1 | -27.6 | 0 | 0 | 0 | 107.7 | D22 E26 | D22-D24 PolarHBondContact O-N 3Å; D22-D24 VanDerWaalsContact O-N 3.1Å; D24-E26 VanDerWaalsContact C-N 3.3Å; D24-E26 PolarHBondContact O-N 3.39Å | ||
| 25 | D | 54.5 | Low | 49.3 | Very low | 117 Ų | 117 | 130.7 Ų | 130.7 | 63% | 0.626 | 67% | 0.667 | S | S | * | * | trans | -61.4 | 99.4 | 158.5 | -83.9 | -42.7 | 0 | 0 | 0 | 105.8 | F23 D27 | F23-D25 PolarHBondContact O-N 3.04Å; F23-D25 VanDerWaalsContact O-N 3.17Å; D25-D27 PolarHBondContact O-N 3Å | ||
| 26 | E | 49.4 | Very low | 48.5 | Very low | 171 Ų | 171 | 128.4 Ų | 128.4 | 80% | 0.799 | 67% | 0.671 | S | S | * | * | trans | -57.9 | 109.8 | 158.3 | -76.7 | -80.5 | 176.8 | 0 | 0 | 106.1 | D24 D28 | D24-E26 VanDerWaalsContact C-N 3.3Å; D24-E26 PolarHBondContact O-N 3.39Å; E26-D28 PolarHBondContact O-N 3.34Å | ||
| 27 | D | 52.2 | Low | 47.4 | Very low | 141 Ų | 141 | 134 Ų | 134 | 75% | 0.754 | 70% | 0.695 | S | S | * | * | trans | -57.2 | 86.1 | 169.7 | -73.6 | -51.4 | 0 | 0 | 0 | 108.8 | D25 D29 | D25-D27 PolarHBondContact O-N 3Å; D27-D29 PolarHBondContact O-N 3.2Å | ||
| 28 | D | 48 | Very low | 47 | Very low | 148 Ų | 148 | 135.3 Ų | 135.3 | 79% | 0.791 | 72% | 0.717 | S | S | * | * | trans | -69 | 84.7 | 160.7 | -89.2 | -26.4 | 0 | 0 | 0 | 107.1 | E26 I30 | E26-D28 PolarHBondContact O-N 3.34Å; D28-I30 VanDerWaalsContact C-N 3.25Å; D28-I30 PolarHBondContact O-N 3Å | ||
| 29 | D | 45.8 | Very low | 46.2 | Very low | 144 Ų | 144 | 139.9 Ų | 139.9 | 77% | 0.77 | 74% | 0.736 | S | S | * | * | trans | -52.8 | 91.1 | 163.2 | -88.6 | -29.3 | 0 | 0 | 0 | 108.5 | D27 K31 | D27-D29 PolarHBondContact O-N 3.2Å; D29-K31 PolarHBondContact O-N 2.92Å | ||
| 30 | I | 43.5 | Very low | 45.1 | Very low | 144 Ų | 144 | 140.4 Ų | 140.4 | 74% | 0.738 | 74% | 0.744 | S | S | * | * | trans | -69.6 | 81.7 | 167.5 | -52.5 | 179.4 | 0 | 0 | 0 | 106.9 | D28 V32 | D28-I30 VanDerWaalsContact C-N 3.25Å; D28-I30 PolarHBondContact O-N 3Å; I30-V32 HydrophobicContact CG2-CG2 3.78Å; I30-V32 PolarHBondContact O-N 3.21Å | ||
| 31 | K | 44.5 | Very low | 44.4 | Very low | 196 Ų | 196 | 141.7 Ų | 141.7 | 85% | 0.852 | 74% | 0.744 | S | S | * | * | trans | -62.8 | 89.5 | 157 | -90.5 | -175.5 | 176.8 | 178.7 | 0 | 107.6 | D29 S33 | D29-K31 PolarHBondContact O-N 2.92Å; K31-S33 PolarHBondContact O-N 3.11Å | ||
| 32 | V | 35.7 | Very low | 44 | Very low | 120 Ų | 120 | 143.5 Ų | 143.5 | 73% | 0.727 | 76% | 0.762 | S | S | * | * | trans | -64.5 | 103.7 | 160.6 | 173.1 | 0 | 0 | 0 | 0 | 106.5 | I30 E34 | I30-V32 HydrophobicContact CG2-CG2 3.78Å; I30-V32 PolarHBondContact O-N 3.21Å; V32-E34 PolarHBondContact O-N 3.43Å; V32-E34 VanDerWaalsContact O-N 3.12Å | ||
| 33 | S | 39.6 | Very low | 43.5 | Very low | 94 Ų | 94 | 145.8 Ų | 145.8 | 66% | 0.657 | 78% | 0.781 | S | S | * | * | trans | -58.9 | 107.2 | 169.5 | -177 | 0 | 0 | 0 | 0 | 109.2 | K31 E35 | K31-S33 PolarHBondContact O-N 3.11Å; S33-E35 VanDerWaalsContact C-N 3.29Å; S33-E35 PolarHBondContact O-N 2.75Å | ||
| 34 | E | 40.6 | Very low | 43.2 | Very low | 195 Ų | 195 | 142 Ų | 142 | 91% | 0.911 | 78% | 0.782 | S | S | * | * | trans | -85.3 | 73.7 | 168.1 | -167.8 | 176.5 | -158.1 | 0 | 0 | 107.9 | V32 | V32-E34 PolarHBondContact O-N 3.43Å; V32-E34 VanDerWaalsContact O-N 3.12Å | ||
| 35 | E | 42.3 | Very low | 42.6 | Very low | 169 Ų | 169 | 144 Ų | 144 | 79% | 0.79 | 78% | 0.784 | S | S | * | * | trans | -150 | 136.1 | 175.2 | -121.3 | 167.2 | -175.2 | 0 | 0 | 110.8 | S33 | S33-E35 VanDerWaalsContact C-N 3.29Å; S33-E35 PolarHBondContact O-N 2.75Å | ||
| 36 | A | 40.1 | Very low | 41.7 | Very low | 87 Ų | 87 | 145.5 Ų | 145.5 | 72% | 0.719 | 79% | 0.792 | S | S | * | * | trans | 75.1 | 107.6 | -170 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 37 | L | 34.8 | Very low | 41.8 | Very low | 175 Ų | 175 | 147.1 Ų | 147.1 | 92% | 0.916 | 80% | 0.797 | S | S | * | * | -148.1 | 98.5 | 63.2 | -69.6 | 166.5 | 0 | 0 | 0 | 110.8 | |||||
| 38 | S | 46.3 | Very low | 41.1 | Very low | 110 Ų | 110 | 147.6 Ų | 147.6 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | trans | -73.7 | 156 | 153.9 | 53.9 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 39 | E | 41.4 | Very low | 40.9 | Very low | 164 Ų | 164 | 148.9 Ų | 148.9 | 77% | 0.766 | 80% | 0.8 | S | S | * | * | trans | 91.4 | 66.2 | 161.8 | -144.8 | 168.3 | -163.7 | 0 | 0 | 116.6 | K41 | E39-K41 VanDerWaalsContact C-N 3.35Å; E39-K41 PolarHBondContact O-N 2.98Å | ||
| 40 | V | 33.8 | Very low | 40.5 | Very low | 147 Ų | 147 | 148.6 Ų | 148.6 | 89% | 0.891 | 80% | 0.799 | S | S | * | * | trans | -73.4 | 98 | 146.9 | 173.6 | 0 | 0 | 0 | 0 | 107 | S42 | V40-S42 PolarHBondContact O-N 3.45Š| ||
| 41 | K | 40.9 | Very low | 40.2 | Very low | 176 Ų | 176 | 148.8 Ų | 148.8 | 77% | 0.765 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -51.1 | 125 | 165.7 | -99 | 170.4 | 172.2 | 169.6 | 0 | 110.2 | E39 | E39-K41 VanDerWaalsContact C-N 3.35Å; E39-K41 PolarHBondContact O-N 2.98Å |
| 42 | S | 44.9 | Very low | 40.1 | Very low | 107 Ų | 107 | 144.2 Ų | 144.2 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 139.9 | 164.5 | -34 | 0 | 0 | 0 | 0 | 109.8 | V40 A44 | V40-S42 PolarHBondContact O-N 3.45Å; S42-A44 PolarHBondContact O-N 3.36Å |
| 43 | P | 39.5 | Very low | 40.3 | Very low | 127 Ų | 127 | 144.1 Ų | 144.1 | 83% | 0.825 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 131.6 | 172.7 | -8.5 | 24.3 | 0 | 0 | 0 | 108.9 | F45 | P43-F45 PolarHBondContact O-N 3.18Š|
| 44 | A | 39.2 | Very low | 40.7 | Very low | 95 Ų | 95 | 149 Ų | 149 | 79% | 0.785 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 129 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | S42 D46 | S42-A44 PolarHBondContact O-N 3.36Å; A44-D46 PolarHBondContact O-N 3.04Å |
| 45 | F | 37.3 | Very low | 40.6 | Very low | 198 Ų | 198 | 144 Ų | 144 | 87% | 0.868 | 80% | 0.799 | S | S | * | * | trans | -79.1 | 114.4 | 171.4 | -143.4 | -91.9 | 0 | 0 | 0 | 107.9 | P43 K47 | P43-F45 PolarHBondContact O-N 3.18Å; F45-K47 PolarHBondContact O-N 2.78Å | ||
| 46 | D | 36.1 | Very low | 40.6 | Very low | 147 Ų | 147 | 145.6 Ų | 145.6 | 79% | 0.786 | 81% | 0.806 | S | S | * | * | trans | -65.5 | 122.4 | 171.5 | -86.3 | -34.2 | 0 | 0 | 0 | 109 | A44 N48 | A44-D46 PolarHBondContact O-N 3.04Å; D46-N48 PolarHBondContact O-N 3.01Å; D46-N48 VanDerWaalsContact O-N 3.16Å | ||
| 47 | K | 52 | Low | 40.9 | Very low | 206 Ų | 206 | 145.3 Ų | 145.3 | 90% | 0.896 | 80% | 0.804 | S | S | * | * | trans | -70.4 | 105.5 | 171.5 | -66.7 | -178.7 | 177.6 | -176.6 | 0 | 108.1 | F45 E49 | F45-K47 PolarHBondContact O-N 2.78Å; K47-E49 PolarHBondContact O-N 3.45Å | ||
| 48 | N | 37.6 | Very low | 41.8 | Very low | 151 Ų | 151 | 143.3 Ų | 143.3 | 81% | 0.807 | 79% | 0.794 | S | S | * | * | trans | -83.8 | 108 | 164.3 | 64 | -10 | 0 | 0 | 0 | 109.3 | D46 | D46-N48 PolarHBondContact O-N 3.01Å; D46-N48 VanDerWaalsContact O-N 3.16Å | ||
| 49 | E | 42.9 | Very low | 42.2 | Very low | 174 Ų | 174 | 146.4 Ų | 146.4 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | trans | -72.9 | 141.8 | 167 | -137.1 | 170.8 | -163.7 | 0 | 0 | 109 | K47 | K47-E49 PolarHBondContact O-N 3.45Š| ||
| 50 | N | 37.7 | Very low | 43.1 | Very low | 138 Ų | 138 | 145 Ų | 145 | 74% | 0.738 | 79% | 0.794 | S | S | * | * | trans | 78.2 | 132.6 | 162.1 | -91.1 | -49.2 | 0 | 0 | 0 | 116.8 | ||||
| 51 | I | 36.7 | Very low | 44.6 | Very low | 148 Ų | 148 | 143.2 Ų | 143.2 | 76% | 0.759 | 78% | 0.777 | S | S | * | * | cis | -154.9 | 138.3 | 27.2 | -59 | 177.8 | 0 | 0 | 0 | 108.7 | ||||
| 52 | S | 42 | Very low | 46 | Very low | 100 Ų | 100 | 136.8 Ų | 136.8 | 70% | 0.699 | 76% | 0.761 | S | S | * | * | trans | -76.2 | 134.2 | 171.7 | 172.8 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 53 | P | 40.7 | Very low | 47.6 | Very low | 118 Ų | 118 | 137.8 Ų | 137.8 | 77% | 0.766 | 76% | 0.758 | S | S | * | * | trans | -92.2 | 114.6 | 147.2 | 2.5 | 17.4 | 0 | 0 | 0 | 108.1 | A55 | P53-A55 PolarHBondContact O-N 3.49Å; P53-A55 VanDerWaalsContact O-N 3.11Å | ||
| 54 | Q | 46.9 | Very low | 49.5 | Very low | 197 Ų | 197 | 136.3 Ų | 136.3 | 92% | 0.921 | 74% | 0.74 | S | S | * | * | trans | -55.6 | 109.3 | 172.6 | -162.7 | 177.8 | 6.4 | 0 | 0 | 109.5 | ||||
| 55 | A | 40.2 | Very low | 51.5 | Low | 90 Ų | 90 | 135.6 Ų | 135.6 | 74% | 0.744 | 73% | 0.726 | S | S | * | * | trans | -117.5 | 134.8 | 164.4 | 0 | 0 | 0 | 0 | 0 | 107.5 | P53 | P53-A55 PolarHBondContact O-N 3.49Å; P53-A55 VanDerWaalsContact O-N 3.11Å | ||
| 56 | E | 41.9 | Very low | 53.8 | Low | 202 Ų | 202 | 130.7 Ų | 130.7 | 94% | 0.944 | 71% | 0.708 | S | S | * | * | trans | -53.7 | 134.6 | -171 | -61.8 | 173.9 | 166.9 | 0 | 0 | 111.9 | D58 | E56-D58 PolarHBondContact O-N 3.39Š| ||
| 57 | A | 46.3 | Very low | 56.1 | Low | 81 Ų | 81 | 126.1 Ų | 126.1 | 67% | 0.669 | 69% | 0.688 | S | S | * | * | trans | -81.1 | 113.9 | -174 | 0 | 0 | 0 | 0 | 0 | 111.4 | E59 | A57-E59 HydrophobicContact CB-CG 4Š| ||
| 58 | D | 52.6 | Low | 57.8 | Low | 134 Ų | 134 | 121.3 Ų | 121.3 | 72% | 0.717 | 67% | 0.67 | S | S | * | * | trans | -85.2 | 95.4 | 140.4 | -91.6 | -29.7 | 0 | 0 | 0 | 106.2 | E56 D60 M61 | E56-D58 PolarHBondContact O-N 3.39Å; D58-D60 PolarHBondContact O-N 3.21Å; D58-M61 PolarHBondContact O-N 2.99Å | ||
| 59 | E | 55.8 | Low | 60.3 | Low | 175 Ų | 175 | 118.7 Ų | 118.7 | 82% | 0.818 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -61.9 | -9.8 | -178.7 | -75.8 | -178.5 | 154.2 | 0 | 0 | 113.7 | A57 | A57-E59 HydrophobicContact CB-CG 4Å |
| 60 | D | 60.7 | Low | 62.6 | Low | 133 Ų | 133 | 115.6 Ų | 115.6 | 71% | 0.711 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -84.6 | -23.3 | -177.1 | -163.4 | 35.7 | 0 | 0 | 0 | 113.7 | D58 | D58-D60 PolarHBondContact O-N 3.21Å |
| 61 | M | 63.8 | Low | 65.2 | Low | 111 Ų | 111 | 114.9 Ų | 114.9 | 55% | 0.547 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -90 | -21.4 | -173.5 | -68.9 | -72.5 | 172.7 | 0 | 0 | 114.1 | D58 V65 | D58-M61 PolarHBondContact O-N 2.99Å; M61-V65 WeakPolarHBondContact O-CG2 3.46Å; M61-V65 PolarHBondContact O-N 3Å |
| 62 | G | 72.3 | Confident | 67.8 | Low | 40 Ų | 40 | 110.4 Ų | 110.4 | 41% | 0.412 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -70.8 | -47 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | E64 V65 D66 | G62-E64 VanDerWaalsContact C-N 3.25Å; G62-E64 PolarHBondContact O-N 3.07Å; G62-V65 PolarHBondContact O-N 3.43Å; G62-D66 PolarHBondContact O-N 3.29Å |
| 63 | D | 77.8 | Confident | 70.2 | Confident | 128 Ų | 128 | 112 Ų | 112 | 68% | 0.684 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -62.6 | -33 | 177.6 | -75.3 | -4.4 | 0 | 0 | 0 | 112 | S67 | D63-S67 VanDerWaalsContact O-CB 3.22Å; D63-S67 WeakPolarHBondContact O-CB 3.47Å; D63-S67 PolarHBondContact O-N 3.3Å |
| 64 | E | 78.7 | Confident | 72.8 | Confident | 97 Ų | 97 | 109.9 Ų | 109.9 | 45% | 0.453 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -68.1 | -44.2 | 174.7 | -177.8 | 170.3 | -167.3 | 0 | 0 | 111.8 | G62 S67 M68 | G62-E64 VanDerWaalsContact C-N 3.25Å; G62-E64 PolarHBondContact O-N 3.07Å; E64-S67 PolarHBondContact O-N 2.96Å; E64-M68 HydrophobicContact CG-CE 3.65Å; E64-M68 VanDerWaalsContact O-CG 3.3Å; E64-M68 WeakPolarHBondContact O-CG 3.38Å; E64-M68 PolarHBondContact O-N 2.97Å; E64-M68 WeakPolarHBondContact OE1-CE 3.19Å |
| 65 | V | 81.7 | Confident | 75.1 | Confident | 80 Ų | 80 | 105 Ų | 105 | 49% | 0.485 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.9 | -43.9 | 177.6 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | M61 G62 M68 L69 | M61-V65 WeakPolarHBondContact O-CG2 3.46Å; M61-V65 PolarHBondContact O-N 3Å; G62-V65 PolarHBondContact O-N 3.43Å; V65-M68 PolarHBondContact O-N 3.26Å; V65-L69 HydrophobicContact CG1-CD1 4.19Å; V65-L69 WeakPolarHBondContact O-CG 3.44Å; V65-L69 PolarHBondContact O-N 3.06Å |
| 66 | D | 85 | Confident | 77.8 | Confident | 95 Ų | 95 | 105.4 Ų | 105.4 | 51% | 0.508 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.2 | -41.4 | 176.5 | -74.4 | -17.2 | 0 | 0 | 0 | 111.2 | G62 M68 L69 D70 | G62-D66 PolarHBondContact O-N 3.29Å; D66-M68 VanDerWaalsContact C-N 3.29Å; D66-M68 PolarHBondContact O-N 2.99Å; D66-L69 PolarHBondContact O-N 3.4Å; D66-D70 PolarHBondContact O-N 2.96Å |
| 67 | S | 86 | Confident | 80.4 | Confident | 50 Ų | 50 | 102.8 Ų | 102.8 | 35% | 0.35 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -60.5 | -36.6 | 173.2 | -171.6 | 0 | 0 | 0 | 0 | 113.1 | D63 E64 K71 | D63-S67 VanDerWaalsContact O-CB 3.22Å; D63-S67 WeakPolarHBondContact O-CB 3.47Å; D63-S67 PolarHBondContact O-N 3.3Å; E64-S67 PolarHBondContact O-N 2.96Å; S67-K71 WeakPolarHBondContact O-CD 3.5Å; S67-K71 VanDerWaalsContact O-CG 3.23Å; S67-K71 WeakPolarHBondContact O-CG 3.47Å; S67-K71 PolarHBondContact O-N 2.97Å; S67-K71 PolarHBondContact OG-NZ 3.21Å; S67-K71 VanDerWaalsContact OG-NZ 3.14Å |
| 68 | M | 87.5 | Confident | 82.8 | Confident | 105 Ų | 105 | 103.4 Ų | 103.4 | 52% | 0.517 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -71.4 | -38.2 | 175.7 | -72.8 | -177 | -172.9 | 0 | 0 | 111.9 | E64 V65 D66 S72 | E64-M68 HydrophobicContact CG-CE 3.65Å; E64-M68 VanDerWaalsContact O-CG 3.3Å; E64-M68 WeakPolarHBondContact O-CG 3.38Å; E64-M68 PolarHBondContact O-N 2.97Å; E64-M68 WeakPolarHBondContact OE1-CE 3.19Å; V65-M68 PolarHBondContact O-N 3.26Å; D66-M68 VanDerWaalsContact C-N 3.29Å; D66-M68 PolarHBondContact O-N 2.99Å; M68-S72 WeakPolarHBondContact O-CB 3.49Å; M68-S72 PolarHBondContact O-N 3.19Å |
| 69 | L | 90 | Very high | 84.9 | Confident | 97 Ų | 97 | 101.4 Ų | 101.4 | 51% | 0.508 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.8 | -46.4 | 176.2 | -72.4 | 173.2 | 0 | 0 | 0 | 111.6 | V65 D66 K71 S72 E73 | V65-L69 HydrophobicContact CG1-CD1 4.19Å; V65-L69 WeakPolarHBondContact O-CG 3.44Å; V65-L69 PolarHBondContact O-N 3.06Å; D66-L69 PolarHBondContact O-N 3.4Å; L69-K71 VanDerWaalsContact C-N 3.32Å; L69-K71 PolarHBondContact O-N 3.01Å; L69-S72 CarbonylContact O-C 3.58Å; L69-S72 WeakPolarHBondContact O-CA 3.43Å; L69-S72 WeakPolarHBondContact O-CB 3.44Å; L69-S72 PolarHBondContact O-N 3.47Å; L69-S72 PolarHBondContact O-OG 3.44Å; L69-E73 PolarHBondContact O-N 3.41Å |
| 70 | D | 90.3 | Very high | 86.9 | Confident | 109 Ų | 109 | 97.9 Ų | 97.9 | 58% | 0.583 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -58.1 | -43.6 | 176.4 | -83 | -4.9 | 0 | 0 | 0 | 112 | D66 S72 E73 D74 | D66-D70 PolarHBondContact O-N 2.96Å; D70-S72 VanDerWaalsContact C-N 3.32Å; D70-S72 PolarHBondContact O-N 3.27Å; D70-E73 PolarHBondContact O-N 3.3Å; D70-D74 PolarHBondContact O-N 3.5Å |
| 71 | K | 92 | Very high | 88.6 | Confident | 123 Ų | 123 | 95 Ų | 95 | 54% | 0.535 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.1 | -40.8 | 174.6 | -72.8 | 166 | -170.3 | 154.5 | 0 | 111.5 | S67 L69 D74 D75 | S67-K71 WeakPolarHBondContact O-CD 3.5Å; S67-K71 VanDerWaalsContact O-CG 3.23Å; S67-K71 WeakPolarHBondContact O-CG 3.47Å; S67-K71 PolarHBondContact O-N 2.97Å; S67-K71 PolarHBondContact OG-NZ 3.21Å; S67-K71 VanDerWaalsContact OG-NZ 3.14Å; L69-K71 VanDerWaalsContact C-N 3.32Å; L69-K71 PolarHBondContact O-N 3.01Å; K71-D74 PolarHBondContact O-N 2.88Å; K71-D75 WeakPolarHBondContact O-CB 3.49Å; K71-D75 PolarHBondContact O-N 3.12Å |
| 72 | S | 90.9 | Very high | 90.2 | Very high | 53 Ų | 53 | 95.4 Ų | 95.4 | 37% | 0.371 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.9 | -38 | 177.3 | 81.3 | 0 | 0 | 0 | 0 | 112.3 | M68 L69 D70 D75 I76 | M68-S72 WeakPolarHBondContact O-CB 3.49Å; M68-S72 PolarHBondContact O-N 3.19Å; L69-S72 CarbonylContact O-C 3.58Å; L69-S72 WeakPolarHBondContact O-CA 3.43Å; L69-S72 WeakPolarHBondContact O-CB 3.44Å; L69-S72 PolarHBondContact O-N 3.47Å; L69-S72 PolarHBondContact O-OG 3.44Å; D70-S72 VanDerWaalsContact C-N 3.32Å; D70-S72 PolarHBondContact O-N 3.27Å; S72-D75 PolarHBondContact O-N 3.09Å; S72-I76 WeakPolarHBondContact O-CB 3.44Å; S72-I76 WeakPolarHBondContact O-CD1 3.46Å; S72-I76 WeakPolarHBondContact O-CG1 3.48Å; S72-I76 PolarHBondContact O-N 3.36Å |
| 73 | E | 93.7 | Very high | 91.5 | Very high | 134 Ų | 134 | 99 Ų | 99 | 63% | 0.626 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.6 | -44.9 | 176.5 | -174.4 | 175.3 | 177 | 0 | 0 | 111.3 | L69 D70 D75 I76 Y77 | L69-E73 PolarHBondContact O-N 3.41Å; D70-E73 PolarHBondContact O-N 3.3Å; E73-D75 PolarHBondContact O-N 3.06Å; E73-I76 PolarHBondContact O-N 2.98Å; E73-Y77 WeakPolarHBondContact O-CB 3.49Å; E73-Y77 PolarHBondContact O-N 3.14Å |
| 74 | D | 94.9 | Very high | 92.4 | Very high | 74 Ų | 74 | 99.1 Ų | 99.1 | 40% | 0.396 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.5 | -42.1 | 176.4 | -173.6 | 33.9 | 0 | 0 | 0 | 111.6 | D70 K71 Y77 K78 | D70-D74 PolarHBondContact O-N 3.5Å; K71-D74 PolarHBondContact O-N 2.88Å; D74-Y77 PolarHBondContact O-N 3.3Å; D74-K78 VanDerWaalsContact CG-CE 3.46Å; D74-K78 WeakPolarHBondContact O-CB 3.42Å; D74-K78 VanDerWaalsContact O-CG 3.3Å; D74-K78 WeakPolarHBondContact O-CG 3.48Å; D74-K78 PolarHBondContact O-N 3.42Å; D74-K78 VanDerWaalsContact OD1-CE 3.27Å; D74-K78 WeakPolarHBondContact OD1-CE 3.37Å; D74-K78 IonicContact OD1-NZ 2.6Å; D74-K78 WeakPolarHBondContact OD2-CE 3.45Å; D74-K78 IonicContact OD2-NZ 2.67Å; D74-K78 PolarHBondContact OD2-NZ 2.91Å |
| 75 | D | 95.4 | Very high | 93.3 | Very high | 93 Ų | 93 | 99.2 Ų | 99.2 | 50% | 0.497 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.9 | -39.2 | 176.3 | -78 | -14.1 | 0 | 0 | 0 | 112.5 | K71 S72 E73 T79 | K71-D75 WeakPolarHBondContact O-CB 3.49Å; K71-D75 PolarHBondContact O-N 3.12Å; S72-D75 PolarHBondContact O-N 3.09Å; E73-D75 PolarHBondContact O-N 3.06Å; D75-T79 VanDerWaalsContact O-CB 3.3Å; D75-T79 WeakPolarHBondContact O-CB 3.49Å; D75-T79 PolarHBondContact O-N 3.27Å; D75-T79 PolarHBondContact O-OG1 3.2Å |
| 76 | I | 95.8 | Very high | 94.1 | Very high | 100 Ų | 100 | 103.2 Ų | 103.2 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.8 | -48.4 | 172.3 | -71.2 | 163.6 | 0 | 0 | 0 | 109.7 | S72 E73 K78 T79 L80 | S72-I76 WeakPolarHBondContact O-CB 3.44Å; S72-I76 WeakPolarHBondContact O-CD1 3.46Å; S72-I76 WeakPolarHBondContact O-CG1 3.48Å; S72-I76 PolarHBondContact O-N 3.36Å; E73-I76 PolarHBondContact O-N 2.98Å; I76-K78 PolarHBondContact O-N 3.49Å; I76-T79 PolarHBondContact O-N 3.43Å; I76-L80 HydrophobicContact CG2-CD1 3.85Å; I76-L80 HydrophobicContact CG2-CG 4.34Å; I76-L80 WeakPolarHBondContact O-CB 3.37Å; I76-L80 VanDerWaalsContact O-CG 3.32Å; I76-L80 WeakPolarHBondContact O-CG 3.45Å; I76-L80 PolarHBondContact O-N 2.85Å |
| 77 | Y | 96.9 | Very high | 94.7 | Very high | 146 Ų | 146 | 102.4 Ų | 102.4 | 57% | 0.573 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -60.5 | -47.7 | -179.5 | 179 | -99 | 0 | 0 | 0 | 111.8 | E73 D74 T79 L80 H81 | E73-Y77 WeakPolarHBondContact O-CB 3.49Å; E73-Y77 PolarHBondContact O-N 3.14Å; D74-Y77 PolarHBondContact O-N 3.3Å; Y77-T79 PolarHBondContact O-N 3.4Å; Y77-L80 PolarHBondContact O-N 3.09Å; Y77-H81 WeakPolarHBondContact O-CB 3.32Å; Y77-H81 PolarHBondContact O-N 2.98Å |
| 78 | K | 96.8 | Very high | 95.2 | Very high | 95 Ų | 95 | 104.3 Ų | 104.3 | 41% | 0.413 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.4 | -46.3 | 176.3 | -73.5 | 170.5 | -171.3 | 157.3 | 0 | 111.7 | D74 I76 L80 H81 I82 | D74-K78 VanDerWaalsContact CG-CE 3.46Å; D74-K78 WeakPolarHBondContact O-CB 3.42Å; D74-K78 VanDerWaalsContact O-CG 3.3Å; D74-K78 WeakPolarHBondContact O-CG 3.48Å; D74-K78 PolarHBondContact O-N 3.42Å; D74-K78 VanDerWaalsContact OD1-CE 3.27Å; D74-K78 WeakPolarHBondContact OD1-CE 3.37Å; D74-K78 IonicContact OD1-NZ 2.6Å; D74-K78 WeakPolarHBondContact OD2-CE 3.45Å; D74-K78 IonicContact OD2-NZ 2.67Å; D74-K78 PolarHBondContact OD2-NZ 2.91Å; I76-K78 PolarHBondContact O-N 3.49Å; K78-L80 PolarHBondContact O-N 3.5Å; K78-H81 PolarHBondContact O-N 3.32Å; K78-I82 WeakPolarHBondContact O-CG1 3.32Å; K78-I82 PolarHBondContact O-N 3.46Å |
| 79 | T | 97.6 | Very high | 95.7 | Very high | 92 Ų | 92 | 102.6 Ų | 102.6 | 56% | 0.564 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.8 | -45.4 | 179.6 | -60.9 | 0 | 0 | 0 | 0 | 111.2 | D75 I76 Y77 H81 I82 K83 | D75-T79 VanDerWaalsContact O-CB 3.3Å; D75-T79 WeakPolarHBondContact O-CB 3.49Å; D75-T79 PolarHBondContact O-N 3.27Å; D75-T79 PolarHBondContact O-OG1 3.2Å; I76-T79 PolarHBondContact O-N 3.43Å; Y77-T79 PolarHBondContact O-N 3.4Å; T79-H81 VanDerWaalsContact C-N 3.35Å; T79-H81 PolarHBondContact O-N 3.45Å; T79-I82 PolarHBondContact O-N 3.39Å; T79-K83 WeakPolarHBondContact O-CB 3.49Å; T79-K83 PolarHBondContact O-N 2.96Å |
| 80 | L | 97.3 | Very high | 95.9 | Very high | 100 Ų | 100 | 104.4 Ų | 104.4 | 52% | 0.524 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.5 | -40.2 | 176 | -72.2 | 176.1 | 0 | 0 | 0 | 112 | I76 Y77 K78 K83 R84 | I76-L80 HydrophobicContact CG2-CD1 3.85Å; I76-L80 HydrophobicContact CG2-CG 4.34Å; I76-L80 WeakPolarHBondContact O-CB 3.37Å; I76-L80 VanDerWaalsContact O-CG 3.32Å; I76-L80 WeakPolarHBondContact O-CG 3.45Å; I76-L80 PolarHBondContact O-N 2.85Å; Y77-L80 PolarHBondContact O-N 3.09Å; K78-L80 PolarHBondContact O-N 3.5Å; L80-K83 PolarHBondContact O-N 3.41Å; L80-R84 WeakPolarHBondContact O-CB 3.47Å; L80-R84 PolarHBondContact O-N 3.47Å |
| 81 | H | 96.9 | Very high | 96.2 | Very high | 74 Ų | 74 | 102.7 Ų | 102.7 | 34% | 0.343 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.7 | -46.7 | 177.3 | -170.3 | 85.2 | 0 | 0 | 0 | 111.8 | Y77 K78 T79 R84 K85 | Y77-H81 WeakPolarHBondContact O-CB 3.32Å; Y77-H81 PolarHBondContact O-N 2.98Å; K78-H81 PolarHBondContact O-N 3.32Å; T79-H81 VanDerWaalsContact C-N 3.35Å; T79-H81 PolarHBondContact O-N 3.45Å; H81-R84 PolarHBondContact O-N 3.09Å; H81-K85 PolarHBondContact O-N 2.86Å |
| 82 | I | 97.9 | Very high | 96.4 | Very high | 118 Ų | 118 | 104.6 Ų | 104.6 | 61% | 0.605 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.3 | -47.3 | 175.9 | -68.3 | 166.3 | 0 | 0 | 0 | 110.4 | K78 T79 R84 K85 W86 | K78-I82 WeakPolarHBondContact O-CG1 3.32Å; K78-I82 PolarHBondContact O-N 3.46Å; T79-I82 PolarHBondContact O-N 3.39Å; I82-R84 VanDerWaalsContact C-N 3.32Å; I82-R84 PolarHBondContact O-N 3.22Å; I82-K85 PolarHBondContact O-N 3.14Å; I82-W86 WeakPolarHBondContact O-CB 3.39Å; I82-W86 PolarHBondContact O-N 3.22Å |
| 83 | K | 97.9 | Very high | 96.6 | Very high | 116 Ų | 116 | 108.2 Ų | 108.2 | 50% | 0.504 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.6 | -39.9 | 178.9 | -171.9 | 174.5 | -178.3 | -72.6 | 0 | 111.8 | T79 L80 M87 | T79-K83 WeakPolarHBondContact O-CB 3.49Å; T79-K83 PolarHBondContact O-N 2.96Å; L80-K83 PolarHBondContact O-N 3.41Å; K83-M87 HydrophobicContact CG-CE 4.42Å; K83-M87 WeakPolarHBondContact O-CG 3.36Å; K83-M87 PolarHBondContact O-N 2.94Å |
| 84 | R | 97.9 | Very high | 96.6 | Very high | 130 Ų | 130 | 103.5 Ų | 103.5 | 49% | 0.491 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.3 | -51.3 | 174.5 | -176.4 | -174.9 | -64.4 | 143.6 | 2 | 111.2 | L80 H81 I82 W86 M87 E88 | L80-R84 WeakPolarHBondContact O-CB 3.47Å; L80-R84 PolarHBondContact O-N 3.47Å; H81-R84 PolarHBondContact O-N 3.09Å; I82-R84 VanDerWaalsContact C-N 3.32Å; I82-R84 PolarHBondContact O-N 3.22Å; R84-W86 VanDerWaalsContact C-N 3.29Å; R84-W86 PolarHBondContact O-N 2.96Å; R84-M87 PolarHBondContact O-N 3.28Å; R84-M87 VanDerWaalsContact O-N 3.15Å; R84-E88 HydrophobicContact CG-CG 4.44Å; R84-E88 WeakPolarHBondContact CG-OE1 3.43Å; R84-E88 WeakPolarHBondContact O-CG 3.39Å; R84-E88 PolarHBondContact O-N 3.24Å |
| 85 | K | 97.9 | Very high | 96.6 | Very high | 100 Ų | 100 | 104.7 Ų | 104.7 | 44% | 0.435 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.6 | -39.8 | 179.2 | -76.7 | -75.1 | 161.2 | -142.3 | 0 | 112.6 | H81 I82 E88 T89 | H81-K85 PolarHBondContact O-N 2.86Å; I82-K85 PolarHBondContact O-N 3.14Å; K85-E88 IonicContact NZ-OE2 3.72Å; K85-E88 PolarHBondContact NZ-OE2 3.49Å; K85-T89 WeakPolarHBondContact O-CB 3.3Å; K85-T89 PolarHBondContact O-N 3.27Å; K85-T89 PolarHBondContact O-OG1 3.16Å |
| 86 | W | 97.9 | Very high | 96.6 | Very high | 164 Ų | 164 | 106.9 Ų | 106.9 | 62% | 0.621 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.2 | -47.1 | 174.5 | 178.7 | 83.6 | 0 | 0 | 0 | 111.8 | I82 R84 T89 Y90 | I82-W86 WeakPolarHBondContact O-CB 3.39Å; I82-W86 PolarHBondContact O-N 3.22Å; R84-W86 VanDerWaalsContact C-N 3.29Å; R84-W86 PolarHBondContact O-N 2.96Å; W86-T89 PolarHBondContact O-N 2.92Å; W86-Y90 VanDerWaalsContact O-CB 3.31Å; W86-Y90 WeakPolarHBondContact O-CB 3.49Å; W86-Y90 PolarHBondContact O-N 3Å |
| 87 | M | 97.6 | Very high | 96.4 | Very high | 78 Ų | 78 | 104 Ų | 104 | 38% | 0.384 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.3 | -43.7 | 177.4 | -70.9 | -174.8 | -53.2 | 0 | 0 | 112.3 | K83 R84 T89 Y90 V91 | K83-M87 HydrophobicContact CG-CE 4.42Å; K83-M87 WeakPolarHBondContact O-CG 3.36Å; K83-M87 PolarHBondContact O-N 2.94Å; R84-M87 PolarHBondContact O-N 3.28Å; R84-M87 VanDerWaalsContact O-N 3.15Å; M87-T89 VanDerWaalsContact C-N 3.32Å; M87-T89 PolarHBondContact O-N 3.44Å; M87-Y90 PolarHBondContact O-N 3.4Å; M87-V91 WeakPolarHBondContact O-CB 3.23Å; M87-V91 VanDerWaalsContact O-CG2 3.27Å; M87-V91 WeakPolarHBondContact O-CG2 3.38Å; M87-V91 PolarHBondContact O-N 3.34Å |
| 88 | E | 96.6 | Very high | 96.3 | Very high | 90 Ų | 90 | 103.5 Ų | 103.5 | 42% | 0.421 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -55.9 | -47.4 | 175.5 | -75.9 | 171.1 | -170.6 | 0 | 0 | 111.2 | R84 K85 K92 | R84-E88 HydrophobicContact CG-CG 4.44Å; R84-E88 WeakPolarHBondContact CG-OE1 3.43Å; R84-E88 WeakPolarHBondContact O-CG 3.39Å; R84-E88 PolarHBondContact O-N 3.24Å; K85-E88 IonicContact NZ-OE2 3.72Å; K85-E88 PolarHBondContact NZ-OE2 3.49Å; E88-K92 VanDerWaalsContact O-CB 3.3Å; E88-K92 WeakPolarHBondContact O-CB 3.31Å; E88-K92 PolarHBondContact O-N 3.11Å |
| 89 | T | 96.8 | Very high | 96.2 | Very high | 69 Ų | 69 | 103.5 Ų | 103.5 | 42% | 0.423 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.6 | -48.3 | 179.2 | -54.5 | 0 | 0 | 0 | 0 | 111.1 | K85 W86 M87 V91 K92 E93 | K85-T89 WeakPolarHBondContact O-CB 3.3Å; K85-T89 PolarHBondContact O-N 3.27Å; K85-T89 PolarHBondContact O-OG1 3.16Å; W86-T89 PolarHBondContact O-N 2.92Å; M87-T89 VanDerWaalsContact C-N 3.32Å; M87-T89 PolarHBondContact O-N 3.44Å; T89-V91 PolarHBondContact O-N 3.36Å; T89-K92 PolarHBondContact O-N 3.32Å; T89-E93 HydrophobicContact CG2-CG 4.39Å; T89-E93 WeakPolarHBondContact O-CG 3.31Å; T89-E93 PolarHBondContact O-N 3.21Å |
| 90 | Y | 96.2 | Very high | 96.2 | Very high | 134 Ų | 134 | 103.8 Ų | 103.8 | 53% | 0.525 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -57.8 | -46.3 | 179.2 | 175 | -98.2 | 0 | 0 | 0 | 112.1 | W86 M87 S94 | W86-Y90 VanDerWaalsContact O-CB 3.31Å; W86-Y90 WeakPolarHBondContact O-CB 3.49Å; W86-Y90 PolarHBondContact O-N 3Å; M87-Y90 PolarHBondContact O-N 3.4Å; Y90-S94 WeakPolarHBondContact O-CB 3.44Å; Y90-S94 PolarHBondContact O-N 3.11Å; Y90-S94 PolarHBondContact O-OG 3.02Å |
| 91 | V | 96.4 | Very high | 96.1 | Very high | 73 Ų | 73 | 106.1 Ų | 106.1 | 44% | 0.442 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62 | -49.6 | 177.3 | 169.4 | 0 | 0 | 0 | 0 | 110 | M87 T89 E93 S94 F95 | M87-V91 WeakPolarHBondContact O-CB 3.23Å; M87-V91 VanDerWaalsContact O-CG2 3.27Å; M87-V91 WeakPolarHBondContact O-CG2 3.38Å; M87-V91 PolarHBondContact O-N 3.34Å; T89-V91 PolarHBondContact O-N 3.36Å; V91-E93 PolarHBondContact O-N 3.41Å; V91-S94 PolarHBondContact O-N 2.91Å; V91-F95 HydrophobicContact CG1-CD2 3.67Å; V91-F95 HydrophobicContact CG1-CE2 3.79Å; V91-F95 VanDerWaalsContact O-CD2 3.27Å; V91-F95 WeakPolarHBondContact O-CD2 3.16Å; V91-F95 PolarHBondContact O-N 3.48Å |
| 92 | K | 96.3 | Very high | 96.1 | Very high | 163 Ų | 163 | 107.5 Ų | 107.5 | 71% | 0.709 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -56.9 | -48.2 | -180 | -175.9 | 177.3 | -178.6 | 176 | 0 | 112.2 | E88 T89 F95 K96 | E88-K92 VanDerWaalsContact O-CB 3.3Å; E88-K92 WeakPolarHBondContact O-CB 3.31Å; E88-K92 PolarHBondContact O-N 3.11Å; T89-K92 PolarHBondContact O-N 3.32Å; K92-F95 PolarHBondContact O-N 3.02Å; K92-K96 PolarHBondContact O-N 3.05Å |
| 93 | E | 94.7 | Very high | 96.1 | Very high | 129 Ų | 129 | 106.6 Ų | 106.6 | 60% | 0.603 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66.9 | -41.6 | 178.9 | -69.8 | -178.9 | 166.6 | 0 | 0 | 112 | T89 V91 F95 K96 G97 | T89-E93 HydrophobicContact CG2-CG 4.39Å; T89-E93 WeakPolarHBondContact O-CG 3.31Å; T89-E93 PolarHBondContact O-N 3.21Å; V91-E93 PolarHBondContact O-N 3.41Å; E93-F95 VanDerWaalsContact C-N 3.3Å; E93-F95 PolarHBondContact O-N 3.09Å; E93-K96 PolarHBondContact O-N 2.87Å; E93-G97 PolarHBondContact O-N 3.43Å |
| 94 | S | 93 | Very high | 96.1 | Very high | 35 Ų | 35 | 109.3 Ų | 109.3 | 25% | 0.245 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -61.9 | -37.1 | 177.5 | -65.1 | 0 | 0 | 0 | 0 | 112.4 | Y90 V91 R98 | Y90-S94 WeakPolarHBondContact O-CB 3.44Å; Y90-S94 PolarHBondContact O-N 3.11Å; Y90-S94 PolarHBondContact O-OG 3.02Å; V91-S94 PolarHBondContact O-N 2.91Å; S94-R98 WeakPolarHBondContact O-CG 3.41Å; S94-R98 PolarHBondContact O-NE 3.43Å |
| 95 | F | 94.8 | Very high | 96.1 | Very high | 99 Ų | 99 | 109.7 Ų | 109.7 | 43% | 0.434 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -76.3 | -35.3 | 175.8 | -85 | -78 | 0 | 0 | 0 | 112.8 | V91 K92 E93 G97 R98 N99 | V91-F95 HydrophobicContact CG1-CD2 3.67Å; V91-F95 HydrophobicContact CG1-CE2 3.79Å; V91-F95 VanDerWaalsContact O-CD2 3.27Å; V91-F95 WeakPolarHBondContact O-CD2 3.16Å; V91-F95 PolarHBondContact O-N 3.48Å; K92-F95 PolarHBondContact O-N 3.02Å; E93-F95 VanDerWaalsContact C-N 3.3Å; E93-F95 PolarHBondContact O-N 3.09Å; F95-G97 PolarHBondContact O-N 3.45Å; F95-R98 VanDerWaalsContact CD2-NH2 3.31Å; F95-R98 VanDerWaalsContact CE2-NH2 3.26Å; F95-R98 VanDerWaalsContact CZ-NH2 3.35Å; F95-R98 PolarHBondContact O-N 3.37Å; F95-N99 WeakPolarHBondContact O-CB 3.48Å; F95-N99 VanDerWaalsContact O-CG 3.29Å; F95-N99 PolarHBondContact O-N 3.39Å; F95-N99 PolarHBondContact O-OD1 2.96Å |
| 96 | K | 95.4 | Very high | 96 | Very high | 139 Ų | 139 | 108 Ų | 108 | 60% | 0.604 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -55 | -52.2 | 179.5 | -174.5 | 179.7 | -179.5 | -177.9 | 0 | 112.5 | K92 E93 R98 N99 Q100 | K92-K96 PolarHBondContact O-N 3.05Å; E93-K96 PolarHBondContact O-N 2.87Å; K96-R98 PolarHBondContact O-N 2.97Å; K96-N99 PolarHBondContact O-N 2.94Å; K96-Q100 WeakPolarHBondContact O-CG 3.33Å; K96-Q100 PolarHBondContact O-N 3.48Å; K96-Q100 VanDerWaalsContact O-N 3.14Å |
| 97 | G | 91.1 | Very high | 96 | Very high | 41 Ų | 41 | 105.4 Ų | 105.4 | 42% | 0.423 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.3 | -37.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | E93 F95 K101 | E93-G97 PolarHBondContact O-N 3.43Å; F95-G97 PolarHBondContact O-N 3.45Å; G97-K101 PolarHBondContact O-N 3.02Å; G97-K101 VanDerWaalsContact O-N 3.14Å |
| 98 | R | 94.7 | Very high | 96 | Very high | 135 Ų | 135 | 106.2 Ų | 106.2 | 51% | 0.509 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.5 | -44.1 | 177.4 | -73.9 | -175.8 | -70.1 | 169.7 | 3.3 | 112 | S94 F95 K96 Q100 K101 L102 | S94-R98 WeakPolarHBondContact O-CG 3.41Å; S94-R98 PolarHBondContact O-NE 3.43Å; F95-R98 VanDerWaalsContact CD2-NH2 3.31Å; F95-R98 VanDerWaalsContact CE2-NH2 3.26Å; F95-R98 VanDerWaalsContact CZ-NH2 3.35Å; F95-R98 PolarHBondContact O-N 3.37Å; K96-R98 PolarHBondContact O-N 2.97Å; R98-Q100 PolarHBondContact O-N 3.02Å; R98-K101 WeakPolarHBondContact O-CB 3.48Å; R98-K101 PolarHBondContact O-N 3.21Å; R98-K101 VanDerWaalsContact O-N 3.13Å; R98-L102 PolarHBondContact O-N 3.47Å |
| 99 | N | 96.1 | Very high | 96.1 | Very high | 94 Ų | 94 | 105.3 Ų | 105.3 | 50% | 0.503 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.9 | -43.7 | 178.1 | -72.1 | 4.1 | 0 | 0 | 0 | 111.3 | F95 K96 K101 L102 E103 | F95-N99 WeakPolarHBondContact O-CB 3.48Å; F95-N99 VanDerWaalsContact O-CG 3.29Å; F95-N99 PolarHBondContact O-N 3.39Å; F95-N99 PolarHBondContact O-OD1 2.96Å; K96-N99 PolarHBondContact O-N 2.94Å; N99-K101 VanDerWaalsContact C-N 3.26Å; N99-K101 PolarHBondContact O-N 3.27Å; N99-L102 PolarHBondContact O-N 3.38Å; N99-E103 WeakPolarHBondContact O-CB 3.27Å; N99-E103 PolarHBondContact O-N 3.17Å |
| 100 | Q | 96.3 | Very high | 96 | Very high | 98 Ų | 98 | 106.7 Ų | 106.7 | 46% | 0.458 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.1 | -32.3 | 174.5 | -72.1 | 179.3 | -11.7 | 0 | 0 | 113.2 | K96 R98 R104 | K96-Q100 WeakPolarHBondContact O-CG 3.33Å; K96-Q100 PolarHBondContact O-N 3.48Å; K96-Q100 VanDerWaalsContact O-N 3.14Å; R98-Q100 PolarHBondContact O-N 3.02Å; Q100-R104 WeakPolarHBondContact O-CG 3.47Å; Q100-R104 PolarHBondContact O-N 2.98Å; Q100-R104 PolarHBondContact O-NE 3.43Å |
| 101 | K | 96.6 | Very high | 96.1 | Very high | 149 Ų | 149 | 107.8 Ų | 107.8 | 65% | 0.648 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -71.1 | -43.6 | 174.5 | -173.9 | 177.5 | 178.6 | -179.3 | 0 | 111.2 | G97 R98 N99 R104 F105 | G97-K101 PolarHBondContact O-N 3.02Å; G97-K101 VanDerWaalsContact O-N 3.14Å; R98-K101 WeakPolarHBondContact O-CB 3.48Å; R98-K101 PolarHBondContact O-N 3.21Å; R98-K101 VanDerWaalsContact O-N 3.13Å; N99-K101 VanDerWaalsContact C-N 3.26Å; N99-K101 PolarHBondContact O-N 3.27Å; K101-R104 PolarHBondContact O-N 3.49Å; K101-F105 PolarHBondContact O-N 2.87Å |
| 102 | L | 96.9 | Very high | 96.2 | Very high | 104 Ų | 104 | 109.6 Ų | 109.6 | 55% | 0.545 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.3 | -47.4 | 176.8 | 179.9 | 60.2 | 0 | 0 | 0 | 111.1 | R98 N99 R104 F105 C106 | R98-L102 PolarHBondContact O-N 3.47Å; N99-L102 PolarHBondContact O-N 3.38Å; L102-R104 PolarHBondContact O-N 3.49Å; L102-F105 WeakPolarHBondContact O-CB 3.45Å; L102-F105 PolarHBondContact O-N 2.91Å; L102-F105 VanDerWaalsContact O-N 3.08Å; L102-C106 PolarHBondContact O-N 3.36Å; L102-C106 PolarHBondContact O-SG 3.33Å; L102-C106 VanDerWaalsContact O-SG 3.37Å |
| 103 | E | 97.4 | Very high | 96.2 | Very high | 99 Ų | 99 | 110.2 Ų | 110.2 | 46% | 0.463 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.4 | -45.7 | 178.5 | -170.8 | -168.2 | 161.9 | 0 | 0 | 112 | N99 F105 C106 K107 | N99-E103 WeakPolarHBondContact O-CB 3.27Å; N99-E103 PolarHBondContact O-N 3.17Å; E103-F105 VanDerWaalsContact C-N 3.3Å; E103-F105 PolarHBondContact O-N 3.34Å; E103-C106 PolarHBondContact O-N 3.03Å; E103-K107 HydrophobicContact CG-CD 4.31Å; E103-K107 WeakPolarHBondContact O-CG 3.4Å; E103-K107 PolarHBondContact O-N 3.39Å; E103-K107 WeakPolarHBondContact OE1-CE 3.41Å; E103-K107 IonicContact OE1-NZ 3.22Å; E103-K107 PolarHBondContact OE1-NZ 3.27Å |
| 104 | R | 97.6 | Very high | 96.3 | Very high | 172 Ų | 172 | 108.6 Ų | 108.6 | 65% | 0.649 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.1 | -39.5 | 175.4 | -76.8 | -173.9 | -68.8 | 170.3 | -3.3 | 112.3 | Q100 K101 L102 M108 | Q100-R104 WeakPolarHBondContact O-CG 3.47Å; Q100-R104 PolarHBondContact O-N 2.98Å; Q100-R104 PolarHBondContact O-NE 3.43Å; K101-R104 PolarHBondContact O-N 3.49Å; L102-R104 PolarHBondContact O-N 3.49Å; R104-M108 WeakPolarHBondContact O-CB 3.48Å; R104-M108 PolarHBondContact O-N 2.93Å |
| 105 | F | 97.4 | Very high | 96.5 | Very high | 139 Ų | 139 | 110.7 Ų | 110.7 | 61% | 0.61 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -65.5 | -46.6 | 176.8 | 177.6 | -96.5 | 0 | 0 | 0 | 111.4 | K101 L102 E103 K107 M108 N109 | K101-F105 PolarHBondContact O-N 2.87Å; L102-F105 WeakPolarHBondContact O-CB 3.45Å; L102-F105 PolarHBondContact O-N 2.91Å; L102-F105 VanDerWaalsContact O-N 3.08Å; E103-F105 VanDerWaalsContact C-N 3.3Å; E103-F105 PolarHBondContact O-N 3.34Å; F105-K107 PolarHBondContact O-N 3.49Å; F105-M108 PolarHBondContact O-N 2.99Å; F105-N109 WeakPolarHBondContact O-CB 3.28Å; F105-N109 PolarHBondContact O-N 3.07Å |
| 106 | C | 97.2 | Very high | 96.6 | Very high | 64 Ų | 64 | 111.4 Ų | 111.4 | 43% | 0.432 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -57.5 | -50.4 | 176.6 | -68.9 | 0 | 0 | 0 | 0 | 111.5 | L102 E103 M108 N109 E110 | L102-C106 PolarHBondContact O-N 3.36Å; L102-C106 PolarHBondContact O-SG 3.33Å; L102-C106 VanDerWaalsContact O-SG 3.37Å; E103-C106 PolarHBondContact O-N 3.03Å; C106-M108 VanDerWaalsContact C-N 3.3Å; C106-M108 PolarHBondContact O-N 2.9Å; C106-N109 PolarHBondContact O-N 3.48Å; C106-E110 WeakPolarHBondContact O-CB 3.46Å; C106-E110 PolarHBondContact O-N 3.11Å |
| 107 | K | 97.8 | Very high | 96.6 | Very high | 109 Ų | 109 | 107.9 Ų | 107.9 | 47% | 0.474 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.4 | -36.7 | 177.6 | -73.7 | 176.8 | 172 | 173.2 | 0 | 113.1 | E103 F105 R111 | E103-K107 HydrophobicContact CG-CD 4.31Å; E103-K107 WeakPolarHBondContact O-CG 3.4Å; E103-K107 PolarHBondContact O-N 3.39Å; E103-K107 WeakPolarHBondContact OE1-CE 3.41Å; E103-K107 IonicContact OE1-NZ 3.22Å; E103-K107 PolarHBondContact OE1-NZ 3.27Å; F105-K107 PolarHBondContact O-N 3.49Å; K107-R111 WeakPolarHBondContact O-CB 3.42Å; K107-R111 PolarHBondContact O-N 3.36Å; K107-R111 VanDerWaalsContact O-N 3.17Å |
| 108 | M | 97.6 | Very high | 96.9 | Very high | 95 Ų | 95 | 108 Ų | 108 | 47% | 0.468 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.3 | -48.3 | 175.6 | -170.9 | 69.6 | 76.7 | 0 | 0 | 111 | R104 F105 C106 E110 R111 E112 | R104-M108 WeakPolarHBondContact O-CB 3.48Å; R104-M108 PolarHBondContact O-N 2.93Å; F105-M108 PolarHBondContact O-N 2.99Å; C106-M108 VanDerWaalsContact C-N 3.3Å; C106-M108 PolarHBondContact O-N 2.9Å; M108-E110 PolarHBondContact O-N 2.92Å; M108-R111 PolarHBondContact O-N 3.39Å; M108-E112 PolarHBondContact O-N 3.23Å |
| 109 | N | 97 | Very high | 97 | Very high | 71 Ų | 71 | 107.1 Ų | 107.1 | 38% | 0.38 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.4 | -42.4 | -179.5 | 177.6 | 74.5 | 0 | 0 | 0 | 112 | F105 C106 E112 R113 | F105-N109 WeakPolarHBondContact O-CB 3.28Å; F105-N109 PolarHBondContact O-N 3.07Å; C106-N109 PolarHBondContact O-N 3.48Å; N109-E112 PolarHBondContact O-N 2.99Å; N109-R113 WeakPolarHBondContact O-CG 3.49Å; N109-R113 PolarHBondContact O-N 3.29Å |
| 110 | E | 96.6 | Very high | 97 | Very high | 98 Ų | 98 | 108.5 Ų | 108.5 | 46% | 0.458 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.8 | -46.6 | 175.2 | -168.2 | -157.1 | 126.3 | 0 | 0 | 111.5 | C106 M108 E112 R113 K114 | C106-E110 WeakPolarHBondContact O-CB 3.46Å; C106-E110 PolarHBondContact O-N 3.11Å; M108-E110 PolarHBondContact O-N 2.92Å; E110-E112 VanDerWaalsContact C-N 3.34Å; E110-E112 PolarHBondContact O-N 3.45Å; E110-R113 PolarHBondContact O-N 3.49Å; E110-K114 PolarHBondContact O-N 2.85Å |
| 111 | R | 97.1 | Very high | 96.9 | Very high | 158 Ų | 158 | 104.7 Ų | 104.7 | 60% | 0.596 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -60.8 | -41.9 | 175.5 | -171.9 | -172.2 | -59.4 | 143.4 | 1.6 | 112.4 | K107 M108 K114 N115 | K107-R111 WeakPolarHBondContact O-CB 3.42Å; K107-R111 PolarHBondContact O-N 3.36Å; K107-R111 VanDerWaalsContact O-N 3.17Å; M108-R111 PolarHBondContact O-N 3.39Å; R111-K114 PolarHBondContact O-N 3.35Å; R111-N115 WeakPolarHBondContact O-CB 3.49Å; R111-N115 PolarHBondContact O-N 3.33Å |
| 112 | E | 97.8 | Very high | 96.9 | Very high | 110 Ų | 110 | 102.7 Ų | 102.7 | 51% | 0.514 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.4 | -43.5 | 176.7 | -76.6 | -174.8 | 176.1 | 0 | 0 | 111.6 | M108 N109 E110 N115 I116 | M108-E112 PolarHBondContact O-N 3.23Å; N109-E112 PolarHBondContact O-N 2.99Å; E110-E112 VanDerWaalsContact C-N 3.34Å; E110-E112 PolarHBondContact O-N 3.45Å; E112-N115 PolarHBondContact O-N 3.43Å; E112-I116 WeakPolarHBondContact O-CG1 3.4Å; E112-I116 PolarHBondContact O-N 2.93Å |
| 113 | R | 97.1 | Very high | 96.9 | Very high | 177 Ų | 177 | 104 Ų | 104 | 67% | 0.668 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -59.9 | -47.1 | 174.7 | -71.4 | 174.7 | 66.4 | 113.9 | -0.1 | 111.6 | N109 E110 N115 I116 N117 | N109-R113 WeakPolarHBondContact O-CG 3.49Å; N109-R113 PolarHBondContact O-N 3.29Å; E110-R113 PolarHBondContact O-N 3.49Å; R113-N115 VanDerWaalsContact C-N 3.34Å; R113-N115 PolarHBondContact O-N 2.95Å; R113-I116 PolarHBondContact O-N 2.8Å; R113-N117 WeakPolarHBondContact O-CB 3.02Å; R113-N117 PolarHBondContact O-N 3.28Å |
| 114 | K | 96.6 | Very high | 96.8 | Very high | 94 Ų | 94 | 105.4 Ų | 105.4 | 41% | 0.409 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -59.8 | -43.2 | 176.3 | -172.4 | 168 | -175.3 | 162.6 | 0 | 111.6 | D22 E110 R111 N117 N118 | D22-K114 VanDerWaalsContact CG-NZ 3.27Å; D22-K114 WeakPolarHBondContact OD1-CE 3.44Å; D22-K114 IonicContact OD1-NZ 2.75Å; D22-K114 PolarHBondContact OD1-NZ 3.06Å; D22-K114 IonicContact OD2-NZ 3.99Å; D22-K114 PolarHBondContact OD2-NZ 2.91Å; E110-K114 PolarHBondContact O-N 2.85Å; R111-K114 PolarHBondContact O-N 3.35Å; K114-N117 PolarHBondContact O-N 3.08Å; K114-N118 WeakPolarHBondContact O-CB 3.37Å; K114-N118 PolarHBondContact O-N 3.24Å; K114-N118 PolarHBondContact O-OD1 2.85Å |
| 115 | N | 96.9 | Very high | 96.7 | Very high | 79 Ų | 79 | 98.8 Ų | 98.8 | 42% | 0.422 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.7 | -43.7 | 177.4 | -177.5 | 39.6 | 0 | 0 | 0 | 112.7 | R111 E112 R113 K119 | R111-N115 WeakPolarHBondContact O-CB 3.49Å; R111-N115 PolarHBondContact O-N 3.33Å; E112-N115 PolarHBondContact O-N 3.43Å; R113-N115 VanDerWaalsContact C-N 3.34Å; R113-N115 PolarHBondContact O-N 2.95Å; N115-K119 WeakPolarHBondContact O-CG 3.36Å; N115-K119 PolarHBondContact O-N 3.14Å; N115-K119 VanDerWaalsContact O-N 3.07Å; N115-K119 WeakPolarHBondContact OD1-CE 3.35Å |
| 116 | I | 96.8 | Very high | 96.7 | Very high | 115 Ų | 115 | 95.9 Ų | 95.9 | 59% | 0.59 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -63.3 | -46.4 | 176.6 | -68.2 | 165.7 | 0 | 0 | 0 | 110.2 | E112 R113 N118 K119 F120 | E112-I116 WeakPolarHBondContact O-CG1 3.4Å; E112-I116 PolarHBondContact O-N 2.93Å; R113-I116 PolarHBondContact O-N 2.8Å; I116-N118 PolarHBondContact O-N 2.8Å; I116-K119 PolarHBondContact O-N 2.99Å; I116-F120 PolarHBondContact O-N 3.02Å |
| 117 | N | 96.8 | Very high | 96.7 | Very high | 65 Ų | 65 | 97.2 Ų | 97.2 | 35% | 0.348 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -60.2 | -46.8 | 178.6 | -169.5 | 57.2 | 0 | 0 | 0 | 111.5 | R113 K114 K119 F120 C121 | R113-N117 WeakPolarHBondContact O-CB 3.02Å; R113-N117 PolarHBondContact O-N 3.28Å; K114-N117 PolarHBondContact O-N 3.08Å; N117-K119 PolarHBondContact O-N 3.41Å; N117-F120 WeakPolarHBondContact O-CB 3.34Å; N117-F120 PolarHBondContact O-N 3.17Å; N117-F120 VanDerWaalsContact O-N 3.16Å; N117-C121 WeakPolarHBondContact O-CB 3.42Å; N117-C121 PolarHBondContact O-N 3.32Å; N117-C121 PolarHBondContact O-SG 3.44Å; N117-C121 VanDerWaalsContact O-SG 3.32Å |
| 118 | N | 96.3 | Very high | 96.7 | Very high | 44 Ų | 44 | 97.3 Ų | 97.3 | 24% | 0.235 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -60 | -46.1 | 179 | -72.1 | -5.3 | 0 | 0 | 0 | 112 | K114 I116 F120 C121 E122 | K114-N118 WeakPolarHBondContact O-CB 3.37Å; K114-N118 PolarHBondContact O-N 3.24Å; K114-N118 PolarHBondContact O-OD1 2.85Å; I116-N118 PolarHBondContact O-N 2.8Å; N118-F120 VanDerWaalsContact C-N 3.31Å; N118-F120 PolarHBondContact O-N 3.1Å; N118-C121 PolarHBondContact O-N 3.46Å; N118-E122 WeakPolarHBondContact O-CG 3.34Å; N118-E122 PolarHBondContact O-N 2.87Å |
| 119 | K | 96.8 | Very high | 96.6 | Very high | 115 Ų | 115 | 95.8 Ų | 95.8 | 50% | 0.5 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -59.9 | -41.4 | 176 | -73.8 | 174.7 | 179.3 | 178 | 0 | 112.2 | N115 I116 N117 Q123 | N115-K119 WeakPolarHBondContact O-CG 3.36Å; N115-K119 PolarHBondContact O-N 3.14Å; N115-K119 VanDerWaalsContact O-N 3.07Å; N115-K119 WeakPolarHBondContact OD1-CE 3.35Å; I116-K119 PolarHBondContact O-N 2.99Å; N117-K119 PolarHBondContact O-N 3.41Å; K119-Q123 WeakPolarHBondContact O-CG 3.36Å; K119-Q123 PolarHBondContact O-N 3.01Å; K119-Q123 VanDerWaalsContact O-N 3.15Å |
| 120 | F | 96.3 | Very high | 96.7 | Very high | 124 Ų | 124 | 99 Ų | 99 | 54% | 0.544 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65.1 | -46.2 | 176.5 | -179.6 | -98.2 | 0 | 0 | 0 | 111.6 | I116 N117 N118 E122 Q123 Y124 | I116-F120 PolarHBondContact O-N 3.02Å; N117-F120 WeakPolarHBondContact O-CB 3.34Å; N117-F120 PolarHBondContact O-N 3.17Å; N117-F120 VanDerWaalsContact O-N 3.16Å; N118-F120 VanDerWaalsContact C-N 3.31Å; N118-F120 PolarHBondContact O-N 3.1Å; F120-E122 VanDerWaalsContact C-N 3.35Å; F120-E122 PolarHBondContact O-N 3.26Å; F120-Q123 PolarHBondContact O-N 2.98Å; F120-Y124 PolarHBondContact O-N 3.39Å |
| 121 | C | 95.5 | Very high | 96.7 | Very high | 18 Ų | 18 | 97.3 Ų | 97.3 | 12% | 0.122 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -60 | -42.5 | 176.3 | -71.1 | 0 | 0 | 0 | 0 | 112.1 | N117 N118 Q123 Y124 I125 | N117-C121 WeakPolarHBondContact O-CB 3.42Å; N117-C121 PolarHBondContact O-N 3.32Å; N117-C121 PolarHBondContact O-SG 3.44Å; N117-C121 VanDerWaalsContact O-SG 3.32Å; N118-C121 PolarHBondContact O-N 3.46Å; C121-Q123 PolarHBondContact O-N 3.24Å; C121-Y124 WeakPolarHBondContact O-CB 3.42Å; C121-Y124 PolarHBondContact O-N 2.78Å; C121-I125 WeakPolarHBondContact O-CB 3.43Å; C121-I125 VanDerWaalsContact O-CG1 3.27Å; C121-I125 WeakPolarHBondContact O-CG1 3.43Å; C121-I125 PolarHBondContact O-N 3.15Å |
| 122 | E | 95.8 | Very high | 96.8 | Very high | 106 Ų | 106 | 95.8 Ų | 95.8 | 50% | 0.495 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -59.8 | -44 | 175.7 | -76.9 | 178.1 | -179.5 | 0 | 0 | 112.4 | N118 F120 T126 | N118-E122 WeakPolarHBondContact O-CG 3.34Å; N118-E122 PolarHBondContact O-N 2.87Å; F120-E122 VanDerWaalsContact C-N 3.35Å; F120-E122 PolarHBondContact O-N 3.26Å; E122-T126 WeakPolarHBondContact O-CB 3.45Å; E122-T126 PolarHBondContact O-N 3.22Å; E122-T126 PolarHBondContact O-OG1 3.02Å |
| 123 | Q | 96.5 | Very high | 96.7 | Very high | 133 Ų | 133 | 96.6 Ų | 96.6 | 62% | 0.621 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -63.1 | -42.9 | 175.4 | -73 | -177.6 | -2.9 | 0 | 0 | 111.7 | K119 F120 C121 T126 T127 | K119-Q123 WeakPolarHBondContact O-CG 3.36Å; K119-Q123 PolarHBondContact O-N 3.01Å; K119-Q123 VanDerWaalsContact O-N 3.15Å; F120-Q123 PolarHBondContact O-N 2.98Å; C121-Q123 PolarHBondContact O-N 3.24Å; Q123-T126 PolarHBondContact O-N 2.67Å; Q123-T127 WeakPolarHBondContact O-CB 3.35Å; Q123-T127 PolarHBondContact O-N 2.84Å; Q123-T127 PolarHBondContact O-OG1 3.24Å |
| 124 | Y | 95.8 | Very high | 96.8 | Very high | 128 Ų | 128 | 92.3 Ų | 92.3 | 50% | 0.502 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.9 | -54.6 | 177.4 | -168.4 | -89.4 | 0 | 0 | 0 | 110.4 | F120 C121 T126 T127 F128 | F120-Y124 PolarHBondContact O-N 3.39Å; C121-Y124 WeakPolarHBondContact O-CB 3.42Å; C121-Y124 PolarHBondContact O-N 2.78Å; Y124-T126 VanDerWaalsContact C-N 3.3Å; Y124-T126 PolarHBondContact O-N 3.24Å; Y124-T127 PolarHBondContact O-N 3.16Å; Y124-T127 VanDerWaalsContact O-N 3.14Å; Y124-F128 AromaticContact CD1-CD2 3.58Å; Y124-F128 HydrophobicContact CD1-CD2 3.58Å; Y124-F128 AromaticContact CD1-CE2 3.84Å; Y124-F128 HydrophobicContact CD1-CE2 3.84Å; Y124-F128 HydrophobicContact CD1-CG 4.44Å; Y124-F128 HydrophobicContact CD2-CD2 4.16Å; Y124-F128 AromaticContact CD2-CE2 3.76Å; Y124-F128 HydrophobicContact CD2-CE2 3.76Å; Y124-F128 AromaticContact CE1-CD2 3.38Å; Y124-F128 HydrophobicContact CE1-CD2 3.38Å; Y124-F128 AromaticContact CE1-CE2 3.32Å; Y124-F128 HydrophobicContact CE1-CE2 3.32Å; Y124-F128 HydrophobicContact CE1-CG 4.1Å; Y124-F128 AromaticContact CE1-CZ 3.94Å; Y124-F128 HydrophobicContact CE1-CZ 3.94Å; Y124-F128 HydrophobicContact CE2-CD2 4.01Å; Y124-F128 AromaticContact CE2-CE2 3.25Å; Y124-F128 HydrophobicContact CE2-CE2 3.25Å; Y124-F128 AromaticContact CE2-CZ 3.95Å; Y124-F128 HydrophobicContact CE2-CZ 3.95Å; Y124-F128 AromaticContact CG-CD2 3.97Å; Y124-F128 HydrophobicContact CG-CD2 3.97Å; Y124-F128 HydrophobicContact CG-CE2 4.05Å; Y124-F128 AromaticContact CZ-CD2 3.62Å; Y124-F128 AromaticContact CZ-CE2 2.99Å; Y124-F128 AromaticContact CZ-CZ 3.43Å; Y124-F128 VanDerWaalsContact CZ-CZ 3.43Å; Y124-F128 VanDerWaalsContact O-CD2 3.31Å; Y124-F128 WeakPolarHBondContact O-CD2 3.39Å; Y124-F128 PolarHBondContact O-N 3.02Å; Y124-F128 VanDerWaalsContact OH-CE2 3.31Å; Y124-F128 WeakPolarHBondContact OH-CE2 3.37Å; Y124-F128 WeakPolarHBondContact OH-CZ 3.44Å |
| 125 | I | 95.8 | Very high | 96.9 | Very high | 32 Ų | 32 | 91.6 Ų | 91.6 | 16% | 0.164 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -55.2 | -47 | 179.4 | -69.3 | 165.6 | 0 | 0 | 0 | 110.9 | Y17 C121 T127 F128 Q129 | Y17-I125 HydrophobicContact CG-CD1 4.26Å; C121-I125 WeakPolarHBondContact O-CB 3.43Å; C121-I125 VanDerWaalsContact O-CG1 3.27Å; C121-I125 WeakPolarHBondContact O-CG1 3.43Å; C121-I125 PolarHBondContact O-N 3.15Å; I125-T127 VanDerWaalsContact C-N 3.34Å; I125-T127 PolarHBondContact O-N 3.42Å; I125-F128 PolarHBondContact O-N 2.77Å; I125-Q129 HydrophobicContact CG2-CG 4.31Å; I125-Q129 WeakPolarHBondContact O-CB 3.41Å; I125-Q129 VanDerWaalsContact O-CG 3.28Å; I125-Q129 WeakPolarHBondContact O-CG 3.43Å; I125-Q129 PolarHBondContact O-N 2.79Å |
| 126 | T | 96.9 | Very high | 96.9 | Very high | 79 Ų | 79 | 92.5 Ų | 92.5 | 49% | 0.485 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.4 | -43.1 | -178.9 | -57.5 | 0 | 0 | 0 | 0 | 111.4 | E122 Q123 Y124 K130 | E122-T126 WeakPolarHBondContact O-CB 3.45Å; E122-T126 PolarHBondContact O-N 3.22Å; E122-T126 PolarHBondContact O-OG1 3.02Å; Q123-T126 PolarHBondContact O-N 2.67Å; Y124-T126 VanDerWaalsContact C-N 3.3Å; Y124-T126 PolarHBondContact O-N 3.24Å; T126-K130 PolarHBondContact O-N 3.39Å |
| 127 | T | 97.6 | Very high | 97 | Very high | 91 Ų | 91 | 92.8 Ų | 92.8 | 56% | 0.558 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -62.5 | -46 | 177.7 | -58.4 | 0 | 0 | 0 | 0 | 111.7 | Q123 Y124 I125 K130 S131 | Q123-T127 WeakPolarHBondContact O-CB 3.35Å; Q123-T127 PolarHBondContact O-N 2.84Å; Q123-T127 PolarHBondContact O-OG1 3.24Å; Y124-T127 PolarHBondContact O-N 3.16Å; Y124-T127 VanDerWaalsContact O-N 3.14Å; I125-T127 VanDerWaalsContact C-N 3.34Å; I125-T127 PolarHBondContact O-N 3.42Å; T127-K130 PolarHBondContact O-N 2.91Å; T127-S131 WeakPolarHBondContact O-CB 3.39Å; T127-S131 PolarHBondContact O-N 3.42Å |
| 128 | F | 96.6 | Very high | 97.1 | Very high | 112 Ų | 112 | 96 Ų | 96 | 49% | 0.491 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -68.1 | -39.2 | -179.7 | -87.7 | -92.1 | 0 | 0 | 0 | 112.7 | Y124 I125 K130 S131 Y132 | Y124-F128 AromaticContact CD1-CD2 3.58Å; Y124-F128 HydrophobicContact CD1-CD2 3.58Å; Y124-F128 AromaticContact CD1-CE2 3.84Å; Y124-F128 HydrophobicContact CD1-CE2 3.84Å; Y124-F128 HydrophobicContact CD1-CG 4.44Å; Y124-F128 HydrophobicContact CD2-CD2 4.16Å; Y124-F128 AromaticContact CD2-CE2 3.76Å; Y124-F128 HydrophobicContact CD2-CE2 3.76Å; Y124-F128 AromaticContact CE1-CD2 3.38Å; Y124-F128 HydrophobicContact CE1-CD2 3.38Å; Y124-F128 AromaticContact CE1-CE2 3.32Å; Y124-F128 HydrophobicContact CE1-CE2 3.32Å; Y124-F128 HydrophobicContact CE1-CG 4.1Å; Y124-F128 AromaticContact CE1-CZ 3.94Å; Y124-F128 HydrophobicContact CE1-CZ 3.94Å; Y124-F128 HydrophobicContact CE2-CD2 4.01Å; Y124-F128 AromaticContact CE2-CE2 3.25Å; Y124-F128 HydrophobicContact CE2-CE2 3.25Å; Y124-F128 AromaticContact CE2-CZ 3.95Å; Y124-F128 HydrophobicContact CE2-CZ 3.95Å; Y124-F128 AromaticContact CG-CD2 3.97Å; Y124-F128 HydrophobicContact CG-CD2 3.97Å; Y124-F128 HydrophobicContact CG-CE2 4.05Å; Y124-F128 AromaticContact CZ-CD2 3.62Å; Y124-F128 AromaticContact CZ-CE2 2.99Å; Y124-F128 AromaticContact CZ-CZ 3.43Å; Y124-F128 VanDerWaalsContact CZ-CZ 3.43Å; Y124-F128 VanDerWaalsContact O-CD2 3.31Å; Y124-F128 WeakPolarHBondContact O-CD2 3.39Å; Y124-F128 PolarHBondContact O-N 3.02Å; Y124-F128 VanDerWaalsContact OH-CE2 3.31Å; Y124-F128 WeakPolarHBondContact OH-CE2 3.37Å; Y124-F128 WeakPolarHBondContact OH-CZ 3.44Å; I125-F128 PolarHBondContact O-N 2.77Å; F128-K130 VanDerWaalsContact C-N 3.34Å; F128-K130 PolarHBondContact O-N 3.12Å; F128-S131 PolarHBondContact O-N 2.88Å; F128-Y132 WeakPolarHBondContact O-CB 3.35Å; F128-Y132 PolarHBondContact O-N 3.23Å |
| 129 | Q | 97.1 | Very high | 97.1 | Very high | 63 Ų | 63 | 97 Ų | 97 | 29% | 0.294 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -60.7 | -44.3 | 173.9 | -75.6 | 177.9 | -14.1 | 0 | 0 | 111.6 | I125 Y132 M133 | I125-Q129 HydrophobicContact CG2-CG 4.31Å; I125-Q129 WeakPolarHBondContact O-CB 3.41Å; I125-Q129 VanDerWaalsContact O-CG 3.28Å; I125-Q129 WeakPolarHBondContact O-CG 3.43Å; I125-Q129 PolarHBondContact O-N 2.79Å; Q129-Y132 PolarHBondContact O-N 2.96Å; Q129-M133 WeakPolarHBondContact O-CG 3.4Å; Q129-M133 PolarHBondContact O-N 2.88Å; Q129-M133 VanDerWaalsContact O-N 3.07Å |
| 130 | K | 97.5 | Very high | 97.2 | Very high | 138 Ų | 138 | 95.8 Ų | 95.8 | 60% | 0.6 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -62.4 | -48.3 | 175.7 | -176.2 | 179.1 | 177.4 | -177.2 | 0 | 111.6 | T126 T127 F128 Y132 M133 D134 | T126-K130 PolarHBondContact O-N 3.39Å; T127-K130 PolarHBondContact O-N 2.91Å; F128-K130 VanDerWaalsContact C-N 3.34Å; F128-K130 PolarHBondContact O-N 3.12Å; K130-Y132 VanDerWaalsContact C-N 3.28Å; K130-Y132 PolarHBondContact O-N 3.41Å; K130-M133 WeakPolarHBondContact O-CB 3.41Å; K130-M133 PolarHBondContact O-N 3.36Å; K130-M133 VanDerWaalsContact O-N 3.11Å; K130-D134 PolarHBondContact O-N 3.38Å |
| 131 | S | 97.9 | Very high | 97.3 | Very high | 62 Ų | 62 | 94.8 Ų | 94.8 | 43% | 0.434 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -57.8 | -41.8 | 177.7 | -179.5 | 0 | 0 | 0 | 0 | 112 | T127 F128 M133 D134 V135 | T127-S131 WeakPolarHBondContact O-CB 3.39Å; T127-S131 PolarHBondContact O-N 3.42Å; F128-S131 PolarHBondContact O-N 2.88Å; S131-M133 PolarHBondContact O-N 2.95Å; S131-D134 PolarHBondContact O-N 3.31Å; S131-V135 WeakPolarHBondContact O-CG2 3.3Å; S131-V135 PolarHBondContact O-N 2.95Å |
| 132 | Y | 97.6 | Very high | 97.4 | Very high | 126 Ų | 126 | 98.9 Ų | 98.9 | 49% | 0.494 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | 175.7 | -179.3 | -92.6 | 0 | 0 | 0 | 112.2 | F128 Q129 K130 D134 V135 Q136 | F128-Y132 WeakPolarHBondContact O-CB 3.35Å; F128-Y132 PolarHBondContact O-N 3.23Å; Q129-Y132 PolarHBondContact O-N 2.96Å; K130-Y132 VanDerWaalsContact C-N 3.28Å; K130-Y132 PolarHBondContact O-N 3.41Å; Y132-D134 VanDerWaalsContact C-N 3.35Å; Y132-D134 PolarHBondContact O-N 3.48Å; Y132-V135 PolarHBondContact O-N 3.07Å; Y132-Q136 PolarHBondContact O-N 3.29Å |
| 133 | M | 97.7 | Very high | 97.5 | Very high | 127 Ų | 127 | 99.9 Ų | 99.9 | 63% | 0.626 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -61.9 | -41.8 | 175.3 | -71.6 | 178 | 55.2 | 0 | 0 | 112.2 | Q129 K130 S131 V135 Q136 K137 | Q129-M133 WeakPolarHBondContact O-CG 3.4Å; Q129-M133 PolarHBondContact O-N 2.88Å; Q129-M133 VanDerWaalsContact O-N 3.07Å; K130-M133 WeakPolarHBondContact O-CB 3.41Å; K130-M133 PolarHBondContact O-N 3.36Å; K130-M133 VanDerWaalsContact O-N 3.11Å; S131-M133 PolarHBondContact O-N 2.95Å; M133-V135 VanDerWaalsContact C-N 3.35Å; M133-V135 PolarHBondContact O-N 3.44Å; M133-Q136 WeakPolarHBondContact O-CB 3.27Å; M133-Q136 PolarHBondContact O-N 2.91Å; M133-K137 PolarHBondContact O-N 3.37Å |
| 134 | D | 98 | Very high | 97.6 | Very high | 88 Ų | 88 | 100.3 Ų | 100.3 | 47% | 0.471 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.6 | -41.4 | 178.8 | -68.4 | -24.9 | 0 | 0 | 0 | 111.2 | K130 S131 Y132 Q136 K137 F138 | K130-D134 PolarHBondContact O-N 3.38Å; S131-D134 PolarHBondContact O-N 3.31Å; Y132-D134 VanDerWaalsContact C-N 3.35Å; Y132-D134 PolarHBondContact O-N 3.48Å; D134-Q136 VanDerWaalsContact C-N 3.33Å; D134-Q136 PolarHBondContact O-N 3.18Å; D134-K137 PolarHBondContact O-N 3.32Å; D134-F138 WeakPolarHBondContact O-CB 3.34Å; D134-F138 PolarHBondContact O-N 2.88Å |
| 135 | V | 98.3 | Very high | 97.7 | Very high | 79 Ų | 79 | 98 Ų | 98 | 48% | 0.479 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -63 | -39.6 | 174 | 170.4 | 0 | 0 | 0 | 0 | 111.6 | S131 Y132 M133 N139 | S131-V135 WeakPolarHBondContact O-CG2 3.3Å; S131-V135 PolarHBondContact O-N 2.95Å; Y132-V135 PolarHBondContact O-N 3.07Å; M133-V135 VanDerWaalsContact C-N 3.35Å; M133-V135 PolarHBondContact O-N 3.44Å; V135-N139 PolarHBondContact O-N 2.95Å; V135-N139 VanDerWaalsContact O-N 3.09Å; V135-N139 PolarHBondContact O-ND2 2.97Å |
| 136 | Q | 97.6 | Very high | 97.8 | Very high | 97 Ų | 97 | 100.5 Ų | 100.5 | 45% | 0.453 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.7 | -49 | 175.9 | -170.9 | -173.4 | -37.7 | 0 | 0 | 110.8 | Y132 M133 D134 F138 N139 E140 | Y132-Q136 PolarHBondContact O-N 3.29Å; M133-Q136 WeakPolarHBondContact O-CB 3.27Å; M133-Q136 PolarHBondContact O-N 2.91Å; D134-Q136 VanDerWaalsContact C-N 3.33Å; D134-Q136 PolarHBondContact O-N 3.18Å; Q136-F138 VanDerWaalsContact C-N 3.34Å; Q136-F138 PolarHBondContact O-N 2.9Å; Q136-N139 PolarHBondContact O-N 3.17Å; Q136-N139 VanDerWaalsContact O-N 3.11Å; Q136-E140 PolarHBondContact NE2-OE1 2.96Å; Q136-E140 PolarHBondContact O-N 3.33Å |
| 137 | K | 98.4 | Very high | 97.9 | Very high | 122 Ų | 122 | 100.3 Ų | 100.3 | 53% | 0.53 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60 | -43.7 | 178.8 | -173.8 | -179.2 | 174.7 | -171.1 | 0 | 111.9 | M133 D134 N139 E140 E141 | M133-K137 PolarHBondContact O-N 3.37Å; D134-K137 PolarHBondContact O-N 3.32Å; K137-N139 VanDerWaalsContact C-N 3.29Å; K137-N139 PolarHBondContact O-N 3.48Å; K137-E140 PolarHBondContact O-N 3.23Å; K137-E141 VanDerWaalsContact CE-OE1 3.23Å; K137-E141 WeakPolarHBondContact CE-OE1 3.46Å; K137-E141 PolarHBondContact O-N 3.28Å |
| 138 | F | 98.2 | Very high | 97.9 | Very high | 131 Ų | 131 | 98.9 Ų | 98.9 | 58% | 0.575 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -57.2 | -42.8 | 174.6 | 173 | -99.5 | 0 | 0 | 0 | 111.9 | D134 Q136 E141 K142 | D134-F138 WeakPolarHBondContact O-CB 3.34Å; D134-F138 PolarHBondContact O-N 2.88Å; Q136-F138 VanDerWaalsContact C-N 3.34Å; Q136-F138 PolarHBondContact O-N 2.9Å; F138-E141 PolarHBondContact O-N 3.48Å; F138-K142 HydrophobicContact CE1-CD 4.42Å; F138-K142 VanDerWaalsContact O-CB 3.3Å; F138-K142 WeakPolarHBondContact O-CB 3.4Å; F138-K142 PolarHBondContact O-N 3.18Å |
| 139 | N | 97.9 | Very high | 98 | Very high | 66 Ų | 66 | 97.1 Ų | 97.1 | 35% | 0.353 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.9 | -38.2 | 178.6 | -80.5 | -49.8 | 0 | 0 | 0 | 112.8 | V135 Q136 K137 K142 E143 | V135-N139 PolarHBondContact O-N 2.95Å; V135-N139 VanDerWaalsContact O-N 3.09Å; V135-N139 PolarHBondContact O-ND2 2.97Å; Q136-N139 PolarHBondContact O-N 3.17Å; Q136-N139 VanDerWaalsContact O-N 3.11Å; K137-N139 VanDerWaalsContact C-N 3.29Å; K137-N139 PolarHBondContact O-N 3.48Å; N139-K142 PolarHBondContact O-N 3.41Å; N139-K142 PolarHBondContact OD1-NZ 2.86Å; N139-E143 PolarHBondContact O-N 3.4Å |
| 140 | E | 98.1 | Very high | 98.1 | Very high | 90 Ų | 90 | 99.8 Ų | 99.8 | 42% | 0.421 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.4 | -42.7 | 174.6 | -68.4 | 173.8 | -164.6 | 0 | 0 | 111.6 | Q136 K137 E143 K144 | Q136-E140 PolarHBondContact NE2-OE1 2.96Å; Q136-E140 PolarHBondContact O-N 3.33Å; K137-E140 PolarHBondContact O-N 3.23Å; E140-E143 PolarHBondContact O-N 3.08Å; E140-K144 WeakPolarHBondContact O-CG 3.4Å; E140-K144 PolarHBondContact O-N 3.3Å; E140-K144 VanDerWaalsContact O-N 3.17Å |
| 141 | E | 98.3 | Very high | 98.1 | Very high | 102 Ų | 102 | 100.6 Ų | 100.6 | 48% | 0.477 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.3 | -42.2 | 175.8 | -72.9 | 177.5 | -173.7 | 0 | 0 | 112 | K137 F138 E143 K144 S145 | K137-E141 VanDerWaalsContact CE-OE1 3.23Å; K137-E141 WeakPolarHBondContact CE-OE1 3.46Å; K137-E141 PolarHBondContact O-N 3.28Å; F138-E141 PolarHBondContact O-N 3.48Å; E141-E143 VanDerWaalsContact C-N 3.34Å; E141-E143 PolarHBondContact O-N 3.07Å; E141-K144 PolarHBondContact O-N 3.41Å; E141-S145 PolarHBondContact O-N 2.66Å |
| 142 | K | 97.8 | Very high | 98.1 | Very high | 105 Ų | 105 | 103.9 Ų | 103.9 | 46% | 0.457 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.1 | -45.2 | 174.6 | -174.6 | -168.1 | 77.1 | -162.8 | 0 | 111.4 | F138 N139 K144 S145 V146 | F138-K142 HydrophobicContact CE1-CD 4.42Å; F138-K142 VanDerWaalsContact O-CB 3.3Å; F138-K142 WeakPolarHBondContact O-CB 3.4Å; F138-K142 PolarHBondContact O-N 3.18Å; N139-K142 PolarHBondContact O-N 3.41Å; N139-K142 PolarHBondContact OD1-NZ 2.86Å; K142-K144 PolarHBondContact O-N 3.18Å; K142-S145 PolarHBondContact O-N 2.93Å; K142-V146 VanDerWaalsContact O-CG2 3.32Å; K142-V146 WeakPolarHBondContact O-CG2 3.27Å; K142-V146 PolarHBondContact O-N 3.3Å |
| 143 | E | 98.2 | Very high | 98.2 | Very high | 126 Ų | 126 | 103 Ų | 103 | 59% | 0.589 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.7 | -42.2 | 178.6 | -174.1 | 173 | -177.2 | 0 | 0 | 111.8 | N139 E140 E141 S145 V146 N147 | N139-E143 PolarHBondContact O-N 3.4Å; E140-E143 PolarHBondContact O-N 3.08Å; E141-E143 VanDerWaalsContact C-N 3.34Å; E141-E143 PolarHBondContact O-N 3.07Å; E143-S145 PolarHBondContact O-N 3.39Å; E143-V146 PolarHBondContact O-N 3.25Å; E143-N147 VanDerWaalsContact O-CG 3.26Å; E143-N147 PolarHBondContact O-N 3.36Å; E143-N147 PolarHBondContact O-ND2 3.46Å |
| 144 | K | 98.3 | Very high | 98.2 | Very high | 143 Ų | 143 | 102.9 Ų | 102.9 | 62% | 0.622 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.8 | -45.6 | 174 | -69.8 | 171.5 | -173.2 | 172.5 | 0 | 111.8 | E140 E141 K142 N147 S148 | E140-K144 WeakPolarHBondContact O-CG 3.4Å; E140-K144 PolarHBondContact O-N 3.3Å; E140-K144 VanDerWaalsContact O-N 3.17Å; E141-K144 PolarHBondContact O-N 3.41Å; K142-K144 PolarHBondContact O-N 3.18Å; K144-N147 PolarHBondContact O-N 3.39Å; K144-S148 PolarHBondContact O-N 3.16Å |
| 145 | S | 98.1 | Very high | 98.2 | Very high | 79 Ų | 79 | 101.4 Ų | 101.4 | 55% | 0.552 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.1 | -45.9 | 178.7 | -178.4 | 0 | 0 | 0 | 0 | 112 | E141 K142 E143 N147 S148 C149 | E141-S145 PolarHBondContact O-N 2.66Å; K142-S145 PolarHBondContact O-N 2.93Å; E143-S145 PolarHBondContact O-N 3.39Å; S145-N147 VanDerWaalsContact C-N 3.33Å; S145-N147 PolarHBondContact O-N 3.4Å; S145-S148 PolarHBondContact O-N 3.46Å; S145-S148 VanDerWaalsContact O-N 3.16Å; S145-C149 WeakPolarHBondContact O-CB 3.45Å; S145-C149 PolarHBondContact O-N 3.46Å |
| 146 | V | 98.4 | Very high | 98.2 | Very high | 84 Ų | 84 | 103.6 Ų | 103.6 | 51% | 0.509 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -58.3 | -45.3 | 176.1 | 168.9 | 0 | 0 | 0 | 0 | 111.2 | K142 E143 S148 C149 Q150 | K142-V146 VanDerWaalsContact O-CG2 3.32Å; K142-V146 WeakPolarHBondContact O-CG2 3.27Å; K142-V146 PolarHBondContact O-N 3.3Å; E143-V146 PolarHBondContact O-N 3.25Å; V146-S148 VanDerWaalsContact C-N 3.33Å; V146-S148 PolarHBondContact O-N 3.03Å; V146-C149 PolarHBondContact O-N 3.04Å; V146-Q150 PolarHBondContact O-N 3.44Å |
| 147 | N | 98.3 | Very high | 98.2 | Very high | 76 Ų | 76 | 105.6 Ų | 105.6 | 41% | 0.406 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.6 | -38.2 | 178 | -70.9 | -27.3 | 0 | 0 | 0 | 112.3 | E143 K144 S145 K151 | E143-N147 VanDerWaalsContact O-CG 3.26Å; E143-N147 PolarHBondContact O-N 3.36Å; E143-N147 PolarHBondContact O-ND2 3.46Å; K144-N147 PolarHBondContact O-N 3.39Å; S145-N147 VanDerWaalsContact C-N 3.33Å; S145-N147 PolarHBondContact O-N 3.4Å; N147-K151 WeakPolarHBondContact O-CG 3.42Å; N147-K151 PolarHBondContact O-N 3.03Å |
| 148 | S | 98.3 | Very high | 98.2 | Very high | 60 Ų | 60 | 105.2 Ų | 105.2 | 42% | 0.42 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.8 | -47.4 | 175.7 | -161.3 | 0 | 0 | 0 | 0 | 111.5 | K144 S145 V146 Q150 K151 E152 | K144-S148 PolarHBondContact O-N 3.16Å; S145-S148 PolarHBondContact O-N 3.46Å; S145-S148 VanDerWaalsContact O-N 3.16Å; V146-S148 VanDerWaalsContact C-N 3.33Å; V146-S148 PolarHBondContact O-N 3.03Å; S148-Q150 VanDerWaalsContact C-N 3.27Å; S148-Q150 PolarHBondContact O-N 3.23Å; S148-K151 WeakPolarHBondContact O-CB 3.31Å; S148-K151 PolarHBondContact O-N 3.24Å; S148-K151 VanDerWaalsContact O-N 3.09Å; S148-E152 PolarHBondContact O-N 2.93Å |
| 149 | C | 98.1 | Very high | 98.2 | Very high | 75 Ų | 75 | 102.4 Ų | 102.4 | 51% | 0.507 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -58.5 | -40.4 | 177.7 | -176.7 | 0 | 0 | 0 | 0 | 111.6 | S145 V146 K151 E152 Q153 | S145-C149 WeakPolarHBondContact O-CB 3.45Å; S145-C149 PolarHBondContact O-N 3.46Å; V146-C149 PolarHBondContact O-N 3.04Å; C149-K151 PolarHBondContact O-N 3.4Å; C149-E152 PolarHBondContact O-N 3.4Å; C149-Q153 WeakPolarHBondContact O-CB 3.17Å; C149-Q153 PolarHBondContact O-N 3.43Å |
| 150 | Q | 98.5 | Very high | 98.3 | Very high | 120 Ų | 120 | 105.7 Ų | 105.7 | 56% | 0.561 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63 | -41.2 | 176.3 | -173.3 | 177.6 | -6.8 | 0 | 0 | 112.4 | V146 S148 Q153 Q154 | V146-Q150 PolarHBondContact O-N 3.44Å; S148-Q150 VanDerWaalsContact C-N 3.27Å; S148-Q150 PolarHBondContact O-N 3.23Å; Q150-Q153 PolarHBondContact O-N 3.24Å; Q150-Q154 PolarHBondContact O-N 3.38Å; Q150-Q154 VanDerWaalsContact O-N 3.09Å |
| 151 | K | 98.3 | Very high | 98.3 | Very high | 154 Ų | 154 | 104.4 Ų | 104.4 | 67% | 0.67 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.4 | -46.5 | 176 | -71.7 | 177.1 | -179.3 | -178.6 | 0 | 111.6 | N147 S148 C149 Q153 Q154 A155 | N147-K151 WeakPolarHBondContact O-CG 3.42Å; N147-K151 PolarHBondContact O-N 3.03Å; S148-K151 WeakPolarHBondContact O-CB 3.31Å; S148-K151 PolarHBondContact O-N 3.24Å; S148-K151 VanDerWaalsContact O-N 3.09Å; C149-K151 PolarHBondContact O-N 3.4Å; K151-Q153 VanDerWaalsContact C-N 3.32Å; K151-Q153 PolarHBondContact O-N 2.84Å; K151-Q154 PolarHBondContact O-N 3.13Å; K151-A155 PolarHBondContact O-N 3.49Å |
| 152 | E | 98 | Very high | 98.3 | Very high | 131 Ų | 131 | 102.6 Ų | 102.6 | 61% | 0.612 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -61.1 | -41.8 | 176.3 | -75.6 | 179 | -179.8 | 0 | 0 | 111.8 | S148 C149 Q154 A155 L156 | S148-E152 PolarHBondContact O-N 2.93Å; C149-E152 PolarHBondContact O-N 3.4Å; E152-Q154 VanDerWaalsContact C-N 3.29Å; E152-Q154 PolarHBondContact O-N 3.14Å; E152-A155 PolarHBondContact O-N 3.49Å; E152-L156 WeakPolarHBondContact O-CB 3.32Å; E152-L156 PolarHBondContact O-N 2.8Å |
| 153 | Q | 98.4 | Very high | 98.3 | Very high | 108 Ų | 108 | 103.9 Ų | 103.9 | 51% | 0.505 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.6 | -39.3 | 176.2 | -169.1 | -174.6 | 28.1 | 0 | 0 | 111.8 | C149 Q150 K151 K157 | C149-Q153 WeakPolarHBondContact O-CB 3.17Å; C149-Q153 PolarHBondContact O-N 3.43Å; Q150-Q153 PolarHBondContact O-N 3.24Å; K151-Q153 VanDerWaalsContact C-N 3.32Å; K151-Q153 PolarHBondContact O-N 2.84Å; Q153-K157 WeakPolarHBondContact O-CG 3.27Å; Q153-K157 PolarHBondContact O-N 3.24Å; Q153-K157 VanDerWaalsContact O-N 3.14Å |
| 154 | Q | 98.4 | Very high | 98.3 | Very high | 125 Ų | 125 | 102 Ų | 102 | 58% | 0.584 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -68 | -44.8 | 176 | -172.5 | 176.9 | 5 | 0 | 0 | 111.6 | Q150 K151 E152 L156 K157 L158 | Q150-Q154 PolarHBondContact O-N 3.38Å; Q150-Q154 VanDerWaalsContact O-N 3.09Å; K151-Q154 PolarHBondContact O-N 3.13Å; E152-Q154 VanDerWaalsContact C-N 3.29Å; E152-Q154 PolarHBondContact O-N 3.14Å; Q154-L156 VanDerWaalsContact C-N 3.31Å; Q154-L156 PolarHBondContact O-N 3.49Å; Q154-K157 PolarHBondContact O-N 3.14Å; Q154-L158 WeakPolarHBondContact O-CG 3.32Å; Q154-L158 PolarHBondContact O-N 2.89Å; Q154-L158 VanDerWaalsContact O-N 3.09Å |
| 155 | A | 98.3 | Very high | 98.2 | Very high | 57 Ų | 57 | 101.1 Ų | 101.1 | 47% | 0.471 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -60.1 | -41.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | K151 E152 K157 L158 S159 | K151-A155 PolarHBondContact O-N 3.49Å; E152-A155 PolarHBondContact O-N 3.49Å; A155-K157 PolarHBondContact O-N 3.31Å; A155-L158 PolarHBondContact O-N 3.39Å; A155-S159 WeakPolarHBondContact O-CB 3.44Å; A155-S159 PolarHBondContact O-N 2.88Å |
| 156 | L | 98.4 | Very high | 98.2 | Very high | 124 Ų | 124 | 102 Ų | 102 | 65% | 0.649 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.3 | -42.5 | 177.2 | -175.8 | 65 | 0 | 0 | 0 | 112.1 | E152 Q154 L158 S159 K160 | E152-L156 WeakPolarHBondContact O-CB 3.32Å; E152-L156 PolarHBondContact O-N 2.8Å; Q154-L156 VanDerWaalsContact C-N 3.31Å; Q154-L156 PolarHBondContact O-N 3.49Å; L156-L158 VanDerWaalsContact C-N 3.35Å; L156-L158 PolarHBondContact O-N 2.97Å; L156-S159 PolarHBondContact O-N 2.86Å; L156-K160 WeakPolarHBondContact O-CB 3.3Å; L156-K160 PolarHBondContact O-N 3.15Å |
| 157 | K | 98.4 | Very high | 98.2 | Very high | 139 Ų | 139 | 102.6 Ų | 102.6 | 60% | 0.604 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -60.5 | -44.2 | 175.5 | -75.3 | 174.8 | -178.6 | 178.2 | 0 | 111.8 | Q153 Q154 A155 K160 C161 | Q153-K157 WeakPolarHBondContact O-CG 3.27Å; Q153-K157 PolarHBondContact O-N 3.24Å; Q153-K157 VanDerWaalsContact O-N 3.14Å; Q154-K157 PolarHBondContact O-N 3.14Å; A155-K157 PolarHBondContact O-N 3.31Å; K157-K160 PolarHBondContact O-N 2.83Å; K157-C161 PolarHBondContact O-N 3.3Å |
| 158 | L | 98.3 | Very high | 98.2 | Very high | 114 Ų | 114 | 103.9 Ų | 103.9 | 60% | 0.597 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.6 | -45.2 | 177.9 | -70.7 | 172.8 | 0 | 0 | 0 | 111.7 | Q154 A155 L156 K160 C161 S162 | Q154-L158 WeakPolarHBondContact O-CG 3.32Å; Q154-L158 PolarHBondContact O-N 2.89Å; Q154-L158 VanDerWaalsContact O-N 3.09Å; A155-L158 PolarHBondContact O-N 3.39Å; L156-L158 VanDerWaalsContact C-N 3.35Å; L156-L158 PolarHBondContact O-N 2.97Å; L158-K160 VanDerWaalsContact C-N 3.35Å; L158-K160 PolarHBondContact O-N 3.24Å; L158-C161 WeakPolarHBondContact O-CB 3.46Å; L158-C161 PolarHBondContact O-N 3.49Å; L158-S162 PolarHBondContact O-N 2.9Å |
| 159 | S | 98.4 | Very high | 98.2 | Very high | 73 Ų | 73 | 103.4 Ų | 103.4 | 51% | 0.51 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -57.6 | -46.4 | 176.4 | -179.5 | 0 | 0 | 0 | 0 | 111.7 | A155 L156 C161 S162 Q163 | A155-S159 WeakPolarHBondContact O-CB 3.44Å; A155-S159 PolarHBondContact O-N 2.88Å; L156-S159 PolarHBondContact O-N 2.86Å; S159-C161 VanDerWaalsContact C-N 3.34Å; S159-C161 PolarHBondContact O-N 3.05Å; S159-S162 PolarHBondContact O-N 3.4Å; S159-Q163 WeakPolarHBondContact O-CB 3.43Å; S159-Q163 PolarHBondContact O-N 3.4Å |
| 160 | K | 98.4 | Very high | 98.2 | Very high | 134 Ų | 134 | 101.8 Ų | 101.8 | 58% | 0.583 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.1 | -39.8 | 176.7 | -169.4 | 175.8 | -177.7 | 176.9 | 0 | 112.6 | L156 K157 L158 N164 | L156-K160 WeakPolarHBondContact O-CB 3.3Å; L156-K160 PolarHBondContact O-N 3.15Å; K157-K160 PolarHBondContact O-N 2.83Å; L158-K160 VanDerWaalsContact C-N 3.35Å; L158-K160 PolarHBondContact O-N 3.24Å; K160-N164 WeakPolarHBondContact O-CB 3.32Å; K160-N164 VanDerWaalsContact O-CG 3.29Å; K160-N164 PolarHBondContact O-N 3Å |
| 161 | C | 98.1 | Very high | 98.1 | Very high | 63 Ų | 63 | 101 Ų | 101 | 43% | 0.426 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.3 | -48.4 | 175.6 | -172.2 | 0 | 0 | 0 | 0 | 111.4 | K157 L158 S159 Q163 N164 Q165 | K157-C161 PolarHBondContact O-N 3.3Å; L158-C161 WeakPolarHBondContact O-CB 3.46Å; L158-C161 PolarHBondContact O-N 3.49Å; S159-C161 VanDerWaalsContact C-N 3.34Å; S159-C161 PolarHBondContact O-N 3.05Å; C161-Q163 PolarHBondContact O-N 3.27Å; C161-N164 PolarHBondContact O-N 3.36Å; C161-Q165 WeakPolarHBondContact O-CG 3.47Å; C161-Q165 PolarHBondContact O-N 2.88Å |
| 162 | S | 98.1 | Very high | 98.1 | Very high | 64 Ų | 64 | 98.5 Ų | 98.5 | 45% | 0.448 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.1 | -43.7 | 178.1 | 175.6 | 0 | 0 | 0 | 0 | 112 | L158 S159 N164 Q165 T166 | L158-S162 PolarHBondContact O-N 2.9Å; S159-S162 PolarHBondContact O-N 3.4Å; S162-N164 VanDerWaalsContact C-N 3.34Å; S162-N164 PolarHBondContact O-N 2.86Å; S162-Q165 PolarHBondContact O-N 3.42Å; S162-T166 PolarHBondContact O-N 2.92Å; S162-T166 PolarHBondContact O-OG1 3.36Å; S162-T166 VanDerWaalsContact O-OG1 3.12Å |
| 163 | Q | 98.1 | Very high | 98.1 | Very high | 133 Ų | 133 | 98.8 Ų | 98.8 | 62% | 0.621 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.4 | -43.1 | 176.8 | -171.2 | 178.7 | 33.2 | 0 | 0 | 112 | S159 C161 T166 L167 | S159-Q163 WeakPolarHBondContact O-CB 3.43Å; S159-Q163 PolarHBondContact O-N 3.4Å; C161-Q163 PolarHBondContact O-N 3.27Å; Q163-T166 PolarHBondContact O-N 2.91Å; Q163-L167 WeakPolarHBondContact O-CB 3.36Å; Q163-L167 PolarHBondContact O-N 2.72Å |
| 164 | N | 98.1 | Very high | 98 | Very high | 85 Ų | 85 | 99.5 Ų | 99.5 | 46% | 0.455 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.1 | -42.3 | 176.2 | -75 | -12.3 | 0 | 0 | 0 | 111.8 | K160 C161 S162 L167 E168 | K160-N164 WeakPolarHBondContact O-CB 3.32Å; K160-N164 VanDerWaalsContact O-CG 3.29Å; K160-N164 PolarHBondContact O-N 3Å; C161-N164 PolarHBondContact O-N 3.36Å; S162-N164 VanDerWaalsContact C-N 3.34Å; S162-N164 PolarHBondContact O-N 2.86Å; N164-L167 PolarHBondContact O-N 2.9Å; N164-E168 WeakPolarHBondContact O-CG 3.43Å; N164-E168 PolarHBondContact O-N 3.3Å |
| 165 | Q | 97.8 | Very high | 97.9 | Very high | 126 Ų | 126 | 100.1 Ų | 100.1 | 59% | 0.589 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61.7 | -44.6 | 176.4 | -72.8 | 174.5 | -9.2 | 0 | 0 | 112 | C161 S162 L167 E168 A169 | C161-Q165 WeakPolarHBondContact O-CG 3.47Å; C161-Q165 PolarHBondContact O-N 2.88Å; S162-Q165 PolarHBondContact O-N 3.42Å; Q165-L167 VanDerWaalsContact C-N 3.31Å; Q165-L167 PolarHBondContact O-N 3.46Å; Q165-E168 PolarHBondContact O-N 3.02Å; Q165-A169 PolarHBondContact O-N 3.34Å |
| 166 | T | 98 | Very high | 97.8 | Very high | 96 Ų | 96 | 102.7 Ų | 102.7 | 59% | 0.589 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61.9 | -39.7 | 176.4 | -57.3 | 0 | 0 | 0 | 0 | 111.7 | S162 Q163 G170 | S162-T166 PolarHBondContact O-N 2.92Å; S162-T166 PolarHBondContact O-OG1 3.36Å; S162-T166 VanDerWaalsContact O-OG1 3.12Å; Q163-T166 PolarHBondContact O-N 2.91Å; T166-G170 PolarHBondContact O-N 3.47Å |
| 167 | L | 98.1 | Very high | 97.7 | Very high | 97 Ų | 97 | 100.1 Ų | 100.1 | 51% | 0.508 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.1 | -45.9 | 176.2 | 179.3 | 64.9 | 0 | 0 | 0 | 111.7 | Q163 N164 Q165 G170 K171 | Q163-L167 WeakPolarHBondContact O-CB 3.36Å; Q163-L167 PolarHBondContact O-N 2.72Å; N164-L167 PolarHBondContact O-N 2.9Å; Q165-L167 VanDerWaalsContact C-N 3.31Å; Q165-L167 PolarHBondContact O-N 3.46Å; L167-G170 PolarHBondContact O-N 3.49Å; L167-K171 WeakPolarHBondContact O-CG 3.4Å; L167-K171 PolarHBondContact O-N 3.31Å |
| 168 | E | 98.1 | Very high | 97.6 | Very high | 104 Ų | 104 | 97.3 Ų | 97.3 | 49% | 0.486 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 177.8 | -69.9 | -54.1 | 132 | 0 | 0 | 111.9 | N164 Q165 G170 K171 E172 | N164-E168 WeakPolarHBondContact O-CG 3.43Å; N164-E168 PolarHBondContact O-N 3.3Å; Q165-E168 PolarHBondContact O-N 3.02Å; E168-G170 VanDerWaalsContact C-N 3.29Å; E168-G170 PolarHBondContact O-N 3.29Å; E168-K171 WeakPolarHBondContact O-CB 3.37Å; E168-K171 PolarHBondContact O-N 2.85Å; E168-K171 IonicContact OE1-NZ 2.8Å; E168-K171 PolarHBondContact OE1-NZ 2.88Å; E168-K171 IonicContact OE2-NZ 2.66Å; E168-E172 PolarHBondContact O-N 3.31Å |
| 169 | A | 97.8 | Very high | 97.4 | Very high | 49 Ų | 49 | 97.5 Ų | 97.5 | 41% | 0.405 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.3 | -39.1 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q165 E172 M173 | Q165-A169 PolarHBondContact O-N 3.34Å; A169-E172 PolarHBondContact O-N 2.99Å; A169-M173 WeakPolarHBondContact O-CB 3.16Å; A169-M173 WeakPolarHBondContact O-CG 3.3Å; A169-M173 PolarHBondContact O-N 2.97Å |
| 170 | G | 97.8 | Very high | 97.3 | Very high | 41 Ų | 41 | 98.1 Ų | 98.1 | 42% | 0.423 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.3 | -41.4 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113 | T166 L167 E168 H174 | T166-G170 PolarHBondContact O-N 3.47Å; L167-G170 PolarHBondContact O-N 3.49Å; E168-G170 VanDerWaalsContact C-N 3.29Å; E168-G170 PolarHBondContact O-N 3.29Å; G170-H174 WeakPolarHBondContact O-CB 3.43Å; G170-H174 PolarHBondContact O-N 2.92Å; G170-H174 VanDerWaalsContact O-N 3.07Å |
| 171 | K | 97.6 | Very high | 97 | Very high | 104 Ų | 104 | 97.1 Ų | 97.1 | 45% | 0.452 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63 | -46.6 | 174.8 | -70.7 | 174.2 | -174.9 | 168.7 | 0 | 111.6 | L167 E168 M173 H174 E175 | L167-K171 WeakPolarHBondContact O-CG 3.4Å; L167-K171 PolarHBondContact O-N 3.31Å; E168-K171 WeakPolarHBondContact O-CB 3.37Å; E168-K171 PolarHBondContact O-N 2.85Å; E168-K171 IonicContact OE1-NZ 2.8Å; E168-K171 PolarHBondContact OE1-NZ 2.88Å; E168-K171 IonicContact OE2-NZ 2.66Å; K171-M173 VanDerWaalsContact C-N 3.35Å; K171-M173 PolarHBondContact O-N 2.93Å; K171-H174 WeakPolarHBondContact O-CB 3.46Å; K171-H174 PolarHBondContact O-N 3.46Å; K171-E175 PolarHBondContact O-N 3.03Å |
| 172 | E | 97.6 | Very high | 96.6 | Very high | 102 Ų | 102 | 100 Ų | 100 | 48% | 0.477 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.1 | -42.3 | -180 | -168.2 | -171.3 | 162.7 | 0 | 0 | 111.6 | E168 A169 H174 E175 K176 | E168-E172 PolarHBondContact O-N 3.31Å; A169-E172 PolarHBondContact O-N 2.99Å; E172-H174 PolarHBondContact O-N 3.49Å; E172-E175 PolarHBondContact O-N 3.35Å; E172-K176 WeakPolarHBondContact O-CG 3.23Å; E172-K176 PolarHBondContact O-N 3.11Å; E172-K176 VanDerWaalsContact OE1-CE 3.29Å; E172-K176 WeakPolarHBondContact OE1-CE 3.44Å; E172-K176 IonicContact OE1-NZ 2.65Å; E172-K176 PolarHBondContact OE1-NZ 3.14Å |
| 173 | M | 97.1 | Very high | 96.2 | Very high | 136 Ų | 136 | 101.1 Ų | 101.1 | 67% | 0.67 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.2 | -42.7 | 174.8 | -74.2 | -97.3 | -72 | 0 | 0 | 112.3 | A169 K171 S177 | A169-M173 WeakPolarHBondContact O-CB 3.16Å; A169-M173 WeakPolarHBondContact O-CG 3.3Å; A169-M173 PolarHBondContact O-N 2.97Å; K171-M173 VanDerWaalsContact C-N 3.35Å; K171-M173 PolarHBondContact O-N 2.93Å; M173-S177 WeakPolarHBondContact O-CB 3.43Å; M173-S177 PolarHBondContact O-N 3.43Å; M173-S177 PolarHBondContact O-OG 3.48Å |
| 174 | H | 97.3 | Very high | 95.5 | Very high | 124 Ų | 124 | 100.1 Ų | 100.1 | 57% | 0.574 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -64.3 | -45.9 | 177 | 174.6 | -86.7 | 0 | 0 | 0 | 111.3 | G170 K171 E172 S177 M178 | G170-H174 WeakPolarHBondContact O-CB 3.43Å; G170-H174 PolarHBondContact O-N 2.92Å; G170-H174 VanDerWaalsContact O-N 3.07Å; K171-H174 WeakPolarHBondContact O-CB 3.46Å; K171-H174 PolarHBondContact O-N 3.46Å; E172-H174 PolarHBondContact O-N 3.49Å; H174-S177 WeakPolarHBondContact O-CB 3.11Å; H174-S177 PolarHBondContact O-N 2.86Å; H174-M178 WeakPolarHBondContact O-CG 3.22Å; H174-M178 PolarHBondContact O-N 2.66Å |
| 175 | E | 96.9 | Very high | 94.3 | Very high | 138 Ų | 138 | 98.7 Ų | 98.7 | 65% | 0.645 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -59.5 | -49.1 | 178.3 | -172.9 | 168.2 | -158.3 | 0 | 0 | 111.9 | K171 E172 S177 M178 E179 | K171-E175 PolarHBondContact O-N 3.03Å; E172-E175 PolarHBondContact O-N 3.35Å; E175-S177 VanDerWaalsContact C-N 3.29Å; E175-S177 PolarHBondContact O-N 2.92Å; E175-M178 PolarHBondContact O-N 2.9Å; E175-E179 PolarHBondContact O-N 2.78Å |
| 176 | K | 96.3 | Very high | 92.9 | Very high | 111 Ų | 111 | 97.8 Ų | 97.8 | 48% | 0.483 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -58.6 | -40.1 | 174.6 | -73.8 | 176.5 | -174.6 | 166.6 | 0 | 112.6 | E172 E179 V180 | E172-K176 WeakPolarHBondContact O-CG 3.23Å; E172-K176 PolarHBondContact O-N 3.11Å; E172-K176 VanDerWaalsContact OE1-CE 3.29Å; E172-K176 WeakPolarHBondContact OE1-CE 3.44Å; E172-K176 IonicContact OE1-NZ 2.65Å; E172-K176 PolarHBondContact OE1-NZ 3.14Å; K176-E179 PolarHBondContact O-N 2.6Å; K176-V180 WeakPolarHBondContact O-CG2 3.33Å; K176-V180 PolarHBondContact O-N 2.97Å |
| 177 | S | 95.8 | Very high | 91 | Very high | 70 Ų | 70 | 101.9 Ų | 101.9 | 49% | 0.49 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -63.6 | -43.1 | 178.4 | -60.5 | 0 | 0 | 0 | 0 | 111.6 | M173 H174 E175 V180 L181 | M173-S177 WeakPolarHBondContact O-CB 3.43Å; M173-S177 PolarHBondContact O-N 3.43Å; M173-S177 PolarHBondContact O-OG 3.48Å; H174-S177 WeakPolarHBondContact O-CB 3.11Å; H174-S177 PolarHBondContact O-N 2.86Å; E175-S177 VanDerWaalsContact C-N 3.29Å; E175-S177 PolarHBondContact O-N 2.92Å; S177-V180 PolarHBondContact O-N 3.44Å; S177-L181 WeakPolarHBondContact O-CG 3.33Å; S177-L181 PolarHBondContact O-N 3.25Å; S177-L181 VanDerWaalsContact O-N 3.11Å |
| 178 | M | 95.8 | Very high | 88.6 | Confident | 80 Ų | 80 | 107.2 Ų | 107.2 | 39% | 0.394 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.1 | -41.5 | 176.6 | -72 | -62 | -64.2 | 0 | 0 | 112 | H174 E175 L181 M182 | H174-M178 WeakPolarHBondContact O-CG 3.22Å; H174-M178 PolarHBondContact O-N 2.66Å; E175-M178 PolarHBondContact O-N 2.9Å; M178-L181 PolarHBondContact O-N 3.38Å; M178-L181 HydrophobicContact SD-CD1 4.5Å; M178-M182 HydrophobicContact CE-CE 4.27Å; M178-M182 WeakPolarHBondContact O-CG 3.3Å; M178-M182 PolarHBondContact O-N 3.18Å |
| 179 | E | 95 | Very high | 88.1 | Confident | 117 Ų | 117 | 107.4 Ų | 107.4 | 55% | 0.547 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -61 | -45.5 | 176.5 | -175.6 | 178.9 | -170.3 | 0 | 0 | 111.9 | E175 K176 L181 M182 N183 | E175-E179 PolarHBondContact O-N 2.78Å; K176-E179 PolarHBondContact O-N 2.6Å; E179-L181 VanDerWaalsContact C-N 3.32Å; E179-L181 PolarHBondContact O-N 3.34Å; E179-M182 PolarHBondContact O-N 3.37Å; E179-N183 WeakPolarHBondContact O-CB 3.48Å; E179-N183 VanDerWaalsContact O-CG 3.31Å; E179-N183 PolarHBondContact O-N 2.99Å; E179-N183 PolarHBondContact O-ND2 2.92Å; E179-N183 VanDerWaalsContact O-ND2 3.08Å |
| 180 | V | 94.8 | Very high | 87.6 | Confident | 87 Ų | 87 | 110.5 Ų | 110.5 | 53% | 0.527 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -58.4 | -44.5 | 175.3 | 170 | 0 | 0 | 0 | 0 | 111.3 | K176 S177 N183 L184 | K176-V180 WeakPolarHBondContact O-CG2 3.33Å; K176-V180 PolarHBondContact O-N 2.97Å; S177-V180 PolarHBondContact O-N 3.44Å; V180-N183 PolarHBondContact O-N 3.33Å; V180-L184 HydrophobicContact CG1-CD1 4Å; V180-L184 PolarHBondContact O-N 3.19Å; V180-L184 VanDerWaalsContact O-N 3.11Å |
| 181 | L | 92.8 | Very high | 87 | Confident | 113 Ų | 113 | 114.3 Ų | 114.3 | 59% | 0.592 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -64.1 | -42.7 | 178.3 | -71.9 | 172.5 | 0 | 0 | 0 | 112.6 | S177 M178 E179 L184 G185 | S177-L181 WeakPolarHBondContact O-CG 3.33Å; S177-L181 PolarHBondContact O-N 3.25Å; S177-L181 VanDerWaalsContact O-N 3.11Å; M178-L181 PolarHBondContact O-N 3.38Å; M178-L181 HydrophobicContact SD-CD1 4.5Å; E179-L181 VanDerWaalsContact C-N 3.32Å; E179-L181 PolarHBondContact O-N 3.34Å; L181-L184 PolarHBondContact O-N 2.96Å; L181-G185 PolarHBondContact O-N 2.96Å |
| 182 | M | 90.8 | Very high | 86.4 | Confident | 123 Ų | 123 | 114.9 Ų | 114.9 | 61% | 0.606 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -62.7 | -45.4 | 176.6 | -72 | -173.1 | -166.1 | 0 | 0 | 111.7 | M178 E179 L184 G185 T186 | M178-M182 HydrophobicContact CE-CE 4.27Å; M178-M182 WeakPolarHBondContact O-CG 3.3Å; M178-M182 PolarHBondContact O-N 3.18Å; E179-M182 PolarHBondContact O-N 3.37Å; M182-L184 VanDerWaalsContact C-N 3.27Å; M182-L184 PolarHBondContact O-N 3.01Å; M182-G185 PolarHBondContact O-N 3.18Å; M182-G185 VanDerWaalsContact O-N 3.09Å; M182-T186 PolarHBondContact O-N 3.25Å; M182-T186 PolarHBondContact O-OG1 3.42Å |
| 183 | N | 88.8 | Confident | 85.7 | Confident | 87 Ų | 87 | 115.8 Ų | 115.8 | 47% | 0.465 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -64 | -30.9 | 179.9 | -74.3 | -37.1 | 0 | 0 | 0 | 113.2 | E179 V180 T186 | E179-N183 WeakPolarHBondContact O-CB 3.48Å; E179-N183 VanDerWaalsContact O-CG 3.31Å; E179-N183 PolarHBondContact O-N 2.99Å; E179-N183 PolarHBondContact O-ND2 2.92Å; E179-N183 VanDerWaalsContact O-ND2 3.08Å; V180-N183 PolarHBondContact O-N 3.33Å; N183-T186 WeakPolarHBondContact CA-OG1 3.2Å; N183-T186 PolarHBondContact O-OG1 3.06Å; N183-T186 VanDerWaalsContact O-OG1 3.08Å |
| 184 | L | 83.5 | Confident | 84.9 | Confident | 113 Ų | 113 | 114.4 Ų | 114.4 | 59% | 0.592 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -69.4 | -38.9 | 172.1 | -85.6 | 156.9 | 0 | 0 | 0 | 112.1 | V180 L181 M182 T186 | V180-L184 HydrophobicContact CG1-CD1 4Å; V180-L184 PolarHBondContact O-N 3.19Å; V180-L184 VanDerWaalsContact O-N 3.11Å; L181-L184 PolarHBondContact O-N 2.96Å; M182-L184 VanDerWaalsContact C-N 3.27Å; M182-L184 PolarHBondContact O-N 3.01Å; L184-T186 VanDerWaalsContact C-N 3.33Å; L184-T186 PolarHBondContact O-N 3.47Å |
| 185 | G | 73.1 | Confident | 84 | Confident | 55 Ų | 55 | 113.7 Ų | 113.7 | 57% | 0.567 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -68.5 | -27 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | L181 M182 | L181-G185 PolarHBondContact O-N 2.96Å; M182-G185 PolarHBondContact O-N 3.18Å; M182-G185 VanDerWaalsContact O-N 3.09Å |
| 186 | T | 68 | Low | 83.1 | Confident | 107 Ų | 107 | 111.8 Ų | 111.8 | 66% | 0.656 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | -5.1 | 180 | 46.8 | 0 | 0 | 0 | 0 | 115.1 | M182 N183 L184 | M182-T186 PolarHBondContact O-N 3.25Å; M182-T186 PolarHBondContact O-OG1 3.42Å; N183-T186 WeakPolarHBondContact CA-OG1 3.2Å; N183-T186 PolarHBondContact O-OG1 3.06Å; N183-T186 VanDerWaalsContact O-OG1 3.08Å; L184-T186 VanDerWaalsContact C-N 3.33Å; L184-T186 PolarHBondContact O-N 3.47Å |
| 187 | K | 58.8 | Low | 82 | Confident | 182 Ų | 182 | 111.9 Ų | 111.9 | 79% | 0.791 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | 8.1 | -178.1 | -85.9 | -177.4 | 176.1 | 176.5 | 0 | 114.6 | ||
| 188 | N | 46.4 | Very low | 80.7 | Confident | 209 Ų | 209 | 115.7 Ų | 115.7 | 100% | 1.118 | 62% | 0.623 | S | S | * | * | trans | -109.3 | 0 | 167.7 | -74.7 | -25 | 0 | 0 | 0 | 109.9 |
Retrieved 188 of 188 residues in 295.1 ms
(Link to these results)