| 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 | 53.1 | Low | 60.9 | Low | 247 Ų | 247 | 165.2 Ų | 165.2 | 100% | 1.217 | 87% | 0.868 | S | S | * | * | 0 | 138.3 | 0 | -72.1 | 145.4 | 64.2 | 0 | 0 | 108 | |||||
| 2 | L | 52.3 | Low | 59.8 | Low | 174 Ų | 174 | 165.1 Ų | 165.1 | 91% | 0.911 | 86% | 0.859 | S | S | * | * | trans | -93.3 | 108.7 | -176 | -171.4 | 66.7 | 0 | 0 | 0 | 110.4 | K4 | L2-K4 PolarHBondContact O-N 3.01Š| ||
| 3 | G | 62.2 | Low | 58.7 | Low | 72 Ų | 72 | 163.4 Ų | 163.4 | 74% | 0.742 | 84% | 0.844 | S | S | * | * | trans | -68.8 | 124 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112 | G5 | G3-G5 PolarHBondContact O-N 3.22Š| ||
| 4 | K | 64.6 | Low | 57.9 | Low | 209 Ų | 209 | 164.7 Ų | 164.7 | 91% | 0.909 | 85% | 0.845 | S | S | * | * | trans | -80.8 | 105.4 | 176.2 | -71.2 | -176 | 177.4 | -179.6 | 0 | 110.4 | L2 G6 | L2-K4 PolarHBondContact O-N 3.01Å; K4-G6 PolarHBondContact O-N 2.97Å | ||
| 5 | G | 64.1 | Low | 56.9 | Low | 75 Ų | 75 | 161.9 Ų | 161.9 | 77% | 0.773 | 83% | 0.832 | S | S | * | * | trans | -68.2 | 111.1 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | G3 K7 | G3-G5 PolarHBondContact O-N 3.22Å; G5-K7 PolarHBondContact O-N 3.34Å | ||
| 6 | G | 65.9 | Low | 56.5 | Low | 78 Ų | 78 | 156.2 Ų | 156.2 | 80% | 0.804 | 83% | 0.825 | S | S | * | * | trans | -76.8 | 100.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | K4 R8 | K4-G6 PolarHBondContact O-N 2.97Å; G6-R8 PolarHBondContact O-N 3.45Å | ||
| 7 | K | 71.8 | Confident | 56 | Low | 207 Ų | 207 | 156.2 Ų | 156.2 | 90% | 0.9 | 83% | 0.825 | S | S | * | * | trans | -75.8 | 107 | 171.3 | -69.6 | -167 | 176.6 | -171.7 | 0 | 110.2 | G5 | G5-K7 PolarHBondContact O-N 3.34Š| ||
| 8 | R | 73.6 | Confident | 55.3 | Low | 246 Ų | 246 | 158.3 Ų | 158.3 | 93% | 0.928 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 131.3 | 164.8 | -69 | -174.1 | -72.3 | 163 | -2.3 | 108.9 | G6 | G6-R8 PolarHBondContact O-N 3.45Š|
| 9 | K | 62.4 | Low | 55 | Low | 197 Ų | 197 | 154.2 Ų | 154.2 | 86% | 0.857 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 141 | 166.6 | -74.8 | -75.9 | -164.8 | 159.3 | 0 | 108.5 | ||
| 10 | F | 45.6 | Very low | 54.1 | Low | 171 Ų | 171 | 156.4 Ų | 156.4 | 75% | 0.75 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 133.6 | 157.3 | -174.6 | -109 | 0 | 0 | 0 | 106.6 | E12 | F10-E12 HydrophobicContact CD1-CB 4.06Å; F10-E12 HydrophobicContact CD1-CG 4.5Å; F10-E12 HydrophobicContact CE1-CB 4.02Å; F10-E12 HydrophobicContact CE1-CG 4.02Å; F10-E12 WeakPolarHBondContact CE1-OE2 3.45Å |
| 11 | D | 53.9 | Low | 53.9 | Low | 141 Ų | 141 | 157 Ų | 157 | 75% | 0.754 | 83% | 0.832 | S | S | * | * | trans | -106.5 | 117.6 | 179.9 | -162.7 | 65 | 0 | 0 | 0 | 107.6 | ||||
| 12 | E | 48.3 | Very low | 53.5 | Low | 164 Ų | 164 | 151.4 Ų | 151.4 | 77% | 0.766 | 81% | 0.812 | S | S | * | * | trans | -122 | 74.9 | -167.6 | -164.7 | 172.5 | 148.1 | 0 | 0 | 108.4 | F10 | F10-E12 HydrophobicContact CD1-CB 4.06Å; F10-E12 HydrophobicContact CD1-CG 4.5Å; F10-E12 HydrophobicContact CE1-CB 4.02Å; F10-E12 HydrophobicContact CE1-CG 4.02Å; F10-E12 WeakPolarHBondContact CE1-OE2 3.45Å | ||
| 13 | H | 45.2 | Very low | 53.3 | Low | 143 Ų | 143 | 147.1 Ų | 147.1 | 66% | 0.662 | 80% | 0.796 | S | S | * | * | trans | -96.8 | 89.8 | -178.1 | -161 | -60.2 | 0 | 0 | 0 | 110.8 | D15 | H13-D15 IonicContact CE1-OD2 3.41Å; H13-D15 PolarHBondContact O-N 2.97Å | ||
| 14 | E | 47.3 | Very low | 52.6 | Low | 182 Ų | 182 | 149.3 Ų | 149.3 | 85% | 0.85 | 80% | 0.797 | S | S | * | * | trans | -59.4 | 123.6 | 156 | -90.3 | -117.8 | 99.5 | 0 | 0 | 109.3 | ||||
| 15 | D | 43 | Very low | 51.7 | Low | 123 Ų | 123 | 145.2 Ų | 145.2 | 66% | 0.658 | 79% | 0.794 | S | S | * | * | trans | -149.5 | 111.9 | 152.3 | -144.5 | -19.4 | 0 | 0 | 0 | 109.1 | H13 L17 | H13-D15 IonicContact CE1-OD2 3.41Å; H13-D15 PolarHBondContact O-N 2.97Å; D15-L17 PolarHBondContact O-N 2.55Å | ||
| 16 | G | 51.5 | Low | 51.1 | Low | 70 Ų | 70 | 146.2 Ų | 146.2 | 72% | 0.722 | 78% | 0.781 | S | S | * | * | trans | -91.1 | 98.7 | -169.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 17 | L | 46.5 | Very low | 50.9 | Low | 156 Ų | 156 | 144.7 Ų | 144.7 | 82% | 0.817 | 77% | 0.766 | S | S | * | * | trans | -122.8 | 138.2 | 175.6 | -62.6 | 177.1 | 0 | 0 | 0 | 112.8 | D15 | D15-L17 PolarHBondContact O-N 2.55Š| ||
| 18 | E | 43.9 | Very low | 49.9 | Very low | 195 Ų | 195 | 140.7 Ų | 140.7 | 91% | 0.911 | 76% | 0.761 | S | S | * | * | trans | -49.5 | 140 | -164.8 | -55.9 | 175.8 | 106.8 | 0 | 0 | 117.8 | ||||
| 19 | G | 50 | Low | 49.6 | Very low | 79 Ų | 79 | 131.4 Ų | 131.4 | 81% | 0.814 | 73% | 0.734 | S | S | * | * | 76.7 | 56.3 | 116 | 0 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 20 | K | 36.8 | Very low | 50.3 | Low | 198 Ų | 198 | 126.1 Ų | 126.1 | 86% | 0.861 | 71% | 0.711 | S | S | * | * | trans | -140.6 | 132.3 | 148.2 | -122.4 | 174.6 | -173.1 | 178.1 | 0 | 113.3 | V22 | K20-V22 VanDerWaalsContact C-N 3.31Å; K20-V22 PolarHBondContact O-N 2.88Å | ||
| 21 | I | 50 | Low | 51.8 | Low | 169 Ų | 169 | 123.2 Ų | 123.2 | 87% | 0.867 | 71% | 0.707 | S | S | * | * | trans | -74.1 | 86 | 179.9 | -53.9 | 170.4 | 0 | 0 | 0 | 108.5 | S23 | I21-S23 VanDerWaalsContact C-N 3.3Å; I21-S23 PolarHBondContact O-N 3.24Å | ||
| 22 | V | 44 | Very low | 53.3 | Low | 130 Ų | 130 | 119.4 Ų | 119.4 | 79% | 0.788 | 69% | 0.691 | S | S | * | * | trans | -72.8 | 93.7 | 161.1 | 179.3 | 0 | 0 | 0 | 0 | 106.5 | K20 | K20-V22 VanDerWaalsContact C-N 3.31Å; K20-V22 PolarHBondContact O-N 2.88Å | ||
| 23 | S | 48.9 | Very low | 55.4 | Low | 84 Ų | 84 | 116.6 Ų | 116.6 | 59% | 0.587 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -46.8 | 141.3 | 163 | 178.4 | 0 | 0 | 0 | 0 | 108.8 | I21 C25 | I21-S23 VanDerWaalsContact C-N 3.3Å; I21-S23 PolarHBondContact O-N 3.24Å; S23-C25 PolarHBondContact O-N 3.03Å |
| 24 | P | 47.9 | Very low | 57.6 | Low | 118 Ų | 118 | 111.8 Ų | 111.8 | 77% | 0.766 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 118.3 | 168.8 | -23.9 | 33.4 | 0 | 0 | 0 | 108.4 | D26 | P24-D26 PolarHBondContact O-N 3.47Š|
| 25 | C | 45 | Very low | 59.7 | Low | 124 Ų | 124 | 108.5 Ų | 108.5 | 84% | 0.838 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 116.9 | 179.7 | -172.9 | 0 | 0 | 0 | 0 | 107 | S23 G27 | S23-C25 PolarHBondContact O-N 3.03Å; C25-G27 PolarHBondContact O-N 3.19Å |
| 26 | D | 52.4 | Low | 62.2 | Low | 95 Ų | 95 | 108 Ų | 108 | 51% | 0.508 | 64% | 0.637 | S | S | . | * | trans | -73.3 | 74.9 | -174.3 | -163.7 | 39.8 | 0 | 0 | 0 | 110.4 | P24 S29 K30 | P24-D26 PolarHBondContact O-N 3.47Å; D26-S29 VanDerWaalsContact OD2-CA 3.23Å; D26-S29 WeakPolarHBondContact OD2-CA 3.23Å; D26-S29 WeakPolarHBondContact OD2-CB 3.18Å; D26-S29 PolarHBondContact OD2-OG 3.16Å; D26-K30 WeakPolarHBondContact OD1-CB 3.15Å; D26-K30 PolarHBondContact OD1-N 3.13Å; D26-K30 PolarHBondContact OD2-N 3.21Å | ||
| 27 | G | 60.7 | Low | 64.1 | Low | 47 Ų | 47 | 105.5 Ų | 105.5 | 49% | 0.485 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -52.9 | 154 | 165.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | C25 S29 | C25-G27 PolarHBondContact O-N 3.19Å; G27-S29 VanDerWaalsContact O-CA 3.27Å; G27-S29 WeakPolarHBondContact O-CA 3.01Å; G27-S29 PolarHBondContact O-N 3.26Å |
| 28 | P | 51 | Low | 66.4 | Low | 123 Ų | 123 | 101.5 Ų | 101.5 | 80% | 0.799 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -22.6 | 97.3 | -150.5 | 10.8 | -29.9 | 0 | 0 | 0 | 113 | S32 | P28-S32 PolarHBondContact O-OG 3.21Š|
| 29 | S | 68.2 | Low | 68.8 | Low | 50 Ų | 50 | 95.3 Ų | 95.3 | 35% | 0.35 | 56% | 0.558 | S | S | . | * | trans | -28.2 | 138.8 | -144 | -177.8 | 0 | 0 | 0 | 0 | 116.7 | D26 G27 V31 S32 Y33 | D26-S29 VanDerWaalsContact OD2-CA 3.23Å; D26-S29 WeakPolarHBondContact OD2-CA 3.23Å; D26-S29 WeakPolarHBondContact OD2-CB 3.18Å; D26-S29 PolarHBondContact OD2-OG 3.16Å; G27-S29 VanDerWaalsContact O-CA 3.27Å; G27-S29 WeakPolarHBondContact O-CA 3.01Å; G27-S29 PolarHBondContact O-N 3.26Å; S29-V31 PolarHBondContact O-N 3.41Å; S29-S32 WeakPolarHBondContact O-CA 3.22Å; S29-S32 WeakPolarHBondContact O-CB 3.26Å; S29-S32 PolarHBondContact O-N 3.37Å; S29-S32 PolarHBondContact O-OG 2.75Å; S29-Y33 PolarHBondContact O-N 2.92Å | ||
| 30 | K | 75.2 | Confident | 71 | Confident | 86 Ų | 86 | 94.7 Ų | 94.7 | 37% | 0.374 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -39.1 | -37.9 | 171.8 | 179 | 179.4 | 178.5 | -176.4 | 0 | 113.8 | D26 S32 Y33 T34 | D26-K30 WeakPolarHBondContact OD1-CB 3.15Å; D26-K30 PolarHBondContact OD1-N 3.13Å; D26-K30 PolarHBondContact OD2-N 3.21Å; K30-S32 VanDerWaalsContact C-N 3.31Å; K30-S32 PolarHBondContact O-N 2.97Å; K30-Y33 PolarHBondContact O-N 3.33Å; K30-Y33 VanDerWaalsContact O-N 3.13Å; K30-T34 PolarHBondContact O-N 3.13Å; K30-T34 PolarHBondContact O-OG1 3.46Å; K30-T34 VanDerWaalsContact O-OG1 3.1Å |
| 31 | V | 78.4 | Confident | 73.7 | Confident | 110 Ų | 110 | 86.7 Ų | 86.7 | 67% | 0.667 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58 | -39.7 | 175.9 | -177.8 | 0 | 0 | 0 | 0 | 112.6 | S29 L35 | S29-V31 PolarHBondContact O-N 3.41Å; V31-L35 WeakPolarHBondContact O-CB 3.47Å; V31-L35 PolarHBondContact O-N 2.74Å |
| 32 | S | 85.3 | Confident | 75.8 | Confident | 61 Ų | 61 | 82.5 Ų | 82.5 | 43% | 0.427 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.6 | -35.4 | 176 | 83.8 | 0 | 0 | 0 | 0 | 112.2 | P28 S29 K30 L35 Q36 | P28-S32 PolarHBondContact O-OG 3.21Å; S29-S32 WeakPolarHBondContact O-CA 3.22Å; S29-S32 WeakPolarHBondContact O-CB 3.26Å; S29-S32 PolarHBondContact O-N 3.37Å; S29-S32 PolarHBondContact O-OG 2.75Å; K30-S32 VanDerWaalsContact C-N 3.31Å; K30-S32 PolarHBondContact O-N 2.97Å; S32-L35 PolarHBondContact O-N 2.9Å; S32-Q36 WeakPolarHBondContact O-CB 3.45Å; S32-Q36 PolarHBondContact O-N 3.48Å |
| 33 | Y | 91.5 | Very high | 78.2 | Confident | 105 Ų | 105 | 80.4 Ų | 80.4 | 41% | 0.412 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -69.6 | -43.8 | 173.1 | -175.9 | -124.7 | 0 | 0 | 0 | 111.6 | S29 K30 L35 Q36 R37 | S29-Y33 PolarHBondContact O-N 2.92Å; K30-Y33 PolarHBondContact O-N 3.33Å; K30-Y33 VanDerWaalsContact O-N 3.13Å; Y33-L35 VanDerWaalsContact C-N 3.31Å; Y33-L35 PolarHBondContact O-N 2.78Å; Y33-Q36 PolarHBondContact O-N 2.8Å; Y33-R37 HydrophobicContact CD2-CG 4.11Å; Y33-R37 HydrophobicContact CE1-CG 4.41Å; Y33-R37 HydrophobicContact CE2-CG 3.87Å; Y33-R37 HydrophobicContact CG-CG 4.48Å; Y33-R37 WeakPolarHBondContact O-CB 3.46Å; Y33-R37 VanDerWaalsContact O-CG 3.23Å; Y33-R37 WeakPolarHBondContact O-CG 3.32Å; Y33-R37 PolarHBondContact O-N 2.81Å |
| 34 | T | 92.4 | Very high | 80.2 | Confident | 42 Ų | 42 | 77.8 Ų | 77.8 | 26% | 0.258 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -52.3 | -49.4 | 169.1 | -59.6 | 0 | 0 | 0 | 0 | 111 | K30 R37 Q38 L76 E79 | K30-T34 PolarHBondContact O-N 3.13Å; K30-T34 PolarHBondContact O-OG1 3.46Å; K30-T34 VanDerWaalsContact O-OG1 3.1Å; T34-R37 PolarHBondContact O-N 3.42Å; T34-Q38 WeakPolarHBondContact O-CB 3.44Å; T34-Q38 PolarHBondContact O-N 3.45Å; T34-L76 HydrophobicContact CG2-CD2 3.93Å; T34-E79 WeakPolarHBondContact CB-OE2 3.49Å; T34-E79 WeakPolarHBondContact CG2-OE2 3.27Å; T34-E79 VanDerWaalsContact OG1-CD 3.3Å; T34-E79 PolarHBondContact OG1-OE2 2.83Å |
| 35 | L | 91.6 | Very high | 82.3 | Confident | 114 Ų | 114 | 74.9 Ų | 74.9 | 60% | 0.597 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -63.9 | -45.9 | 179 | -176.1 | 60.5 | 0 | 0 | 0 | 112.1 | V31 S32 Y33 R37 Q38 T39 | V31-L35 WeakPolarHBondContact O-CB 3.47Å; V31-L35 PolarHBondContact O-N 2.74Å; S32-L35 PolarHBondContact O-N 2.9Å; Y33-L35 VanDerWaalsContact C-N 3.31Å; Y33-L35 PolarHBondContact O-N 2.78Å; L35-R37 VanDerWaalsContact C-N 3.33Å; L35-R37 PolarHBondContact O-N 3.16Å; L35-Q38 PolarHBondContact O-N 3.23Å; L35-T39 WeakPolarHBondContact O-CB 3.39Å; L35-T39 PolarHBondContact O-N 2.83Å; L35-T39 PolarHBondContact O-OG1 3.06Å |
| 36 | Q | 93.9 | Very high | 84.4 | Confident | 113 Ų | 113 | 74.1 Ų | 74.1 | 53% | 0.528 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -57.6 | -45.4 | 175.6 | -173 | -172 | 30 | 0 | 0 | 111.5 | S32 Y33 T39 I40 | S32-Q36 WeakPolarHBondContact O-CB 3.45Å; S32-Q36 PolarHBondContact O-N 3.48Å; Y33-Q36 PolarHBondContact O-N 2.8Å; Q36-T39 PolarHBondContact O-N 3.35Å; Q36-I40 HydrophobicContact CG-CD1 4.03Å; Q36-I40 VanDerWaalsContact O-CG1 3.31Å; Q36-I40 WeakPolarHBondContact O-CG1 3.23Å; Q36-I40 PolarHBondContact O-N 2.89Å |
| 37 | R | 93.3 | Very high | 86 | Confident | 16 Ų | 16 | 75.6 Ų | 75.6 | 6% | 0.06 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -65.2 | -43.1 | 178.5 | -68 | -137.3 | -83.6 | 2.1 | -173.3 | 111.9 | Y33 T34 L35 T39 I40 F41 I72 E75 E79 | Y33-R37 HydrophobicContact CD2-CG 4.11Å; Y33-R37 HydrophobicContact CE1-CG 4.41Å; Y33-R37 HydrophobicContact CE2-CG 3.87Å; Y33-R37 HydrophobicContact CG-CG 4.48Å; Y33-R37 WeakPolarHBondContact O-CB 3.46Å; Y33-R37 VanDerWaalsContact O-CG 3.23Å; Y33-R37 WeakPolarHBondContact O-CG 3.32Å; Y33-R37 PolarHBondContact O-N 2.81Å; T34-R37 PolarHBondContact O-N 3.42Å; L35-R37 VanDerWaalsContact C-N 3.33Å; L35-R37 PolarHBondContact O-N 3.16Å; R37-T39 VanDerWaalsContact C-N 3.34Å; R37-T39 PolarHBondContact O-N 3.2Å; R37-I40 PolarHBondContact O-N 3.06Å; R37-F41 WeakPolarHBondContact O-CB 3.5Å; R37-F41 PolarHBondContact O-N 2.78Å; R37-I72 HydrophobicContact CB-CG2 4.07Å; R37-E75 IonicContact CZ-OE2 3.15Å; R37-E75 VanDerWaalsContact CZ-OE2 3.24Å; R37-E75 IonicContact NE-OE2 2.68Å; R37-E75 PolarHBondContact NE-OE2 3.03Å; R37-E75 IonicContact NH1-OE2 2.73Å; R37-E75 PolarHBondContact NH1-OE2 2.62Å; R37-E79 IonicContact CZ-OE1 2.68Å; R37-E79 IonicContact CZ-OE2 2.75Å; R37-E79 IonicContact NH1-OE1 3.03Å; R37-E79 PolarHBondContact NH1-OE1 3.01Å; R37-E79 IonicContact NH1-OE2 2.82Å; R37-E79 IonicContact NH2-OE1 3.8Å; R37-E79 PolarHBondContact NH2-OE1 3.46Å; R37-E79 VanDerWaalsContact NH2-OE1 3.15Å; R37-E79 IonicContact NH2-OE2 3.24Å; R37-E79 PolarHBondContact NH2-OE2 3.39Å |
| 38 | Q | 94.4 | Very high | 87.1 | Confident | 72 Ų | 72 | 75 Ų | 75 | 34% | 0.336 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.4 | -40.3 | 173.7 | -175.2 | 65.1 | 78.2 | 0 | 0 | 112.2 | T34 L35 F41 N42 L76 | T34-Q38 WeakPolarHBondContact O-CB 3.44Å; T34-Q38 PolarHBondContact O-N 3.45Å; L35-Q38 PolarHBondContact O-N 3.23Å; Q38-F41 PolarHBondContact O-N 2.97Å; Q38-N42 PolarHBondContact NE2-OD1 2.93Å; Q38-N42 WeakPolarHBondContact O-CB 3.28Å; Q38-N42 PolarHBondContact O-N 3.38Å; Q38-N42 PolarHBondContact O-OD1 3.24Å; Q38-L76 HydrophobicContact CB-CD1 4.47Å; Q38-L76 HydrophobicContact CB-CD2 4.49Å |
| 39 | T | 94.4 | Very high | 88.4 | Confident | 66 Ų | 66 | 77.1 Ų | 77.1 | 41% | 0.405 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.6 | -45.6 | 175.5 | -60.5 | 0 | 0 | 0 | 0 | 111.7 | L35 Q36 R37 F41 N42 I43 | L35-T39 WeakPolarHBondContact O-CB 3.39Å; L35-T39 PolarHBondContact O-N 2.83Å; L35-T39 PolarHBondContact O-OG1 3.06Å; Q36-T39 PolarHBondContact O-N 3.35Å; R37-T39 VanDerWaalsContact C-N 3.34Å; R37-T39 PolarHBondContact O-N 3.2Å; T39-F41 VanDerWaalsContact C-N 3.34Å; T39-F41 PolarHBondContact O-N 3.41Å; T39-N42 PolarHBondContact O-N 2.76Å; T39-I43 HydrophobicContact CG2-CD1 3.73Å; T39-I43 HydrophobicContact CG2-CG1 4.47Å; T39-I43 WeakPolarHBondContact O-CB 3.29Å; T39-I43 VanDerWaalsContact O-CG1 3.29Å; T39-I43 WeakPolarHBondContact O-CG1 3.45Å; T39-I43 PolarHBondContact O-N 3.04Å |
| 40 | I | 94.8 | Very high | 88.9 | Confident | 65 Ų | 65 | 80.1 Ų | 80.1 | 33% | 0.333 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.4 | -41.3 | 176.4 | -69.3 | 165.7 | 0 | 0 | 0 | 111 | Q36 R37 S44 I72 | Q36-I40 HydrophobicContact CG-CD1 4.03Å; Q36-I40 VanDerWaalsContact O-CG1 3.31Å; Q36-I40 WeakPolarHBondContact O-CG1 3.23Å; Q36-I40 PolarHBondContact O-N 2.89Å; R37-I40 PolarHBondContact O-N 3.06Å; I40-S44 VanDerWaalsContact O-CB 3.23Å; I40-S44 WeakPolarHBondContact O-CB 3.43Å; I40-S44 PolarHBondContact O-N 2.97Å; I40-S44 PolarHBondContact O-OG 3.41Å; I40-I72 HydrophobicContact CG2-CD1 3.97Å |
| 41 | F | 95 | Very high | 88.4 | Confident | 31 Ų | 31 | 81.4 Ų | 81.4 | 14% | 0.136 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -58.9 | -53.1 | 175.5 | -177 | -89.9 | 0 | 0 | 0 | 111 | R37 Q38 T39 I43 S44 L45 L69 I72 Q73 | R37-F41 WeakPolarHBondContact O-CB 3.5Å; R37-F41 PolarHBondContact O-N 2.78Å; Q38-F41 PolarHBondContact O-N 2.97Å; T39-F41 VanDerWaalsContact C-N 3.34Å; T39-F41 PolarHBondContact O-N 3.41Å; F41-I43 PolarHBondContact O-N 2.86Å; F41-S44 PolarHBondContact O-N 3.18Å; F41-L45 HydrophobicContact CE1-CD2 4.35Å; F41-L45 WeakPolarHBondContact O-CB 3.38Å; F41-L45 PolarHBondContact O-N 3.1Å; F41-L69 HydrophobicContact CB-CD2 4.5Å; F41-L69 HydrophobicContact CD2-CB 4.42Å; F41-L69 HydrophobicContact CD2-CD2 3.43Å; F41-L69 VanDerWaalsContact CD2-CD2 3.43Å; F41-L69 HydrophobicContact CE2-CB 4.16Å; F41-L69 HydrophobicContact CE2-CD2 3.7Å; F41-L69 HydrophobicContact CG-CD2 3.98Å; F41-L69 HydrophobicContact CZ-CD2 4.44Å; F41-I72 HydrophobicContact CB-CG2 3.89Å; F41-I72 HydrophobicContact CD2-CB 4.3Å; F41-I72 HydrophobicContact CD2-CG2 4.06Å; F41-I72 HydrophobicContact CG-CG2 4.38Å; F41-Q73 HydrophobicContact CE2-CB 3.98Å |
| 42 | N | 94 | Very high | 87.7 | Confident | 80 Ų | 80 | 86.1 Ų | 86.1 | 43% | 0.428 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.5 | -43.9 | -178.7 | -68.8 | -1.3 | 0 | 0 | 0 | 112.1 | Q38 T39 M46 | Q38-N42 PolarHBondContact NE2-OD1 2.93Å; Q38-N42 WeakPolarHBondContact O-CB 3.28Å; Q38-N42 PolarHBondContact O-N 3.38Å; Q38-N42 PolarHBondContact O-OD1 3.24Å; T39-N42 PolarHBondContact O-N 2.76Å; N42-M46 WeakPolarHBondContact O-CB 3.34Å; N42-M46 WeakPolarHBondContact O-CG 3.2Å; N42-M46 PolarHBondContact O-N 3.4Å |
| 43 | I | 93.9 | Very high | 86.5 | Confident | 87 Ų | 87 | 88.2 Ų | 88.2 | 45% | 0.446 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64.9 | -41.7 | 177.1 | -68.2 | 169.3 | 0 | 0 | 0 | 111.2 | T39 F41 M46 K47 | T39-I43 HydrophobicContact CG2-CD1 3.73Å; T39-I43 HydrophobicContact CG2-CG1 4.47Å; T39-I43 WeakPolarHBondContact O-CB 3.29Å; T39-I43 VanDerWaalsContact O-CG1 3.29Å; T39-I43 WeakPolarHBondContact O-CG1 3.45Å; T39-I43 PolarHBondContact O-N 3.04Å; F41-I43 PolarHBondContact O-N 2.86Å; I43-M46 PolarHBondContact O-N 2.99Å; I43-K47 HydrophobicContact CG2-CD 4.32Å; I43-K47 WeakPolarHBondContact O-CB 3.48Å; I43-K47 WeakPolarHBondContact O-CG 3.38Å; I43-K47 PolarHBondContact O-N 3.19Å |
| 44 | S | 91.3 | Very high | 84.9 | Confident | 29 Ų | 29 | 90.3 Ų | 90.3 | 20% | 0.203 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -69.4 | -38.6 | -179.6 | -58.2 | 0 | 0 | 0 | 0 | 111.7 | I40 F41 K47 L48 | I40-S44 VanDerWaalsContact O-CB 3.23Å; I40-S44 WeakPolarHBondContact O-CB 3.43Å; I40-S44 PolarHBondContact O-N 2.97Å; I40-S44 PolarHBondContact O-OG 3.41Å; F41-S44 PolarHBondContact O-N 3.18Å; S44-K47 PolarHBondContact O-N 3.24Å; S44-L48 VanDerWaalsContact O-CB 3.3Å; S44-L48 WeakPolarHBondContact O-CB 3.42Å; S44-L48 PolarHBondContact O-N 2.82Å |
| 45 | L | 91.2 | Very high | 83.7 | Confident | 56 Ų | 56 | 94.1 Ų | 94.1 | 29% | 0.293 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.3 | -49.6 | 172.6 | -159.9 | 78.9 | 0 | 0 | 0 | 110.7 | F41 K47 L48 Y49 L69 | F41-L45 HydrophobicContact CE1-CD2 4.35Å; F41-L45 WeakPolarHBondContact O-CB 3.38Å; F41-L45 PolarHBondContact O-N 3.1Å; L45-K47 VanDerWaalsContact C-N 3.31Å; L45-K47 PolarHBondContact O-N 2.98Å; L45-L48 PolarHBondContact O-N 2.74Å; L45-Y49 HydrophobicContact CD1-CD2 3.97Å; L45-Y49 HydrophobicContact CD1-CE2 3.62Å; L45-Y49 HydrophobicContact CG-CD2 3.98Å; L45-Y49 HydrophobicContact CG-CE2 4.16Å; L45-Y49 WeakPolarHBondContact O-CD2 3.5Å; L45-Y49 PolarHBondContact O-N 3.26Å; L45-L69 HydrophobicContact CD1-CD1 4.34Å |
| 46 | M | 89 | Confident | 82.8 | Confident | 109 Ų | 109 | 96.1 Ų | 96.1 | 54% | 0.537 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62 | -36.3 | 177.7 | -75.6 | -72.7 | 98.7 | 0 | 0 | 112.7 | N42 I43 N50 | N42-M46 WeakPolarHBondContact O-CB 3.34Å; N42-M46 WeakPolarHBondContact O-CG 3.2Å; N42-M46 PolarHBondContact O-N 3.4Å; I43-M46 PolarHBondContact O-N 2.99Å; M46-N50 WeakPolarHBondContact O-CB 3.48Å; M46-N50 PolarHBondContact O-N 2.97Å; M46-N50 PolarHBondContact O-ND2 3.47Å; M46-N50 PolarHBondContact SD-ND2 3.41Å; M46-N50 VanDerWaalsContact SD-ND2 3.4Å |
| 47 | K | 86.1 | Confident | 81.9 | Confident | 125 Ų | 125 | 93 Ų | 93 | 54% | 0.543 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -64.1 | -55.9 | 170.1 | -78.2 | -179.4 | 178.3 | -177.2 | 0 | 111.2 | I43 S44 L45 Y49 N50 H51 | I43-K47 HydrophobicContact CG2-CD 4.32Å; I43-K47 WeakPolarHBondContact O-CB 3.48Å; I43-K47 WeakPolarHBondContact O-CG 3.38Å; I43-K47 PolarHBondContact O-N 3.19Å; S44-K47 PolarHBondContact O-N 3.24Å; L45-K47 VanDerWaalsContact C-N 3.31Å; L45-K47 PolarHBondContact O-N 2.98Å; K47-Y49 VanDerWaalsContact C-N 3.27Å; K47-Y49 PolarHBondContact O-N 3.25Å; K47-N50 PolarHBondContact O-N 3.09Å; K47-H51 VanDerWaalsContact C-CD2 3.48Å; K47-H51 WeakPolarHBondContact O-CB 3.33Å; K47-H51 PolarHBondContact O-CD2 3.15Å; K47-H51 PolarHBondContact O-N 2.75Å |
| 48 | L | 83.4 | Confident | 81.5 | Confident | 36 Ų | 36 | 95 Ų | 95 | 19% | 0.188 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -53.8 | -40.5 | -176 | -175.5 | 63.2 | 0 | 0 | 0 | 113.2 | S44 L45 I65 L69 | S44-L48 VanDerWaalsContact O-CB 3.3Å; S44-L48 WeakPolarHBondContact O-CB 3.42Å; S44-L48 PolarHBondContact O-N 2.82Å; L45-L48 PolarHBondContact O-N 2.74Å; L48-I65 HydrophobicContact CD2-CG2 4.26Å; L48-L69 HydrophobicContact CD2-CD1 4.04Å |
| 49 | Y | 79.9 | Confident | 81.3 | Confident | 167 Ų | 167 | 98.1 Ų | 98.1 | 66% | 0.655 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -98.7 | -14.5 | -175.6 | -68.8 | -81.8 | 0 | 0 | 0 | 115.7 | L45 K47 | L45-Y49 HydrophobicContact CD1-CD2 3.97Å; L45-Y49 HydrophobicContact CD1-CE2 3.62Å; L45-Y49 HydrophobicContact CG-CD2 3.98Å; L45-Y49 HydrophobicContact CG-CE2 4.16Å; L45-Y49 WeakPolarHBondContact O-CD2 3.5Å; L45-Y49 PolarHBondContact O-N 3.26Å; K47-Y49 VanDerWaalsContact C-N 3.27Å; K47-Y49 PolarHBondContact O-N 3.25Å |
| 50 | N | 77.3 | Confident | 81 | Confident | 112 Ų | 112 | 102.6 Ų | 102.6 | 60% | 0.599 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -102.8 | 1.9 | 172.7 | -62.2 | -90.4 | 0 | 0 | 0 | 113.5 | M46 K47 R52 | M46-N50 WeakPolarHBondContact O-CB 3.48Å; M46-N50 PolarHBondContact O-N 2.97Å; M46-N50 PolarHBondContact O-ND2 3.47Å; M46-N50 PolarHBondContact SD-ND2 3.41Å; M46-N50 VanDerWaalsContact SD-ND2 3.4Å; K47-N50 PolarHBondContact O-N 3.09Å; N50-R52 PolarHBondContact O-N 2.73Å |
| 51 | H | 65.8 | Low | 80.7 | Confident | 113 Ų | 113 | 105.5 Ų | 105.5 | 52% | 0.523 | 52% | 0.524 | S | S | . | . | trans | -66.7 | 101.7 | 173 | -82.1 | -38.7 | 0 | 0 | 0 | 110.8 | K47 | K47-H51 VanDerWaalsContact C-CD2 3.48Å; K47-H51 WeakPolarHBondContact O-CB 3.33Å; K47-H51 PolarHBondContact O-CD2 3.15Å; K47-H51 PolarHBondContact O-N 2.75Å | ||
| 52 | R | 62.5 | Low | 80.5 | Confident | 210 Ų | 210 | 105.9 Ų | 105.9 | 79% | 0.792 | 53% | 0.529 | S | S | * | . | trans | -47.9 | 130.9 | 167.8 | -173.9 | 177.8 | -175.9 | 175.5 | 1.2 | 109.2 | N50 L54 | N50-R52 PolarHBondContact O-N 2.73Å; R52-L54 PolarHBondContact O-N 3.46Å | ||
| 53 | P | 61.7 | Low | 80.5 | Confident | 104 Ų | 104 | 105.4 Ų | 105.4 | 68% | 0.675 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.7 | 30.9 | -166.2 | 29.9 | -38 | 0 | 0 | 0 | 115.3 | ||
| 54 | L | 57.3 | Low | 80.5 | Confident | 149 Ų | 149 | 106.5 Ų | 106.5 | 78% | 0.78 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.8 | -15.6 | 178 | -161.5 | 65.6 | 0 | 0 | 0 | 112.5 | R52 | R52-L54 PolarHBondContact O-N 3.46Š|
| 55 | T | 66.6 | Low | 80.6 | Confident | 122 Ų | 122 | 107.7 Ų | 107.7 | 75% | 0.748 | 54% | 0.539 | S | S | * | . | S | Bend | trans | -152.1 | 92.7 | 167.8 | -55.9 | 0 | 0 | 0 | 0 | 108.6 | ||
| 56 | E | 73.1 | Confident | 80.7 | Confident | 156 Ų | 156 | 107.8 Ų | 107.8 | 73% | 0.729 | 54% | 0.54 | S | S | * | . | P | Polyproline II helix | trans | -67.4 | 138.4 | 173.8 | -65.3 | -151.8 | 153.7 | 0 | 0 | 111 | ||
| 57 | P | 75.6 | Confident | 81 | Confident | 47 Ų | 47 | 106.1 Ų | 106.1 | 31% | 0.305 | 53% | 0.533 | S | S | . | . | P | Polyproline II helix | trans | -64.7 | 139.9 | 173.1 | 24.9 | -30.9 | 0 | 0 | 0 | 110.7 | K61 T62 | P57-K61 HydrophobicContact CB-CB 4.05Å; P57-T62 WeakPolarHBondContact CG-OG1 3.41Å; P57-T62 PolarHBondContact O-OG1 3.4Å |
| 58 | S | 84.6 | Confident | 81.4 | Confident | 60 Ų | 60 | 104.5 Ų | 104.5 | 42% | 0.42 | 53% | 0.528 | S | S | . | . | P | Polyproline II helix | trans | -56 | 147.8 | 175.4 | 59.7 | 0 | 0 | 0 | 0 | 111.3 | Q60 K61 T62 | S58-Q60 PolarHBondContact O-N 3Å; S58-K61 WeakPolarHBondContact O-CA 3.48Å; S58-K61 WeakPolarHBondContact O-CB 3.29Å; S58-K61 PolarHBondContact O-N 2.81Å; S58-T62 PolarHBondContact O-N 3.49Å; S58-T62 PolarHBondContact O-OG1 2.92Å |
| 59 | L | 89 | Confident | 82 | Confident | 136 Ų | 136 | 103.3 Ų | 103.3 | 71% | 0.712 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -48.9 | -39.3 | -175.7 | -178 | 62.9 | 0 | 0 | 0 | 113 | K61 T62 V63 | L59-K61 PolarHBondContact O-N 3.23Å; L59-T62 PolarHBondContact O-N 2.83Å; L59-V63 HydrophobicContact CD1-CG2 4.02Å; L59-V63 HydrophobicContact CG-CG2 4.27Å; L59-V63 WeakPolarHBondContact O-CB 3.46Å; L59-V63 VanDerWaalsContact O-CG2 3.3Å; L59-V63 WeakPolarHBondContact O-CG2 3.45Å; L59-V63 PolarHBondContact O-N 3.47Å |
| 60 | Q | 90.1 | Very high | 82.7 | Confident | 160 Ų | 160 | 102 Ų | 102 | 75% | 0.748 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -56.7 | -45.5 | 173.7 | -172.7 | -169.6 | 21.9 | 0 | 0 | 113 | S58 L64 | S58-Q60 PolarHBondContact O-N 3Å; Q60-L64 VanDerWaalsContact O-CB 3.23Å; Q60-L64 WeakPolarHBondContact O-CB 3.32Å; Q60-L64 PolarHBondContact O-N 3.31Å |
| 61 | K | 87.9 | Confident | 83.5 | Confident | 126 Ų | 126 | 104.5 Ų | 104.5 | 55% | 0.548 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -66.9 | -44.2 | 176.8 | -68.5 | 175.4 | -179.9 | 176.4 | 0 | 110.6 | P57 S58 L59 L64 I65 | P57-K61 HydrophobicContact CB-CB 4.05Å; S58-K61 WeakPolarHBondContact O-CA 3.48Å; S58-K61 WeakPolarHBondContact O-CB 3.29Å; S58-K61 PolarHBondContact O-N 2.81Å; L59-K61 PolarHBondContact O-N 3.23Å; K61-L64 PolarHBondContact O-N 2.91Å; K61-I65 WeakPolarHBondContact O-CB 3.21Å; K61-I65 WeakPolarHBondContact O-CD1 3.38Å; K61-I65 VanDerWaalsContact O-CG1 3.23Å; K61-I65 WeakPolarHBondContact O-CG1 3.3Å; K61-I65 PolarHBondContact O-N 2.81Å |
| 62 | T | 90.2 | Very high | 84.9 | Confident | 39 Ų | 39 | 99.8 Ų | 99.8 | 24% | 0.239 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -61.4 | -45.9 | 178.4 | -52.4 | 0 | 0 | 0 | 0 | 111.7 | P57 S58 L59 I65 N66 | P57-T62 WeakPolarHBondContact CG-OG1 3.41Å; P57-T62 PolarHBondContact O-OG1 3.4Å; S58-T62 PolarHBondContact O-N 3.49Å; S58-T62 PolarHBondContact O-OG1 2.92Å; L59-T62 PolarHBondContact O-N 2.83Å; T62-I65 PolarHBondContact O-N 3.4Å; T62-N66 WeakPolarHBondContact O-CB 3.18Å; T62-N66 PolarHBondContact O-N 3.16Å; T62-N66 PolarHBondContact O-ND2 2.86Å |
| 63 | V | 93.9 | Very high | 86.4 | Confident | 71 Ų | 71 | 95.3 Ų | 95.3 | 43% | 0.43 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -65.7 | -41.8 | 176 | 170.5 | 0 | 0 | 0 | 0 | 111.4 | L59 N66 N67 | L59-V63 HydrophobicContact CD1-CG2 4.02Å; L59-V63 HydrophobicContact CG-CG2 4.27Å; L59-V63 WeakPolarHBondContact O-CB 3.46Å; L59-V63 VanDerWaalsContact O-CG2 3.3Å; L59-V63 WeakPolarHBondContact O-CG2 3.45Å; L59-V63 PolarHBondContact O-N 3.47Å; V63-N66 PolarHBondContact O-N 3.33Å; V63-N67 WeakPolarHBondContact O-CB 3.23Å; V63-N67 PolarHBondContact O-N 3.46Å; V63-N67 PolarHBondContact O-ND2 3.11Å |
| 64 | L | 94.5 | Very high | 87.9 | Confident | 109 Ų | 109 | 95 Ų | 95 | 57% | 0.571 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -62.4 | -44.4 | 176.4 | -179.9 | 61.3 | 0 | 0 | 0 | 112 | Q60 K61 N67 M68 | Q60-L64 VanDerWaalsContact O-CB 3.23Å; Q60-L64 WeakPolarHBondContact O-CB 3.32Å; Q60-L64 PolarHBondContact O-N 3.31Å; K61-L64 PolarHBondContact O-N 2.91Å; L64-N67 PolarHBondContact O-N 3.42Å; L64-M68 WeakPolarHBondContact O-CB 3.1Å; L64-M68 PolarHBondContact O-N 2.84Å |
| 65 | I | 92.3 | Very high | 89.5 | Confident | 54 Ų | 54 | 89.6 Ų | 89.6 | 28% | 0.277 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 176 | -69.3 | 163.5 | 0 | 0 | 0 | 110.3 | L48 K61 T62 N67 M68 L69 | L48-I65 HydrophobicContact CD2-CG2 4.26Å; K61-I65 WeakPolarHBondContact O-CB 3.21Å; K61-I65 WeakPolarHBondContact O-CD1 3.38Å; K61-I65 VanDerWaalsContact O-CG1 3.23Å; K61-I65 WeakPolarHBondContact O-CG1 3.3Å; K61-I65 PolarHBondContact O-N 2.81Å; T62-I65 PolarHBondContact O-N 3.4Å; I65-N67 PolarHBondContact O-N 2.85Å; I65-M68 PolarHBondContact O-N 3.28Å; I65-L69 HydrophobicContact CG2-CD1 3.85Å; I65-L69 HydrophobicContact CG2-CG 4.33Å; I65-L69 WeakPolarHBondContact O-CB 3.37Å; I65-L69 VanDerWaalsContact O-CG 3.29Å; I65-L69 WeakPolarHBondContact O-CG 3.22Å; I65-L69 PolarHBondContact O-N 3.23Å |
| 66 | N | 92.9 | Very high | 90.6 | Very high | 59 Ų | 59 | 85.2 Ų | 85.2 | 32% | 0.316 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -65.6 | -36 | 178.4 | -82.2 | -86.2 | 0 | 0 | 0 | 113 | T62 V63 R70 | T62-N66 WeakPolarHBondContact O-CB 3.18Å; T62-N66 PolarHBondContact O-N 3.16Å; T62-N66 PolarHBondContact O-ND2 2.86Å; V63-N66 PolarHBondContact O-N 3.33Å; N66-R70 WeakPolarHBondContact O-CB 3.36Å; N66-R70 WeakPolarHBondContact O-CG 3.23Å; N66-R70 PolarHBondContact O-N 2.77Å |
| 67 | N | 96.1 | Very high | 91.4 | Very high | 73 Ų | 73 | 85.2 Ų | 85.2 | 39% | 0.39 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -67.9 | -40.6 | 173.8 | -72.8 | -13.1 | 0 | 0 | 0 | 111.9 | V63 L64 I65 R70 R71 | V63-N67 WeakPolarHBondContact O-CB 3.23Å; V63-N67 PolarHBondContact O-N 3.46Å; V63-N67 PolarHBondContact O-ND2 3.11Å; L64-N67 PolarHBondContact O-N 3.42Å; I65-N67 PolarHBondContact O-N 2.85Å; N67-R70 PolarHBondContact OD1-NH2 3.26Å; N67-R71 WeakPolarHBondContact O-CB 3.4Å; N67-R71 PolarHBondContact O-N 2.95Å |
| 68 | M | 95.2 | Very high | 91.8 | Very high | 91 Ų | 91 | 88.7 Ų | 88.7 | 45% | 0.448 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -64.6 | -44.2 | 174.3 | -173.8 | -174.9 | -64.2 | 0 | 0 | 111.6 | L64 I65 R71 I72 | L64-M68 WeakPolarHBondContact O-CB 3.1Å; L64-M68 PolarHBondContact O-N 2.84Å; I65-M68 PolarHBondContact O-N 3.28Å; M68-R71 PolarHBondContact O-N 2.76Å; M68-I72 HydrophobicContact CG-CD1 3.87Å; M68-I72 WeakPolarHBondContact O-CB 3.4Å; M68-I72 VanDerWaalsContact O-CG1 3.3Å; M68-I72 WeakPolarHBondContact O-CG1 3.43Å; M68-I72 PolarHBondContact O-N 2.9Å |
| 69 | L | 95.3 | Very high | 91.6 | Very high | 12 Ų | 12 | 87.3 Ų | 87.3 | 6% | 0.063 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -60.8 | -47.5 | 176.1 | -75.4 | 171.1 | 0 | 0 | 0 | 111.6 | F41 L45 L48 I65 I72 Q73 | F41-L69 HydrophobicContact CB-CD2 4.5Å; F41-L69 HydrophobicContact CD2-CB 4.42Å; F41-L69 HydrophobicContact CD2-CD2 3.43Å; F41-L69 VanDerWaalsContact CD2-CD2 3.43Å; F41-L69 HydrophobicContact CE2-CB 4.16Å; F41-L69 HydrophobicContact CE2-CD2 3.7Å; F41-L69 HydrophobicContact CG-CD2 3.98Å; F41-L69 HydrophobicContact CZ-CD2 4.44Å; L45-L69 HydrophobicContact CD1-CD1 4.34Å; L48-L69 HydrophobicContact CD2-CD1 4.04Å; I65-L69 HydrophobicContact CG2-CD1 3.85Å; I65-L69 HydrophobicContact CG2-CG 4.33Å; I65-L69 WeakPolarHBondContact O-CB 3.37Å; I65-L69 VanDerWaalsContact O-CG 3.29Å; I65-L69 WeakPolarHBondContact O-CG 3.22Å; I65-L69 PolarHBondContact O-N 3.23Å; L69-I72 PolarHBondContact O-N 3.13Å; L69-Q73 VanDerWaalsContact O-CB 3.32Å; L69-Q73 WeakPolarHBondContact O-CB 3.31Å; L69-Q73 PolarHBondContact O-N 3.1Å |
| 70 | R | 95.4 | Very high | 90.5 | Very high | 140 Ų | 140 | 83 Ų | 83 | 53% | 0.528 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -58.3 | -49.6 | 175.4 | -78.9 | -168.8 | -71.8 | -166.6 | 0.1 | 112 | N66 N67 I72 Q73 E74 | N66-R70 WeakPolarHBondContact O-CB 3.36Å; N66-R70 WeakPolarHBondContact O-CG 3.23Å; N66-R70 PolarHBondContact O-N 2.77Å; N67-R70 PolarHBondContact OD1-NH2 3.26Å; R70-I72 PolarHBondContact O-N 3.37Å; R70-Q73 CarbonylContact O-C 3.07Å; R70-Q73 WeakPolarHBondContact O-CB 3.35Å; R70-Q73 PolarHBondContact O-N 2.83Å; R70-Q73 VanDerWaalsContact O-N 3.16Å; R70-E74 WeakPolarHBondContact O-CB 3.46Å; R70-E74 VanDerWaalsContact O-CG 3.29Å; R70-E74 WeakPolarHBondContact O-CG 3.37Å; R70-E74 PolarHBondContact O-N 3.21Å |
| 71 | R | 94.5 | Very high | 88.6 | Confident | 163 Ų | 163 | 80.4 Ų | 80.4 | 62% | 0.615 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -58 | -46.3 | 177.1 | 178.8 | 175.9 | 172.6 | 150.6 | 7.4 | 112.2 | N67 M68 Q73 E74 E75 | N67-R71 WeakPolarHBondContact O-CB 3.4Å; N67-R71 PolarHBondContact O-N 2.95Å; M68-R71 PolarHBondContact O-N 2.76Å; R71-Q73 VanDerWaalsContact C-N 3.34Å; R71-Q73 PolarHBondContact O-N 2.68Å; R71-E74 PolarHBondContact O-N 2.68Å; R71-E75 WeakPolarHBondContact CG-OE1 3.23Å; R71-E75 IonicContact CZ-OE1 3.1Å; R71-E75 IonicContact NE-OE1 3.38Å; R71-E75 PolarHBondContact NE-OE1 2.59Å; R71-E75 IonicContact NH2-OE1 3.83Å; R71-E75 PolarHBondContact NH2-OE1 3.43Å; R71-E75 VanDerWaalsContact NH2-OE1 3.1Å; R71-E75 WeakPolarHBondContact O-CB 3.23Å; R71-E75 WeakPolarHBondContact O-CG 3.47Å; R71-E75 PolarHBondContact O-N 2.85Å |
| 72 | I | 94.3 | Very high | 86.8 | Confident | 14 Ų | 14 | 79.7 Ų | 79.7 | 7% | 0.072 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -64.9 | -40 | 178 | -67.7 | 168.3 | 0 | 0 | 0 | 110.7 | R37 I40 F41 M68 L69 R70 E75 L76 | R37-I72 HydrophobicContact CB-CG2 4.07Å; I40-I72 HydrophobicContact CG2-CD1 3.97Å; F41-I72 HydrophobicContact CB-CG2 3.89Å; F41-I72 HydrophobicContact CD2-CB 4.3Å; F41-I72 HydrophobicContact CD2-CG2 4.06Å; F41-I72 HydrophobicContact CG-CG2 4.38Å; M68-I72 HydrophobicContact CG-CD1 3.87Å; M68-I72 WeakPolarHBondContact O-CB 3.4Å; M68-I72 VanDerWaalsContact O-CG1 3.3Å; M68-I72 WeakPolarHBondContact O-CG1 3.43Å; M68-I72 PolarHBondContact O-N 2.9Å; L69-I72 PolarHBondContact O-N 3.13Å; R70-I72 PolarHBondContact O-N 3.37Å; I72-E75 PolarHBondContact O-N 3.15Å; I72-L76 HydrophobicContact CG2-CD1 3.68Å; I72-L76 HydrophobicContact CG2-CG 4.13Å; I72-L76 VanDerWaalsContact O-CB 3.29Å; I72-L76 WeakPolarHBondContact O-CB 3.44Å; I72-L76 WeakPolarHBondContact O-CG 3.33Å; I72-L76 PolarHBondContact O-N 3.36Å |
| 73 | Q | 93.1 | Very high | 84.6 | Confident | 116 Ų | 116 | 86.4 Ų | 86.4 | 54% | 0.542 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -64.9 | -38 | 175.4 | -174 | 180 | -0.4 | 0 | 0 | 112.4 | F41 L69 R70 R71 K77 | F41-Q73 HydrophobicContact CE2-CB 3.98Å; L69-Q73 VanDerWaalsContact O-CB 3.32Å; L69-Q73 WeakPolarHBondContact O-CB 3.31Å; L69-Q73 PolarHBondContact O-N 3.1Å; R70-Q73 CarbonylContact O-C 3.07Å; R70-Q73 WeakPolarHBondContact O-CB 3.35Å; R70-Q73 PolarHBondContact O-N 2.83Å; R70-Q73 VanDerWaalsContact O-N 3.16Å; R71-Q73 VanDerWaalsContact C-N 3.34Å; R71-Q73 PolarHBondContact O-N 2.68Å; Q73-K77 VanDerWaalsContact O-CB 3.23Å; Q73-K77 WeakPolarHBondContact O-CB 3.29Å; Q73-K77 PolarHBondContact O-N 2.92Å |
| 74 | E | 94.1 | Very high | 82.1 | Confident | 99 Ų | 99 | 87.1 Ų | 87.1 | 46% | 0.463 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -66.8 | -43 | 174.9 | -73.9 | 159 | -156.9 | 0 | 0 | 111.7 | R70 R71 K77 Q78 | R70-E74 WeakPolarHBondContact O-CB 3.46Å; R70-E74 VanDerWaalsContact O-CG 3.29Å; R70-E74 WeakPolarHBondContact O-CG 3.37Å; R70-E74 PolarHBondContact O-N 3.21Å; R71-E74 PolarHBondContact O-N 2.68Å; E74-K77 PolarHBondContact O-N 3.05Å; E74-Q78 VanDerWaalsContact O-CG 3.32Å; E74-Q78 WeakPolarHBondContact O-CG 3.4Å; E74-Q78 PolarHBondContact O-N 2.92Å; E74-Q78 PolarHBondContact O-NE2 2.94Å |
| 75 | E | 91.8 | Very high | 79.3 | Confident | 35 Ų | 35 | 89.3 Ų | 89.3 | 16% | 0.164 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -67.2 | -42.4 | 175.1 | -71.4 | -176.5 | -152 | 0 | 0 | 111.5 | R37 R71 I72 K77 Q78 E79 | R37-E75 IonicContact CZ-OE2 3.15Å; R37-E75 VanDerWaalsContact CZ-OE2 3.24Å; R37-E75 IonicContact NE-OE2 2.68Å; R37-E75 PolarHBondContact NE-OE2 3.03Å; R37-E75 IonicContact NH1-OE2 2.73Å; R37-E75 PolarHBondContact NH1-OE2 2.62Å; R71-E75 WeakPolarHBondContact CG-OE1 3.23Å; R71-E75 IonicContact CZ-OE1 3.1Å; R71-E75 IonicContact NE-OE1 3.38Å; R71-E75 PolarHBondContact NE-OE1 2.59Å; R71-E75 IonicContact NH2-OE1 3.83Å; R71-E75 PolarHBondContact NH2-OE1 3.43Å; R71-E75 VanDerWaalsContact NH2-OE1 3.1Å; R71-E75 WeakPolarHBondContact O-CB 3.23Å; R71-E75 WeakPolarHBondContact O-CG 3.47Å; R71-E75 PolarHBondContact O-N 2.85Å; I72-E75 PolarHBondContact O-N 3.15Å; E75-K77 VanDerWaalsContact C-N 3.33Å; E75-K77 PolarHBondContact O-N 2.98Å; E75-Q78 PolarHBondContact O-N 3.1Å; E75-E79 WeakPolarHBondContact O-CB 3.3Å; E75-E79 WeakPolarHBondContact O-CG 3.49Å; E75-E79 PolarHBondContact O-N 3.37Å |
| 76 | L | 89.1 | Confident | 76.8 | Confident | 29 Ų | 29 | 94.9 Ų | 94.9 | 15% | 0.152 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -65.8 | -32.4 | 173.5 | -72 | 171.2 | 0 | 0 | 0 | 112.4 | T34 Q38 I72 G80 | T34-L76 HydrophobicContact CG2-CD2 3.93Å; Q38-L76 HydrophobicContact CB-CD1 4.47Å; Q38-L76 HydrophobicContact CB-CD2 4.49Å; I72-L76 HydrophobicContact CG2-CD1 3.68Å; I72-L76 HydrophobicContact CG2-CG 4.13Å; I72-L76 VanDerWaalsContact O-CB 3.29Å; I72-L76 WeakPolarHBondContact O-CB 3.44Å; I72-L76 WeakPolarHBondContact O-CG 3.33Å; I72-L76 PolarHBondContact O-N 3.36Å; L76-G80 PolarHBondContact O-N 3.29Å |
| 77 | K | 89 | Confident | 73.9 | Confident | 156 Ų | 156 | 96.9 Ų | 96.9 | 68% | 0.678 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -70.4 | -36.9 | 172.7 | -171.8 | 179 | 68.9 | 178.1 | 0 | 111.6 | Q73 E74 E75 G80 S81 | Q73-K77 VanDerWaalsContact O-CB 3.23Å; Q73-K77 WeakPolarHBondContact O-CB 3.29Å; Q73-K77 PolarHBondContact O-N 2.92Å; E74-K77 PolarHBondContact O-N 3.05Å; E75-K77 VanDerWaalsContact C-N 3.33Å; E75-K77 PolarHBondContact O-N 2.98Å; K77-G80 CarbonylContact O-C 3.6Å; K77-G80 PolarHBondContact O-N 3.41Å; K77-S81 PolarHBondContact O-N 3.47Å |
| 78 | Q | 84.6 | Confident | 71.1 | Confident | 120 Ų | 120 | 98.8 Ų | 98.8 | 56% | 0.561 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -67.9 | -40.7 | 172.4 | -74 | 165.7 | 83.9 | 0 | 0 | 111.5 | E74 E75 G80 S81 L82 | E74-Q78 VanDerWaalsContact O-CG 3.32Å; E74-Q78 WeakPolarHBondContact O-CG 3.4Å; E74-Q78 PolarHBondContact O-N 2.92Å; E74-Q78 PolarHBondContact O-NE2 2.94Å; E75-Q78 PolarHBondContact O-N 3.1Å; Q78-G80 VanDerWaalsContact C-N 3.32Å; Q78-S81 CarbonylContact O-C 3.6Å; Q78-S81 PolarHBondContact O-N 3.28Å; Q78-L82 WeakPolarHBondContact O-CG 3.34Å; Q78-L82 PolarHBondContact O-N 2.88Å |
| 79 | E | 81.4 | Confident | 68.1 | Low | 32 Ų | 32 | 99.9 Ų | 99.9 | 15% | 0.15 | 51% | 0.508 | C | S | . | . | H | α-helix | trans | -67.6 | -32 | 172.4 | -72.2 | 174.7 | 178 | 0 | 0 | 112.1 | T34 R37 E75 L82 | T34-E79 WeakPolarHBondContact CB-OE2 3.49Å; T34-E79 WeakPolarHBondContact CG2-OE2 3.27Å; T34-E79 VanDerWaalsContact OG1-CD 3.3Å; T34-E79 PolarHBondContact OG1-OE2 2.83Å; R37-E79 IonicContact CZ-OE1 2.68Å; R37-E79 IonicContact CZ-OE2 2.75Å; R37-E79 IonicContact NH1-OE1 3.03Å; R37-E79 PolarHBondContact NH1-OE1 3.01Å; R37-E79 IonicContact NH1-OE2 2.82Å; R37-E79 IonicContact NH2-OE1 3.8Å; R37-E79 PolarHBondContact NH2-OE1 3.46Å; R37-E79 VanDerWaalsContact NH2-OE1 3.15Å; R37-E79 IonicContact NH2-OE2 3.24Å; R37-E79 PolarHBondContact NH2-OE2 3.39Å; E75-E79 WeakPolarHBondContact O-CB 3.3Å; E75-E79 WeakPolarHBondContact O-CG 3.49Å; E75-E79 PolarHBondContact O-N 3.37Å; E79-L82 CarbonylContact O-C 3.58Å; E79-L82 PolarHBondContact O-N 3.32Å; E79-L82 VanDerWaalsContact O-O 3.08Å |
| 80 | G | 64.4 | Low | 65.2 | Low | 45 Ų | 45 | 104.4 Ų | 104.4 | 46% | 0.464 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -70 | -29.9 | 169.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | L76 K77 Q78 R83 | L76-G80 PolarHBondContact O-N 3.29Å; K77-G80 CarbonylContact O-C 3.6Å; K77-G80 PolarHBondContact O-N 3.41Å; Q78-G80 VanDerWaalsContact C-N 3.32Å; G80-R83 WeakPolarHBondContact O-CG 3.42Å |
| 81 | S | 50.3 | Low | 62.6 | Low | 106 Ų | 106 | 105.8 Ų | 105.8 | 74% | 0.741 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -76.3 | -33.5 | 169.7 | -169.2 | 0 | 0 | 0 | 0 | 111.7 | K77 Q78 R83 | K77-S81 PolarHBondContact O-N 3.47Å; Q78-S81 CarbonylContact O-C 3.6Å; Q78-S81 PolarHBondContact O-N 3.28Å; S81-R83 PolarHBondContact O-N 3.37Å |
| 82 | L | 49.8 | Very low | 59.9 | Low | 111 Ų | 111 | 103.8 Ų | 103.8 | 58% | 0.581 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -79.7 | 49.5 | 164.1 | -62.9 | 177.1 | 0 | 0 | 0 | 110.8 | Q78 E79 | Q78-L82 WeakPolarHBondContact O-CG 3.34Å; Q78-L82 PolarHBondContact O-N 2.88Å; E79-L82 CarbonylContact O-C 3.58Å; E79-L82 PolarHBondContact O-N 3.32Å; E79-L82 VanDerWaalsContact O-O 3.08Å |
| 83 | R | 45.2 | Very low | 56.9 | Low | 180 Ų | 180 | 108.3 Ų | 108.3 | 68% | 0.679 | 59% | 0.59 | S | S | * | * | trans | -43 | 132.6 | 162.9 | -80.3 | -63.4 | -65.5 | 165.5 | -2.1 | 107.8 | G80 S81 M85 | G80-R83 WeakPolarHBondContact O-CG 3.42Å; S81-R83 PolarHBondContact O-N 3.37Å; R83-M85 PolarHBondContact O-N 2.82Å | ||
| 84 | P | 41.2 | Very low | 54.3 | Low | 86 Ų | 86 | 109.2 Ų | 109.2 | 56% | 0.558 | 60% | 0.603 | S | S | * | * | trans | -52.7 | 113.6 | 162.3 | -23.3 | 33.5 | 0 | 0 | 0 | 106.9 | F86 | P84-F86 HydrophobicContact CB-CD2 4.15Å; P84-F86 HydrophobicContact CB-CE2 4.05Å; P84-F86 PolarHBondContact O-N 3.06Å | ||
| 85 | M | 34.9 | Very low | 51.7 | Low | 155 Ų | 155 | 112.2 Ų | 112.2 | 76% | 0.764 | 62% | 0.618 | S | S | * | * | trans | -72.9 | 79.8 | 171.6 | -170.4 | 166.9 | -174.2 | 0 | 0 | 106.4 | R83 T87 | R83-M85 PolarHBondContact O-N 2.82Å; M85-T87 HydrophobicContact CG-CG2 4.47Å; M85-T87 PolarHBondContact O-N 2.96Å | ||
| 86 | F | 40.7 | Very low | 49.5 | Very low | 171 Ų | 171 | 115.7 Ų | 115.7 | 75% | 0.75 | 64% | 0.643 | S | S | * | * | trans | -53.7 | 92.7 | 148.5 | -74 | -79 | 0 | 0 | 0 | 105.5 | P84 P88 | P84-F86 HydrophobicContact CB-CD2 4.15Å; P84-F86 HydrophobicContact CB-CE2 4.05Å; P84-F86 PolarHBondContact O-N 3.06Å; F86-P88 WeakPolarHBondContact O-CD 3.34Å | ||
| 87 | T | 32.6 | Very low | 46.8 | Very low | 101 Ų | 101 | 119.8 Ų | 119.8 | 62% | 0.62 | 67% | 0.674 | S | S | * | * | trans | -50.7 | 122.3 | 173.1 | 47.6 | 0 | 0 | 0 | 0 | 106.8 | M85 S89 | M85-T87 HydrophobicContact CG-CG2 4.47Å; M85-T87 PolarHBondContact O-N 2.96Å; T87-S89 PolarHBondContact O-N 2.84Å | ||
| 88 | P | 36.5 | Very low | 44.4 | Very low | 112 Ų | 112 | 118.6 Ų | 118.6 | 73% | 0.727 | 68% | 0.675 | S | S | * | * | trans | -61.3 | 100.1 | 162.1 | 26 | -30.9 | 0 | 0 | 0 | 105.8 | F86 S90 | F86-P88 WeakPolarHBondContact O-CD 3.34Å; P88-S90 PolarHBondContact O-N 2.9Å | ||
| 89 | S | 31.4 | Very low | 42 | Very low | 114 Ų | 114 | 118.3 Ų | 118.3 | 80% | 0.797 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 126.3 | 179.9 | -172.7 | 0 | 0 | 0 | 0 | 107.5 | T87 Q91 | T87-S89 PolarHBondContact O-N 2.84Å; S89-Q91 PolarHBondContact O-N 3.43Å |
| 90 | S | 35.6 | Very low | 40 | Very low | 108 Ų | 108 | 125.6 Ų | 125.6 | 76% | 0.755 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 134.3 | -156.7 | -54.5 | 0 | 0 | 0 | 0 | 113 | P88 | P88-S90 PolarHBondContact O-N 2.9Š|
| 91 | Q | 40.3 | Very low | 39 | Very low | 168 Ų | 168 | 133.6 Ų | 133.6 | 79% | 0.785 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 137.6 | 161.8 | -66.1 | 175.4 | -69.5 | 0 | 0 | 109.5 | S89 | S89-Q91 PolarHBondContact O-N 3.43Š|
| 92 | P | 36.9 | Very low | 38.2 | Very low | 122 Ų | 122 | 136 Ų | 136 | 79% | 0.792 | 73% | 0.729 | S | S | * | * | trans | -79.8 | 108.4 | 147.1 | 1.5 | 17.7 | 0 | 0 | 0 | 107.5 | ||||
| 93 | T | 33.2 | Very low | 37.5 | Very low | 109 Ų | 109 | 133.8 Ų | 133.8 | 67% | 0.669 | 73% | 0.734 | S | S | * | * | trans | -76.2 | 127.1 | 174.1 | -50 | 0 | 0 | 0 | 0 | 110.2 | E95 | T93-E95 HydrophobicContact CG2-CG 4.33Š| ||
| 94 | T | 36.9 | Very low | 37.8 | Very low | 134 Ų | 134 | 131.2 Ų | 131.2 | 82% | 0.822 | 74% | 0.741 | S | S | * | * | trans | -130.4 | 88.1 | 167.3 | 54.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 95 | E | 40.8 | Very low | 38 | Very low | 163 Ų | 163 | 133.4 Ų | 133.4 | 76% | 0.762 | 76% | 0.755 | S | S | * | * | trans | -64.8 | 173 | 157.1 | -75.5 | -94.3 | 123 | 0 | 0 | 110.9 | T93 | T93-E95 HydrophobicContact CG2-CG 4.33Š| ||
| 96 | P | 45.8 | Very low | 37.9 | Very low | 108 Ų | 108 | 129.9 Ų | 129.9 | 70% | 0.701 | 75% | 0.751 | S | S | * | * | -129.8 | 176.5 | -56 | 37.2 | -21.5 | 0 | 0 | 0 | 110.6 | |||||
| 97 | S | 32.3 | Very low | 37.6 | Very low | 115 Ų | 115 | 131.2 Ų | 131.2 | 80% | 0.804 | 76% | 0.756 | S | S | * | * | trans | -146.3 | 108.2 | 168.7 | 65.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 98 | D | 38.7 | Very low | 37.5 | Very low | 131 Ų | 131 | 131.6 Ų | 131.6 | 70% | 0.701 | 76% | 0.763 | S | S | * | * | trans | -58.7 | 132 | 169.3 | -88 | -52.9 | 0 | 0 | 0 | 112.4 | Y100 | D98-Y100 HydrophobicContact CB-CE1 4.37Å; D98-Y100 HydrophobicContact CB-CE2 3.95Å; D98-Y100 PolarHBondContact OD2-OH 3.28Å | ||
| 99 | S | 33.7 | Very low | 37.3 | Very low | 114 Ų | 114 | 134 Ų | 134 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | trans | -153 | 82.5 | 162.2 | -178.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 100 | Y | 39.2 | Very low | 37.3 | Very low | 184 Ų | 184 | 135.1 Ų | 135.1 | 72% | 0.722 | 76% | 0.76 | S | S | * | * | trans | -45.5 | 138.6 | 176.5 | -34.8 | -91.5 | 0 | 0 | 0 | 115.6 | D98 | D98-Y100 HydrophobicContact CB-CE1 4.37Å; D98-Y100 HydrophobicContact CB-CE2 3.95Å; D98-Y100 PolarHBondContact OD2-OH 3.28Å | ||
| 101 | R | 42.4 | Very low | 37.2 | Very low | 213 Ų | 213 | 134.1 Ų | 134.1 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | 145.5 | 115.5 | 152 | -82.5 | -64.8 | -158.1 | -169.5 | 6.8 | 108.3 | ||||
| 102 | E | 33.6 | Very low | 38 | Very low | 156 Ų | 156 | 131.8 Ų | 131.8 | 73% | 0.729 | 76% | 0.759 | S | S | * | * | cis | 101 | 124.2 | 37 | -177.6 | -177.2 | 171.4 | 0 | 0 | 112.9 | ||||
| 103 | G | 34.6 | Very low | 38.4 | Very low | 66 Ų | 66 | 132 Ų | 132 | 68% | 0.68 | 76% | 0.76 | S | S | * | * | trans | 101.5 | 109.4 | 161 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 104 | P | 53.1 | Low | 38.5 | Very low | 126 Ų | 126 | 131.9 Ų | 131.9 | 82% | 0.818 | 76% | 0.764 | S | S | * | * | trans | -90.6 | 164.9 | 165.3 | 37.3 | -34.1 | 0 | 0 | 0 | 112.3 | ||||
| 105 | P | 43.9 | Very low | 38.3 | Very low | 131 Ų | 131 | 131.2 Ų | 131.2 | 85% | 0.851 | 76% | 0.764 | S | S | * | * | trans | -130.8 | 174.4 | 134.9 | 37.8 | -28.7 | 0 | 0 | 0 | 112.7 | ||||
| 106 | A | 33.6 | Very low | 38.2 | Very low | 82 Ų | 82 | 131.5 Ų | 131.5 | 68% | 0.678 | 77% | 0.765 | S | S | * | * | trans | -136 | -179.5 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 107 | F | 33.9 | Very low | 38.2 | Very low | 199 Ų | 199 | 131.8 Ų | 131.8 | 87% | 0.873 | 77% | 0.767 | S | S | * | * | trans | 82 | 149.3 | 169.4 | -70.1 | -84.7 | 0 | 0 | 0 | 120.1 | ||||
| 108 | S | 31.7 | Very low | 38.2 | Very low | 108 Ų | 108 | 132 Ų | 132 | 76% | 0.755 | 77% | 0.767 | S | S | * | * | trans | 75.5 | 140.5 | 157.5 | -65.3 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 109 | H | 31.4 | Very low | 37.7 | Very low | 163 Ų | 163 | 132.4 Ų | 132.4 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | cis | -161.2 | 159.8 | -5.5 | -149 | -143.5 | 0 | 0 | 0 | 111.9 | ||||
| 110 | L | 31.6 | Very low | 37.9 | Very low | 137 Ų | 137 | 134.7 Ų | 134.7 | 72% | 0.717 | 77% | 0.772 | S | S | * | * | trans | 24.7 | 122.8 | 155.4 | -67.3 | -179.9 | 0 | 0 | 0 | 123.5 | ||||
| 111 | A | 34 | Very low | 37.5 | Very low | 88 Ų | 88 | 129 Ų | 129 | 73% | 0.727 | 77% | 0.769 | S | S | * | * | 60.6 | 153.3 | 113.4 | 0 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 112 | P | 56.3 | Low | 37 | Very low | 119 Ų | 119 | 124.4 Ų | 124.4 | 77% | 0.773 | 77% | 0.77 | S | S | * | * | trans | -94.9 | -178.6 | -171.5 | 40.5 | -38.3 | 0 | 0 | 0 | 114.5 | ||||
| 113 | P | 46.5 | Very low | 37.2 | Very low | 126 Ų | 126 | 122.8 Ų | 122.8 | 82% | 0.818 | 77% | 0.77 | S | S | * | * | -145 | 178.5 | 109.1 | 40.3 | -26.3 | 0 | 0 | 0 | 116.7 | |||||
| 114 | S | 34.8 | Very low | 37.4 | Very low | 107 Ų | 107 | 125.7 Ų | 125.7 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | trans | -77.2 | 162.9 | -176.2 | 55.9 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 115 | S | 32 | Very low | 37.2 | Very low | 120 Ų | 120 | 125.1 Ų | 125.1 | 84% | 0.839 | 77% | 0.772 | S | S | * | * | trans | -168.4 | 140.1 | 130.1 | 49.6 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 116 | H | 38.4 | Very low | 37 | Very low | 168 Ų | 168 | 127 Ų | 127 | 78% | 0.778 | 77% | 0.773 | S | S | * | * | trans | -110.6 | 159.3 | 157.7 | 46.5 | -112.5 | 0 | 0 | 0 | 107.8 | ||||
| 117 | P | 46.9 | Very low | 37.1 | Very low | 114 Ų | 114 | 131.4 Ų | 131.4 | 74% | 0.74 | 78% | 0.78 | S | S | * | * | -158 | -155.4 | 88.7 | 38.8 | -15.3 | 0 | 0 | 0 | 114.7 | |||||
| 118 | C | 31.5 | Very low | 37 | Very low | 120 Ų | 120 | 126.2 Ų | 126.2 | 81% | 0.811 | 77% | 0.774 | S | S | * | * | trans | 103.6 | 74.7 | 161.2 | -64.3 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 119 | D | 29 | Very low | 37.2 | Very low | 140 Ų | 140 | 127 Ų | 127 | 75% | 0.749 | 78% | 0.778 | S | S | * | * | trans | -39 | 151.3 | 145.2 | 178.5 | 30 | 0 | 0 | 0 | 116.8 | ||||
| 120 | L | 36.8 | Very low | 37.9 | Very low | 162 Ų | 162 | 126.9 Ų | 126.9 | 85% | 0.848 | 78% | 0.782 | S | S | * | * | 161.3 | 125 | 128.7 | -87.8 | 167.1 | 0 | 0 | 0 | 116 | |||||
| 121 | G | 30.6 | Very low | 38.1 | Very low | 64 Ų | 64 | 127 Ų | 127 | 66% | 0.66 | 79% | 0.789 | S | S | * | * | 112.9 | 129.9 | 128.1 | 0 | 0 | 0 | 0 | 0 | 121.7 | |||||
| 122 | S | 32.9 | Very low | 38.6 | Very low | 117 Ų | 117 | 128.9 Ų | 128.9 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | 70.7 | 143.9 | 155.5 | -60.9 | 0 | 0 | 0 | 0 | 119 | ||||
| 123 | T | 37.3 | Very low | 37.8 | Very low | 121 Ų | 121 | 127.7 Ų | 127.7 | 74% | 0.742 | 79% | 0.794 | S | S | * | * | cis | -174.1 | 156.3 | -11 | 28.8 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 124 | T | 39.9 | Very low | 37.4 | Very low | 127 Ų | 127 | 127 Ų | 127 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | cis | -160.2 | 160.2 | 0.3 | 8.9 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 125 | P | 47.7 | Very low | 37.9 | Very low | 115 Ų | 115 | 127.8 Ų | 127.8 | 75% | 0.747 | 79% | 0.787 | S | S | * | * | trans | -107.6 | 144.3 | -173.8 | 38.2 | -30.8 | 0 | 0 | 0 | 116.1 | ||||
| 126 | L | 40.7 | Very low | 38.2 | Very low | 169 Ų | 169 | 130.3 Ų | 130.3 | 89% | 0.885 | 79% | 0.79 | S | S | * | * | trans | -149.4 | 137.3 | 152.6 | -68.8 | 178.6 | 0 | 0 | 0 | 106.5 | ||||
| 127 | E | 35.3 | Very low | 38.5 | Very low | 176 Ų | 176 | 129.3 Ų | 129.3 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | cis | 79.4 | 134.2 | 39.5 | -86.9 | -62.2 | 168.7 | 0 | 0 | 117 | ||||
| 128 | A | 31.3 | Very low | 38.7 | Very low | 90 Ų | 90 | 131.5 Ų | 131.5 | 74% | 0.744 | 79% | 0.791 | S | S | * | * | trans | 57.3 | 144.4 | -169 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 129 | C | 35.2 | Very low | 39.3 | Very low | 124 Ų | 124 | 133.2 Ų | 133.2 | 84% | 0.838 | 79% | 0.792 | S | S | * | * | cis | -135 | 143.8 | 9.5 | 46.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 130 | L | 46.3 | Very low | 40.2 | Very low | 161 Ų | 161 | 133.8 Ų | 133.8 | 84% | 0.843 | 80% | 0.795 | S | S | * | * | trans | -98.6 | 165.6 | 167.4 | -73.2 | 169.5 | 0 | 0 | 0 | 110.4 | ||||
| 131 | T | 37.2 | Very low | 40.5 | Very low | 139 Ų | 139 | 133 Ų | 133 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | trans | 64.9 | 159.4 | 170.9 | 40.5 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 132 | P | 44.5 | Very low | 41.3 | Very low | 127 Ų | 127 | 134.7 Ų | 134.7 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | cis | -120.1 | -179.1 | 3.9 | 38.9 | -23.7 | 0 | 0 | 0 | 115.4 | ||||
| 133 | A | 39.6 | Very low | 41.5 | Very low | 94 Ų | 94 | 138 Ų | 138 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | trans | -79.6 | 161.8 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 134 | S | 36.5 | Very low | 41.4 | Very low | 112 Ų | 112 | 137.1 Ų | 137.1 | 78% | 0.783 | 79% | 0.788 | S | S | * | * | trans | -156.9 | 125.5 | 143.5 | -104.6 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 135 | L | 46.3 | Very low | 41 | Very low | 123 Ų | 123 | 136.6 Ų | 136.6 | 64% | 0.644 | 78% | 0.784 | S | S | * | * | 78.3 | 91.4 | 87.5 | -162.2 | 79 | 0 | 0 | 0 | 110.9 | E137 | L135-E137 HydrophobicContact CD1-CG 4.32Å; L135-E137 VanDerWaalsContact CD2-CD 3.44Å; L135-E137 HydrophobicContact CD2-CG 3.61Å; L135-E137 HydrophobicContact CG-CG 3.59Å | |||
| 136 | L | 38.6 | Very low | 40.4 | Very low | 174 Ų | 174 | 136.7 Ų | 136.7 | 91% | 0.911 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 116.1 | 155.4 | -81.9 | 170.3 | 0 | 0 | 0 | 106.1 | ||
| 137 | E | 44.3 | Very low | 40.1 | Very low | 147 Ų | 147 | 137.7 Ų | 137.7 | 69% | 0.687 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -96.5 | 134.4 | 169.6 | -54.9 | -172.6 | 97.1 | 0 | 0 | 107.5 | L135 D139 | L135-E137 HydrophobicContact CD1-CG 4.32Å; L135-E137 VanDerWaalsContact CD2-CD 3.44Å; L135-E137 HydrophobicContact CD2-CG 3.61Å; L135-E137 HydrophobicContact CG-CG 3.59Å; E137-D139 PolarHBondContact O-N 3.34Å |
| 138 | D | 51 | Low | 39.9 | Very low | 159 Ų | 159 | 134.1 Ų | 134.1 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 116.2 | 173.2 | -53.1 | -86.8 | 0 | 0 | 0 | 108.9 | ||
| 139 | D | 45.1 | Very low | 39.9 | Very low | 156 Ų | 156 | 138.6 Ų | 138.6 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | -129.4 | 69.6 | 179.3 | -139.4 | -66.8 | 0 | 0 | 0 | 110.1 | E137 | E137-D139 PolarHBondContact O-N 3.34Š| ||
| 140 | D | 48.3 | Very low | 40.1 | Very low | 152 Ų | 152 | 141.4 Ų | 141.4 | 81% | 0.813 | 80% | 0.797 | S | S | * | * | trans | -75.8 | 107.1 | 159.7 | -72.5 | -63.9 | 0 | 0 | 0 | 108.6 | ||||
| 141 | D | 42.9 | Very low | 39.6 | Very low | 147 Ų | 147 | 138.8 Ų | 138.8 | 79% | 0.786 | 79% | 0.789 | S | S | * | * | trans | -174.9 | 156.4 | 132 | -120.9 | -36.9 | 0 | 0 | 0 | 118.4 | ||||
| 142 | T | 46.6 | Very low | 39.2 | Very low | 98 Ų | 98 | 138.5 Ų | 138.5 | 60% | 0.601 | 79% | 0.788 | S | S | * | * | trans | 80 | 137.1 | 156 | 3.6 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 143 | F | 36.8 | Very low | 38.9 | Very low | 187 Ų | 187 | 137 Ų | 137 | 82% | 0.82 | 79% | 0.786 | S | S | * | * | trans | 76.3 | 128.8 | 161.9 | -61.1 | -64.1 | 0 | 0 | 0 | 118.8 | ||||
| 144 | C | 34.4 | Very low | 39.2 | Very low | 103 Ų | 103 | 138.3 Ų | 138.3 | 70% | 0.696 | 79% | 0.786 | S | S | * | * | cis | -153.5 | 124.2 | -0.3 | -159.8 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 145 | T | 33.3 | Very low | 38.9 | Very low | 115 Ų | 115 | 139.4 Ų | 139.4 | 71% | 0.706 | 79% | 0.789 | S | S | * | * | trans | 36.4 | 119.8 | 139.8 | -44.3 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 146 | S | 34.1 | Very low | 38.6 | Very low | 118 Ų | 118 | 142.9 Ų | 142.9 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | trans | -173.1 | 86.5 | 133.8 | -80 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 147 | Q | 34.7 | Very low | 38.3 | Very low | 189 Ų | 189 | 142.5 Ų | 142.5 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | 63.6 | 99.5 | 92.6 | -166.3 | -171.1 | 110.7 | 0 | 0 | 116 | |||||
| 148 | A | 30.3 | Very low | 38.2 | Very low | 101 Ų | 101 | 140.6 Ų | 140.6 | 84% | 0.835 | 80% | 0.799 | S | S | * | * | trans | -157.3 | 144.5 | 148.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 149 | M | 32.4 | Very low | 37.6 | Very low | 184 Ų | 184 | 138.7 Ų | 138.7 | 91% | 0.906 | 80% | 0.796 | S | S | * | * | trans | -76.2 | 144.4 | -174.2 | -70.1 | 148.1 | 66.9 | 0 | 0 | 113.4 | ||||
| 150 | Q | 38.3 | Very low | 37.3 | Very low | 184 Ų | 184 | 136.2 Ų | 136.2 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | trans | -98.1 | 159.5 | 144.7 | -74.4 | -158.1 | -2.9 | 0 | 0 | 109.8 | ||||
| 151 | P | 35.5 | Very low | 37.2 | Very low | 105 Ų | 105 | 135.9 Ų | 135.9 | 68% | 0.682 | 79% | 0.792 | S | S | * | * | -139.7 | 154.5 | 114.5 | 37.8 | -27.4 | 0 | 0 | 0 | 115.3 | |||||
| 152 | T | 29.5 | Very low | 37.1 | Very low | 133 Ų | 133 | 135.8 Ų | 135.8 | 82% | 0.816 | 79% | 0.791 | S | S | * | * | trans | 62 | 123 | 153 | 51.4 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 153 | A | 38.9 | Very low | 37.2 | Very low | 95 Ų | 95 | 135.4 Ų | 135.4 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | -126.9 | 173.9 | 150.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 154 | P | 44.8 | Very low | 37.8 | Very low | 122 Ų | 122 | 132.5 Ų | 132.5 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | cis | -125.4 | 153.6 | -32.3 | 34.5 | -21 | 0 | 0 | 0 | 112.2 | ||||
| 155 | T | 31.8 | Very low | 38.6 | Very low | 135 Ų | 135 | 135.9 Ų | 135.9 | 83% | 0.828 | 80% | 0.797 | S | S | * | * | trans | -127.5 | 95.4 | 172.2 | -52.2 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 156 | K | 39.9 | Very low | 39.8 | Very low | 196 Ų | 196 | 136.3 Ų | 136.3 | 85% | 0.852 | 79% | 0.79 | S | S | * | * | trans | -6.3 | 116.3 | 150.3 | -178.9 | -177.6 | -179.4 | 179.2 | 0 | 116.1 | ||||
| 157 | L | 31.6 | Very low | 41.1 | Very low | 167 Ų | 167 | 136.3 Ų | 136.3 | 87% | 0.874 | 78% | 0.78 | S | S | * | * | trans | -122.4 | 153.7 | 160.6 | -71.8 | 176.2 | 0 | 0 | 0 | 110.5 | ||||
| 158 | S | 42.6 | Very low | 43 | Very low | 106 Ų | 106 | 132.6 Ų | 132.6 | 74% | 0.741 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 154.8 | -172.7 | -54.6 | 0 | 0 | 0 | 0 | 113.1 | ||
| 159 | P | 37.8 | Very low | 45.1 | Very low | 120 Ų | 120 | 136.1 Ų | 136.1 | 78% | 0.779 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 134.4 | 171.3 | 29.8 | -34.3 | 0 | 0 | 0 | 111 | ||
| 160 | P | 39.7 | Very low | 47.1 | Very low | 104 Ų | 104 | 129.8 Ų | 129.8 | 68% | 0.675 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -78.5 | 132.7 | 163.2 | 31.8 | -30.9 | 0 | 0 | 0 | 109.8 | L162 | P160-L162 PolarHBondContact O-N 3.25Š|
| 161 | T | 45.1 | Very low | 48.9 | Very low | 145 Ų | 145 | 124 Ų | 124 | 89% | 0.89 | 73% | 0.726 | S | S | * | * | trans | -68.5 | 112.6 | 168.5 | -52.3 | 0 | 0 | 0 | 0 | 109 | ||||
| 162 | L | 41.5 | Very low | 51 | Low | 145 Ų | 145 | 120.9 Ų | 120.9 | 76% | 0.759 | 71% | 0.708 | S | S | * | * | trans | -119.9 | 157.3 | 169 | -69.6 | 175.5 | 0 | 0 | 0 | 110 | P160 | P160-L162 PolarHBondContact O-N 3.25Š| ||
| 163 | S | 47.5 | Very low | 53.5 | Low | 90 Ų | 90 | 119.4 Ų | 119.4 | 63% | 0.629 | 70% | 0.695 | S | S | * | * | trans | -59.5 | 157.8 | -176.1 | 42.2 | 0 | 0 | 0 | 0 | 112.8 | E165 | S163-E165 VanDerWaalsContact C-N 3.29Å; S163-E165 PolarHBondContact O-N 3.45Å | ||
| 164 | P | 49.8 | Very low | 55.4 | Low | 125 Ų | 125 | 118 Ų | 118 | 81% | 0.812 | 68% | 0.675 | S | S | * | * | trans | -63.6 | 95.9 | 159.7 | 29.5 | -33 | 0 | 0 | 0 | 108.3 | K166 | P164-K166 PolarHBondContact O-N 3.05Å; P164-K166 VanDerWaalsContact O-N 3.08Å | ||
| 165 | E | 51.8 | Low | 57.1 | Low | 174 Ų | 174 | 118.1 Ų | 118.1 | 81% | 0.813 | 66% | 0.664 | S | S | * | * | trans | -59.3 | 110.6 | 156.1 | -68.9 | -169.2 | 117.6 | 0 | 0 | 106 | S163 D167 | S163-E165 VanDerWaalsContact C-N 3.29Å; S163-E165 PolarHBondContact O-N 3.45Å; E165-D167 PolarHBondContact O-N 2.87Å; E165-D167 VanDerWaalsContact O-N 3.08Å | ||
| 166 | K | 58.6 | Low | 59.4 | Low | 125 Ų | 125 | 116.8 Ų | 116.8 | 54% | 0.543 | 65% | 0.651 | S | S | . | * | trans | -55.6 | 117.8 | 165.6 | -83.4 | -172.6 | 170.8 | -173.2 | 0 | 106 | P164 D174 | P164-K166 PolarHBondContact O-N 3.05Å; P164-K166 VanDerWaalsContact O-N 3.08Å; K166-D174 WeakPolarHBondContact CD-OD2 3.49Å; K166-D174 IonicContact NZ-OD1 3.71Å; K166-D174 PolarHBondContact NZ-OD1 2.91Å; K166-D174 IonicContact NZ-OD2 3.69Å; K166-D174 PolarHBondContact NZ-OD2 3.47Å | ||
| 167 | D | 62 | Low | 60.8 | Low | 118 Ų | 118 | 113.5 Ų | 113.5 | 63% | 0.631 | 64% | 0.639 | S | S | * | * | trans | -46.8 | 149.2 | 175.4 | -70.1 | -81.6 | 0 | 0 | 0 | 110 | E165 F169 S170 S171 | E165-D167 PolarHBondContact O-N 2.87Å; E165-D167 VanDerWaalsContact O-N 3.08Å; D167-F169 CarbonylContact O-C 3.57Å; D167-F169 PolarHBondContact O-N 2.83Å; D167-S170 WeakPolarHBondContact O-CA 3.4Å; D167-S170 WeakPolarHBondContact O-CB 3.44Å; D167-S170 PolarHBondContact O-N 2.72Å; D167-S171 PolarHBondContact O-N 3.01Å | ||
| 168 | S | 74 | Confident | 62.6 | Low | 110 Ų | 110 | 114 Ų | 114 | 77% | 0.769 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -50.2 | -30.5 | 177.6 | -174.1 | 0 | 0 | 0 | 0 | 112.3 | A172 | S168-A172 WeakPolarHBondContact O-CB 3.41Å; S168-A172 PolarHBondContact O-N 2.87Å; S168-A172 VanDerWaalsContact O-N 3.1Å |
| 169 | F | 73 | Confident | 63.7 | Low | 176 Ų | 176 | 115.4 Ų | 115.4 | 77% | 0.772 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -69.1 | -40 | 173.4 | -142.6 | -85.9 | 0 | 0 | 0 | 114.3 | D167 L173 | D167-F169 CarbonylContact O-C 3.57Å; D167-F169 PolarHBondContact O-N 2.83Å; F169-L173 PolarHBondContact O-N 3.3Å; F169-L173 VanDerWaalsContact O-N 3.15Å |
| 170 | S | 76.1 | Confident | 64.4 | Low | 51 Ų | 51 | 113.1 Ų | 113.1 | 36% | 0.357 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -68.6 | -45.4 | 175.7 | -63.9 | 0 | 0 | 0 | 0 | 110.8 | D167 A172 L173 D174 | D167-S170 WeakPolarHBondContact O-CA 3.4Å; D167-S170 WeakPolarHBondContact O-CB 3.44Å; D167-S170 PolarHBondContact O-N 2.72Å; S170-A172 VanDerWaalsContact C-N 3.29Å; S170-A172 PolarHBondContact O-N 3.41Å; S170-L173 WeakPolarHBondContact O-CA 3.42Å; S170-L173 VanDerWaalsContact O-CB 3.31Å; S170-L173 WeakPolarHBondContact O-CB 3.31Å; S170-L173 PolarHBondContact O-N 2.85Å; S170-D174 PolarHBondContact O-N 2.96Å |
| 171 | S | 76.3 | Confident | 64.7 | Low | 63 Ų | 63 | 114 Ų | 114 | 44% | 0.441 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -62.8 | -35.1 | 177.8 | -168.6 | 0 | 0 | 0 | 0 | 112.7 | D167 L173 E175 | D167-S171 PolarHBondContact O-N 3.01Å; S171-L173 VanDerWaalsContact C-N 3.31Å; S171-E175 PolarHBondContact O-N 3.44Å |
| 172 | A | 79.1 | Confident | 64.6 | Low | 38 Ų | 38 | 112.6 Ų | 112.6 | 31% | 0.314 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -71.2 | -25.8 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | S168 S170 I176 | S168-A172 WeakPolarHBondContact O-CB 3.41Å; S168-A172 PolarHBondContact O-N 2.87Å; S168-A172 VanDerWaalsContact O-N 3.1Å; S170-A172 VanDerWaalsContact C-N 3.29Å; S170-A172 PolarHBondContact O-N 3.41Å; A172-I176 WeakPolarHBondContact O-CD1 3.42Å; A172-I176 WeakPolarHBondContact O-CG1 3.38Å; A172-I176 PolarHBondContact O-N 2.9Å; A172-I176 VanDerWaalsContact O-N 3.09Å |
| 173 | L | 82.8 | Confident | 64.6 | Low | 102 Ų | 102 | 110.9 Ų | 110.9 | 53% | 0.534 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -72.8 | -44.5 | 175.4 | -138.5 | 172.7 | 0 | 0 | 0 | 110.7 | F169 S170 S171 E175 I176 E177 | F169-L173 PolarHBondContact O-N 3.3Å; F169-L173 VanDerWaalsContact O-N 3.15Å; S170-L173 WeakPolarHBondContact O-CA 3.42Å; S170-L173 VanDerWaalsContact O-CB 3.31Å; S170-L173 WeakPolarHBondContact O-CB 3.31Å; S170-L173 PolarHBondContact O-N 2.85Å; S171-L173 VanDerWaalsContact C-N 3.31Å; L173-E175 VanDerWaalsContact C-N 3.3Å; L173-E175 PolarHBondContact O-N 3.4Å; L173-I176 PolarHBondContact O-N 3.43Å; L173-E177 PolarHBondContact O-N 3.33Å |
| 174 | D | 78.5 | Confident | 64.4 | Low | 67 Ų | 67 | 112.8 Ų | 112.8 | 36% | 0.358 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -55.4 | -45.1 | 171 | -64.9 | -83.6 | 0 | 0 | 0 | 111.3 | K166 S170 I176 E177 E178 | K166-D174 WeakPolarHBondContact CD-OD2 3.49Å; K166-D174 IonicContact NZ-OD1 3.71Å; K166-D174 PolarHBondContact NZ-OD1 2.91Å; K166-D174 IonicContact NZ-OD2 3.69Å; K166-D174 PolarHBondContact NZ-OD2 3.47Å; S170-D174 PolarHBondContact O-N 2.96Å; D174-I176 PolarHBondContact O-N 2.75Å; D174-E177 PolarHBondContact O-N 2.93Å; D174-E178 PolarHBondContact O-N 3.46Å |
| 175 | E | 79.5 | Confident | 63.9 | Low | 123 Ų | 123 | 112.5 Ų | 112.5 | 58% | 0.575 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -63.2 | -38.6 | 179.1 | -173.1 | 179.4 | 173.3 | 0 | 0 | 112.6 | S171 L173 L179 | S171-E175 PolarHBondContact O-N 3.44Å; L173-E175 VanDerWaalsContact C-N 3.3Å; L173-E175 PolarHBondContact O-N 3.4Å; E175-L179 HydrophobicContact CG-CD1 4.48Å; E175-L179 VanDerWaalsContact O-CG 3.28Å; E175-L179 WeakPolarHBondContact O-CG 3.23Å; E175-L179 PolarHBondContact O-N 2.89Å |
| 176 | I | 79.4 | Confident | 63.3 | Low | 108 Ų | 108 | 109.3 Ų | 109.3 | 55% | 0.554 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -71.7 | -33.9 | 176.5 | -69.2 | 164 | 0 | 0 | 0 | 111.6 | A172 L173 D174 C180 | A172-I176 WeakPolarHBondContact O-CD1 3.42Å; A172-I176 WeakPolarHBondContact O-CG1 3.38Å; A172-I176 PolarHBondContact O-N 2.9Å; A172-I176 VanDerWaalsContact O-N 3.09Å; L173-I176 PolarHBondContact O-N 3.43Å; D174-I176 PolarHBondContact O-N 2.75Å; I176-C180 PolarHBondContact O-N 3Å; I176-C180 PolarHBondContact O-SG 2.87Å |
| 177 | E | 71.1 | Confident | 62.5 | Low | 127 Ų | 127 | 112.4 Ų | 112.4 | 59% | 0.593 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -70.6 | -40.7 | 176.6 | -169.6 | 166.3 | -162.5 | 0 | 0 | 111.7 | L173 D174 L179 C180 | L173-E177 PolarHBondContact O-N 3.33Å; D174-E177 PolarHBondContact O-N 2.93Å; E177-L179 VanDerWaalsContact C-N 3.31Å; E177-L179 PolarHBondContact O-N 3.29Å; E177-C180 WeakPolarHBondContact O-CB 3.34Å; E177-C180 PolarHBondContact O-N 2.78Å; E177-C180 VanDerWaalsContact O-N 3.16Å |
| 178 | E | 68.2 | Low | 61.2 | Low | 176 Ų | 176 | 111.6 Ų | 111.6 | 82% | 0.822 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -65.4 | -31.3 | 175.2 | -170.8 | 173.1 | -171.6 | 0 | 0 | 112.9 | D174 C180 | D174-E178 PolarHBondContact O-N 3.46Å; E178-C180 VanDerWaalsContact C-N 3.29Å; E178-C180 PolarHBondContact O-N 3.32Å |
| 179 | L | 65.3 | Low | 59.5 | Low | 136 Ų | 136 | 111.3 Ų | 111.3 | 71% | 0.712 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | -12.6 | 175.3 | -71.2 | 171.6 | 0 | 0 | 0 | 113.9 | E175 E177 P181 | E175-L179 HydrophobicContact CG-CD1 4.48Å; E175-L179 VanDerWaalsContact O-CG 3.28Å; E175-L179 WeakPolarHBondContact O-CG 3.23Å; E175-L179 PolarHBondContact O-N 2.89Å; E177-L179 VanDerWaalsContact C-N 3.31Å; E177-L179 PolarHBondContact O-N 3.29Å; L179-P181 WeakPolarHBondContact O-CD 3.32Å |
| 180 | C | 52.7 | Low | 57.7 | Low | 72 Ų | 72 | 107.2 Ų | 107.2 | 49% | 0.486 | 65% | 0.649 | S | S | . | * | S | Bend | trans | -85.8 | 118 | 173.4 | -69.1 | 0 | 0 | 0 | 0 | 110 | I176 E177 E178 T182 | I176-C180 PolarHBondContact O-N 3Å; I176-C180 PolarHBondContact O-SG 2.87Å; E177-C180 WeakPolarHBondContact O-CB 3.34Å; E177-C180 PolarHBondContact O-N 2.78Å; E177-C180 VanDerWaalsContact O-N 3.16Å; E178-C180 VanDerWaalsContact C-N 3.29Å; E178-C180 PolarHBondContact O-N 3.32Å; C180-T182 VanDerWaalsContact C-N 3.33Å; C180-T182 PolarHBondContact O-N 2.74Å |
| 181 | P | 46.4 | Very low | 55.8 | Low | 123 Ų | 123 | 109.8 Ų | 109.8 | 80% | 0.799 | 67% | 0.673 | S | S | * | * | trans | -68.6 | 92.2 | 176 | 28.2 | -33.9 | 0 | 0 | 0 | 110 | L179 S183 | L179-P181 WeakPolarHBondContact O-CD 3.32Å; P181-S183 PolarHBondContact O-N 3.23Å | ||
| 182 | T | 42.7 | Very low | 54.1 | Low | 116 Ų | 116 | 111.4 Ų | 111.4 | 71% | 0.712 | 69% | 0.691 | S | S | * | * | trans | -57.9 | 105.8 | 173.2 | -67.7 | 0 | 0 | 0 | 0 | 108.2 | C180 T184 | C180-T182 VanDerWaalsContact C-N 3.33Å; C180-T182 PolarHBondContact O-N 2.74Å; T182-T184 PolarHBondContact O-N 3.43Å | ||
| 183 | S | 42.6 | Very low | 52.2 | Low | 108 Ų | 108 | 116.5 Ų | 116.5 | 76% | 0.755 | 72% | 0.718 | S | S | * | * | trans | -64.4 | 119.7 | 175.6 | -69.5 | 0 | 0 | 0 | 0 | 108.5 | P181 S185 | P181-S183 PolarHBondContact O-N 3.23Å; S183-S185 PolarHBondContact O-N 2.92Å | ||
| 184 | T | 42.7 | Very low | 49.8 | Very low | 130 Ų | 130 | 119 Ų | 119 | 80% | 0.798 | 73% | 0.731 | S | S | * | * | trans | -61.6 | 87.4 | 172.9 | -59 | 0 | 0 | 0 | 0 | 109.8 | T182 T186 | T182-T184 PolarHBondContact O-N 3.43Å; T184-T186 PolarHBondContact O-N 2.96Å; T184-T186 VanDerWaalsContact O-N 3.16Å | ||
| 185 | S | 39.4 | Very low | 48 | Very low | 119 Ų | 119 | 120.5 Ų | 120.5 | 83% | 0.832 | 75% | 0.747 | S | S | * | * | trans | -82 | 87.6 | 168.9 | -175.7 | 0 | 0 | 0 | 0 | 108.2 | S183 | S183-S185 PolarHBondContact O-N 2.92Š| ||
| 186 | T | 38.2 | Very low | 45.8 | Very low | 107 Ų | 107 | 120.6 Ų | 120.6 | 66% | 0.656 | 76% | 0.756 | S | S | * | * | trans | -48.1 | 143.7 | 174.7 | -54.3 | 0 | 0 | 0 | 0 | 112.1 | T184 A188 | T184-T186 PolarHBondContact O-N 2.96Å; T184-T186 VanDerWaalsContact O-N 3.16Å; T186-A188 PolarHBondContact O-N 3.33Å | ||
| 187 | E | 42 | Very low | 43.6 | Very low | 191 Ų | 191 | 125.3 Ų | 125.3 | 89% | 0.893 | 77% | 0.773 | S | S | * | * | trans | -45.2 | 117.3 | 171 | -176.8 | -172.8 | 146.8 | 0 | 0 | 112.9 | ||||
| 188 | A | 34.8 | Very low | 41.6 | Very low | 100 Ų | 100 | 122.2 Ų | 122.2 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | trans | -154.8 | 65 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | T186 | T186-A188 PolarHBondContact O-N 3.33Š| ||
| 189 | A | 38.5 | Very low | 39.9 | Very low | 104 Ų | 104 | 120.4 Ų | 120.4 | 86% | 0.86 | 78% | 0.776 | S | S | * | * | trans | -126.9 | 56.9 | -174.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 190 | A | 35.9 | Very low | 38.4 | Very low | 91 Ų | 91 | 118.3 Ų | 118.3 | 75% | 0.752 | 77% | 0.772 | S | S | * | * | trans | -143.9 | 101.4 | 161.4 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 191 | A | 35.5 | Very low | 37.6 | Very low | 104 Ų | 104 | 119.9 Ų | 119.9 | 86% | 0.86 | 78% | 0.784 | S | S | * | * | 72.9 | 113.4 | 85.9 | 0 | 0 | 0 | 0 | 0 | 112 | |||||
| 192 | A | 41 | Very low | 37.1 | Very low | 98 Ų | 98 | 122.1 Ų | 122.1 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | trans | -84.6 | 143.2 | -175.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 193 | T | 38.5 | Very low | 36.7 | Very low | 145 Ų | 145 | 120.9 Ų | 120.9 | 89% | 0.89 | 79% | 0.786 | S | S | * | * | trans | -157.2 | 153.3 | 144.9 | 12.1 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 194 | D | 33.2 | Very low | 36.2 | Very low | 153 Ų | 153 | 119.8 Ų | 119.8 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | 84.9 | 157.5 | 154 | -141.6 | 5.9 | 0 | 0 | 0 | 120.1 | ||||
| 195 | S | 40.1 | Very low | 35.8 | Very low | 99 Ų | 99 | 117.9 Ų | 117.9 | 69% | 0.692 | 79% | 0.789 | S | S | * | * | trans | -101.9 | 178 | -160 | -50.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 196 | V | 34.7 | Very low | 35.6 | Very low | 125 Ų | 125 | 121.5 Ų | 121.5 | 76% | 0.758 | 79% | 0.793 | S | S | * | * | trans | 144.8 | 107.2 | 130.8 | 168.1 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 197 | K | 32.1 | Very low | 35.3 | Very low | 208 Ų | 208 | 124.9 Ų | 124.9 | 90% | 0.904 | 80% | 0.799 | S | S | * | * | trans | 72.4 | 126.6 | 137.3 | -175.3 | -174.7 | 178.6 | -176.1 | 0 | 121.3 | ||||
| 198 | G | 29.6 | Very low | 34.8 | Very low | 61 Ų | 61 | 122 Ų | 122 | 63% | 0.629 | 79% | 0.789 | S | S | * | * | trans | 142.2 | 108.2 | 163.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 199 | T | 31.7 | Very low | 34.5 | Very low | 138 Ų | 138 | 124.5 Ų | 124.5 | 85% | 0.847 | 79% | 0.788 | S | S | * | * | 63.7 | 123 | 65.7 | -141.9 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 200 | S | 35.4 | Very low | 34.1 | Very low | 92 Ų | 92 | 123 Ų | 123 | 64% | 0.643 | 78% | 0.783 | S | S | * | * | cis | -171.6 | 166 | -4 | 33.6 | 0 | 0 | 0 | 0 | 110 | ||||
| 201 | S | 34.8 | Very low | 34.2 | Very low | 106 Ų | 106 | 124.7 Ų | 124.7 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | trans | 69.6 | 155.3 | 153.8 | -68.5 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 202 | E | 35.8 | Very low | 34.2 | Very low | 169 Ų | 169 | 128.4 Ų | 128.4 | 79% | 0.79 | 79% | 0.785 | S | S | * | * | cis | -148.1 | 133.2 | -12.3 | -99.7 | -103.1 | 117.1 | 0 | 0 | 106.3 | ||||
| 203 | A | 35.3 | Very low | 33.6 | Very low | 90 Ų | 90 | 132.5 Ų | 132.5 | 74% | 0.744 | 79% | 0.788 | S | S | * | * | 68.5 | 127.8 | 104.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | |||||
| 204 | G | 31.8 | Very low | 33.2 | Very low | 86 Ų | 86 | 130.2 Ų | 130.2 | 89% | 0.887 | 78% | 0.777 | S | S | * | * | trans | 175.2 | 80.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 205 | A | 33.5 | Very low | 33.2 | Very low | 90 Ų | 90 | 134.3 Ų | 134.3 | 74% | 0.744 | 78% | 0.781 | S | S | * | * | trans | -116.4 | 139.3 | -169.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 206 | Q | 34.7 | Very low | 32.8 | Very low | 195 Ų | 195 | 134.2 Ų | 134.2 | 91% | 0.911 | 79% | 0.787 | S | S | * | * | trans | 172.6 | 149.8 | 147.6 | -94.4 | 149.9 | 51 | 0 | 0 | 108.6 | ||||
| 207 | K | 32 | Very low | 32.8 | Very low | 178 Ų | 178 | 135.5 Ų | 135.5 | 77% | 0.774 | 79% | 0.79 | S | S | * | * | cis | 142.6 | 129.4 | -22 | -177.6 | -140.4 | -176.4 | -158 | 0 | 108.1 | ||||
| 208 | L | 32 | Very low | 33.2 | Very low | 130 Ų | 130 | 132.7 Ų | 132.7 | 68% | 0.681 | 79% | 0.785 | S | S | * | * | trans | 101.5 | 130.9 | 156.1 | -141.8 | 79.2 | 0 | 0 | 0 | 119 | ||||
| 209 | D | 29 | Very low | 33.6 | Very low | 153 Ų | 153 | 135.7 Ų | 135.7 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | 23.7 | 148.9 | 151 | -69.5 | -125.9 | 0 | 0 | 0 | 124.9 | ||||
| 210 | G | 30.1 | Very low | 33.9 | Very low | 72 Ų | 72 | 137.8 Ų | 137.8 | 74% | 0.742 | 79% | 0.793 | S | S | * | * | trans | 146.3 | 118.6 | 150.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 211 | P | 38.5 | Very low | 34.2 | Very low | 126 Ų | 126 | 139.6 Ų | 139.6 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -95.8 | 141.3 | -178.2 | 35.7 | -33.4 | 0 | 0 | 0 | 114.9 | ||||
| 212 | Q | 33.9 | Very low | 34.4 | Very low | 183 Ų | 183 | 142 Ų | 142 | 86% | 0.855 | 80% | 0.797 | S | S | * | * | trans | 26.1 | 114.2 | 136.2 | -178.9 | -174.4 | -14.4 | 0 | 0 | 119.4 | ||||
| 213 | E | 28.8 | Very low | 34.9 | Very low | 184 Ų | 184 | 140.7 Ų | 140.7 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | -163.9 | 158.8 | 121.3 | -125 | -171.9 | 94.8 | 0 | 0 | 115.5 | |||||
| 214 | S | 30.3 | Very low | 35.3 | Very low | 96 Ų | 96 | 142.2 Ų | 142.2 | 67% | 0.671 | 80% | 0.8 | S | S | * | * | trans | 55.3 | 108.4 | 155.1 | -148 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 215 | R | 33.4 | Very low | 35.7 | Very low | 239 Ų | 239 | 145.3 Ų | 145.3 | 90% | 0.902 | 80% | 0.795 | S | S | * | * | trans | 20.5 | 130.3 | 138.3 | -54.9 | -177.4 | -177.2 | -137.5 | 3 | 120.9 | ||||
| 216 | A | 31.2 | Very low | 36 | Very low | 98 Ų | 98 | 147.7 Ų | 147.7 | 81% | 0.81 | 80% | 0.803 | S | S | * | * | -170.1 | 164.2 | 106.1 | 0 | 0 | 0 | 0 | 0 | 112 | |||||
| 217 | D | 35.5 | Very low | 36.7 | Very low | 152 Ų | 152 | 141.9 Ų | 141.9 | 81% | 0.813 | 80% | 0.796 | S | S | * | * | trans | -73.1 | 172.2 | -163 | -63.4 | -100.5 | 0 | 0 | 0 | 118.9 | ||||
| 218 | D | 39.3 | Very low | 37 | Very low | 149 Ų | 149 | 139.2 Ų | 139.2 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | trans | 66.1 | 99.7 | 156.2 | -97.4 | -54.7 | 0 | 0 | 0 | 120.7 | ||||
| 219 | S | 38.6 | Very low | 37.3 | Very low | 124 Ų | 124 | 142.3 Ų | 142.3 | 87% | 0.867 | 80% | 0.798 | S | S | * | * | trans | -156.7 | 93.2 | 145.5 | -83.1 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 220 | K | 38.2 | Very low | 37.9 | Very low | 181 Ų | 181 | 142.3 Ų | 142.3 | 79% | 0.787 | 79% | 0.793 | S | S | * | * | trans | -26.2 | 145 | 160.3 | 172.9 | -172.3 | 178.3 | -173.6 | 0 | 117.4 | ||||
| 221 | L | 41.3 | Very low | 38.9 | Very low | 131 Ų | 131 | 146.3 Ų | 146.3 | 69% | 0.686 | 80% | 0.796 | S | S | * | * | trans | 68.8 | 153.2 | 173.8 | -76.1 | 160.4 | 0 | 0 | 0 | 114 | ||||
| 222 | M | 39.5 | Very low | 39.3 | Very low | 157 Ų | 157 | 145.7 Ų | 145.7 | 77% | 0.773 | 79% | 0.79 | S | S | * | * | cis | -147.2 | 166.9 | 12.8 | 33 | -90.1 | 135.4 | 0 | 0 | 111.6 | ||||
| 223 | D | 46.2 | Very low | 39.7 | Very low | 141 Ų | 141 | 143.3 Ų | 143.3 | 75% | 0.754 | 79% | 0.788 | S | S | * | * | trans | 34 | 111 | 160.2 | -87.1 | -105.8 | 0 | 0 | 0 | 121.1 | ||||
| 224 | S | 42.7 | Very low | 40.3 | Very low | 121 Ų | 121 | 138.9 Ų | 138.9 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | trans | -153.6 | 141.2 | 139.7 | -79.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 225 | L | 40.9 | Very low | 40.9 | Very low | 151 Ų | 151 | 140.8 Ų | 140.8 | 79% | 0.791 | 79% | 0.785 | S | S | * | * | trans | -74.2 | 148.7 | -168.2 | -74 | 71.3 | 0 | 0 | 0 | 112.5 | G227 | L225-G227 PolarHBondContact O-N 2.91Š| ||
| 226 | P | 40.8 | Very low | 41.8 | Very low | 140 Ų | 140 | 132.6 Ų | 132.6 | 91% | 0.909 | 78% | 0.775 | S | S | * | * | trans | -71.2 | 97.2 | 170.4 | 30 | -33.4 | 0 | 0 | 0 | 110.2 | ||||
| 227 | G | 48.5 | Very low | 42.6 | Very low | 73 Ų | 73 | 137.3 Ų | 137.3 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | trans | -138.5 | 7.4 | -169.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | L225 | L225-G227 PolarHBondContact O-N 2.91Š| ||
| 228 | N | 37.5 | Very low | 43.2 | Very low | 122 Ų | 122 | 136.9 Ų | 136.9 | 65% | 0.652 | 78% | 0.775 | S | S | * | * | trans | -150.3 | 127.8 | 172.1 | -164 | 29.7 | 0 | 0 | 0 | 109.8 | E230 | N228-E230 WeakPolarHBondContact ND2-CG 3.35Å; N228-E230 PolarHBondContact ND2-OE1 3.38Å | ||
| 229 | F | 39.7 | Very low | 43.8 | Very low | 196 Ų | 196 | 136.4 Ų | 136.4 | 86% | 0.86 | 78% | 0.777 | S | S | * | * | trans | -112 | 71.9 | -177.4 | -140 | -76.8 | 0 | 0 | 0 | 110.2 | I231 | F229-I231 HydrophobicContact CD1-CG1 4.18Å; F229-I231 PolarHBondContact O-N 2.98Å | ||
| 230 | E | 40.8 | Very low | 44.5 | Very low | 153 Ų | 153 | 138 Ų | 138 | 72% | 0.715 | 78% | 0.776 | S | S | * | * | trans | -76.1 | 110.4 | 176.3 | -81.1 | 169.7 | 173.9 | 0 | 0 | 110.8 | N228 T232 | N228-E230 WeakPolarHBondContact ND2-CG 3.35Å; N228-E230 PolarHBondContact ND2-OE1 3.38Å; E230-T232 PolarHBondContact O-N 3.22Å | ||
| 231 | I | 52.2 | Low | 44.9 | Very low | 155 Ų | 155 | 135.2 Ų | 135.2 | 80% | 0.795 | 77% | 0.769 | S | S | * | * | trans | -86.7 | 90.6 | -179.2 | -54.9 | 174.7 | 0 | 0 | 0 | 109.1 | F229 | F229-I231 HydrophobicContact CD1-CG1 4.18Å; F229-I231 PolarHBondContact O-N 2.98Å | ||
| 232 | T | 47.1 | Very low | 45.6 | Very low | 113 Ų | 113 | 132.4 Ų | 132.4 | 69% | 0.693 | 76% | 0.758 | S | S | * | * | trans | -142.8 | 129.2 | 170.5 | -6.8 | 0 | 0 | 0 | 0 | 113 | E230 | E230-T232 PolarHBondContact O-N 3.22Š| ||
| 233 | T | 41.9 | Very low | 46.4 | Very low | 133 Ų | 133 | 129.3 Ų | 129.3 | 82% | 0.816 | 74% | 0.744 | S | S | * | * | trans | 69.2 | 146.7 | -179.8 | 84.4 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 234 | S | 40 | Very low | 46.8 | Very low | 92 Ų | 92 | 127.8 Ų | 127.8 | 64% | 0.643 | 74% | 0.736 | S | S | * | * | cis | -142 | 158.4 | 14.2 | -70.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 235 | T | 43.5 | Very low | 47.5 | Very low | 135 Ų | 135 | 127 Ų | 127 | 83% | 0.828 | 72% | 0.722 | S | S | * | * | trans | 57.5 | 135.3 | 155.5 | 48.7 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 236 | G | 53.3 | Low | 48.5 | Very low | 67 Ų | 67 | 124.5 Ų | 124.5 | 69% | 0.691 | 71% | 0.709 | S | S | * | * | cis | 140 | 19.4 | 5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 237 | F | 47.5 | Very low | 49.5 | Very low | 197 Ų | 197 | 123 Ų | 123 | 86% | 0.864 | 69% | 0.692 | S | S | * | * | trans | -138.4 | 6.5 | -168.8 | -83.2 | -78 | 0 | 0 | 0 | 115.7 | ||||
| 238 | L | 47.9 | Very low | 49.8 | Very low | 144 Ų | 144 | 125.4 Ų | 125.4 | 75% | 0.754 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -115.8 | 24.6 | -166.3 | -97.7 | 166.6 | 0 | 0 | 0 | 114.8 | L243 | L238-L243 HydrophobicContact CD2-CD1 4.3Š|
| 239 | T | 51.8 | Low | 50.9 | Low | 138 Ų | 138 | 123.4 Ų | 123.4 | 85% | 0.847 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -125.8 | 3 | -171.7 | 56.9 | 0 | 0 | 0 | 0 | 115.2 | ||
| 240 | D | 52.2 | Low | 51.9 | Low | 158 Ų | 158 | 121 Ų | 121 | 85% | 0.845 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -125.7 | 23.9 | -172.4 | -156.9 | 36 | 0 | 0 | 0 | 113.6 | ||
| 241 | L | 47.8 | Very low | 53.1 | Low | 123 Ų | 123 | 117.9 Ų | 117.9 | 64% | 0.644 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -146.3 | 123 | 153.2 | -164.6 | 56.1 | 0 | 0 | 0 | 106.7 | L243 I246 | L241-L243 PolarHBondContact O-N 2.99Å; L241-I246 HydrophobicContact CD2-CD1 3.52Å; L241-I246 HydrophobicContact CG-CD1 3.75Å |
| 242 | T | 55.9 | Low | 53.3 | Low | 72 Ų | 72 | 116.5 Ų | 116.5 | 44% | 0.442 | 66% | 0.66 | S | S | . | * | trans | -60.9 | 102.9 | -174.3 | 24 | 0 | 0 | 0 | 0 | 110.2 | D244 D245 I246 | T242-D244 PolarHBondContact O-N 3.08Å; T242-D245 WeakPolarHBondContact CB-OD2 3.48Å; T242-D245 PolarHBondContact O-N 2.91Å; T242-D245 PolarHBondContact OG1-OD2 2.87Å; T242-I246 PolarHBondContact O-N 3.36Å | ||
| 243 | L | 55.6 | Low | 54 | Low | 91 Ų | 91 | 116.1 Ų | 116.1 | 48% | 0.476 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -59.4 | -29.8 | 174.1 | -76.9 | 173.8 | 0 | 0 | 0 | 110.9 | L238 L241 I246 L247 | L238-L243 HydrophobicContact CD2-CD1 4.3Å; L241-L243 PolarHBondContact O-N 2.99Å; L243-I246 PolarHBondContact O-N 3.47Å; L243-L247 HydrophobicContact CB-CD1 4.32Å; L243-L247 WeakPolarHBondContact O-CB 3.29Å; L243-L247 VanDerWaalsContact O-CG 3.23Å; L243-L247 WeakPolarHBondContact O-CG 3.47Å; L243-L247 PolarHBondContact O-N 3.45Å |
| 244 | D | 55.8 | Low | 54.9 | Low | 109 Ų | 109 | 114 Ų | 114 | 58% | 0.583 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -62.8 | -42.3 | 172.4 | -53.3 | -83.3 | 0 | 0 | 0 | 112.4 | T242 F248 | T242-D244 PolarHBondContact O-N 3.08Å; D244-F248 HydrophobicContact CB-CD2 4.45Å; D244-F248 VanDerWaalsContact O-CB 3.22Å; D244-F248 WeakPolarHBondContact O-CB 3.3Å; D244-F248 VanDerWaalsContact O-CD2 3.26Å; D244-F248 WeakPolarHBondContact O-CD2 3.46Å; D244-F248 PolarHBondContact O-N 2.89Å |
| 245 | D | 57.6 | Low | 55.7 | Low | 104 Ų | 104 | 117.1 Ų | 117.1 | 56% | 0.556 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -68.8 | -38.6 | 177.6 | -70.7 | -42.5 | 0 | 0 | 0 | 111.7 | T242 A249 | T242-D245 WeakPolarHBondContact CB-OD2 3.48Å; T242-D245 PolarHBondContact O-N 2.91Å; T242-D245 PolarHBondContact OG1-OD2 2.87Å; D245-A249 WeakPolarHBondContact O-CB 3.37Å; D245-A249 PolarHBondContact O-N 3.08Å; D245-A249 VanDerWaalsContact O-N 3.13Å |
| 246 | I | 62.1 | Low | 56.1 | Low | 100 Ų | 100 | 119.3 Ų | 119.3 | 51% | 0.513 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -79.3 | -29.1 | -178.5 | -66.7 | 179.7 | 0 | 0 | 0 | 112.9 | L241 T242 L243 | L241-I246 HydrophobicContact CD2-CD1 3.52Å; L241-I246 HydrophobicContact CG-CD1 3.75Å; T242-I246 PolarHBondContact O-N 3.36Å; L243-I246 PolarHBondContact O-N 3.47Å |
| 247 | L | 61.5 | Low | 55.6 | Low | 107 Ų | 107 | 122.4 Ų | 122.4 | 56% | 0.56 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -94.6 | -14.8 | -179.5 | -61.9 | 173.2 | 0 | 0 | 0 | 113.6 | L243 I251 | L243-L247 HydrophobicContact CB-CD1 4.32Å; L243-L247 WeakPolarHBondContact O-CB 3.29Å; L243-L247 VanDerWaalsContact O-CG 3.23Å; L243-L247 WeakPolarHBondContact O-CG 3.47Å; L243-L247 PolarHBondContact O-N 3.45Å; L247-I251 WeakPolarHBondContact O-CD1 3.42Å |
| 248 | F | 53.6 | Low | 55.6 | Low | 125 Ų | 125 | 121.3 Ų | 121.3 | 55% | 0.548 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -123 | -12.3 | -176.5 | -58.4 | -109.4 | 0 | 0 | 0 | 115.1 | D244 D250 I251 | D244-F248 HydrophobicContact CB-CD2 4.45Å; D244-F248 VanDerWaalsContact O-CB 3.22Å; D244-F248 WeakPolarHBondContact O-CB 3.3Å; D244-F248 VanDerWaalsContact O-CD2 3.26Å; D244-F248 WeakPolarHBondContact O-CD2 3.46Å; D244-F248 PolarHBondContact O-N 2.89Å; F248-D250 PolarHBondContact O-N 3.06Å; F248-I251 HydrophobicContact CB-CD1 4.26Å; F248-I251 HydrophobicContact CD1-CD1 3.74Å; F248-I251 HydrophobicContact CE1-CD1 4.4Å; F248-I251 HydrophobicContact CG-CD1 4.11Å; F248-I251 PolarHBondContact O-N 3.47Å; F248-I251 VanDerWaalsContact O-N 3.13Å |
| 249 | A | 62.1 | Low | 55.4 | Low | 80 Ų | 80 | 120 Ų | 120 | 66% | 0.661 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.6 | -28.8 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | D245 I251 | D245-A249 WeakPolarHBondContact O-CB 3.37Å; D245-A249 PolarHBondContact O-N 3.08Å; D245-A249 VanDerWaalsContact O-N 3.13Å; A249-I251 VanDerWaalsContact C-N 3.27Å; A249-I251 PolarHBondContact O-N 2.95Å |
| 250 | D | 59.3 | Low | 55.4 | Low | 145 Ų | 145 | 118.5 Ų | 118.5 | 78% | 0.775 | 63% | 0.631 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.3 | -0 | 177.2 | -68.5 | 6.9 | 0 | 0 | 0 | 112.9 | F248 D252 | F248-D250 PolarHBondContact O-N 3.06Å; D250-D252 PolarHBondContact O-N 3.18Å |
| 251 | I | 66.9 | Low | 55.1 | Low | 88 Ų | 88 | 116.8 Ų | 116.8 | 45% | 0.451 | 63% | 0.63 | S | S | . | * | trans | -94.4 | 97.4 | -177.7 | -58 | -178.9 | 0 | 0 | 0 | 109.8 | L247 F248 A249 T253 | L247-I251 WeakPolarHBondContact O-CD1 3.42Å; F248-I251 HydrophobicContact CB-CD1 4.26Å; F248-I251 HydrophobicContact CD1-CD1 3.74Å; F248-I251 HydrophobicContact CE1-CD1 4.4Å; F248-I251 HydrophobicContact CG-CD1 4.11Å; F248-I251 PolarHBondContact O-N 3.47Å; F248-I251 VanDerWaalsContact O-N 3.13Å; A249-I251 VanDerWaalsContact C-N 3.27Å; A249-I251 PolarHBondContact O-N 2.95Å; I251-T253 HydrophobicContact CG2-CG2 4.08Å; I251-T253 PolarHBondContact O-N 3.04Å | ||
| 252 | D | 56.5 | Low | 54.5 | Low | 125 Ų | 125 | 117.6 Ų | 117.6 | 67% | 0.668 | 64% | 0.641 | S | S | * | * | trans | -62.5 | 73 | 175.1 | -82.5 | -51 | 0 | 0 | 0 | 113.2 | D250 S254 M255 | D250-D252 PolarHBondContact O-N 3.18Å; D252-S254 PolarHBondContact O-N 3.37Å; D252-M255 PolarHBondContact O-N 2.82Å | ||
| 253 | T | 60.6 | Low | 54 | Low | 106 Ų | 106 | 120.2 Ų | 120.2 | 65% | 0.65 | 66% | 0.662 | S | S | * | * | G | 310 helix | trans | -66.9 | -13.8 | 173.2 | 51.3 | 0 | 0 | 0 | 0 | 113.2 | I251 M255 Y256 | I251-T253 HydrophobicContact CG2-CG2 4.08Å; I251-T253 PolarHBondContact O-N 3.04Å; T253-M255 PolarHBondContact O-N 3.4Å; T253-Y256 PolarHBondContact O-N 2.75Å |
| 254 | S | 60.7 | Low | 53.1 | Low | 88 Ų | 88 | 121.2 Ų | 121.2 | 62% | 0.615 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -58 | -23.5 | 173 | 57.1 | 0 | 0 | 0 | 0 | 114.1 | D252 Y256 | D252-S254 PolarHBondContact O-N 3.37Å; S254-Y256 VanDerWaalsContact C-N 3.34Å |
| 255 | M | 56.7 | Low | 52.7 | Low | 157 Ų | 157 | 121.9 Ų | 121.9 | 77% | 0.773 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -84.7 | -2.6 | 175.2 | -77.8 | -64.3 | -55.8 | 0 | 0 | 114.2 | D252 T253 | D252-M255 PolarHBondContact O-N 2.82Å; T253-M255 PolarHBondContact O-N 3.4Å |
| 256 | Y | 52.5 | Low | 51.8 | Low | 182 Ų | 182 | 120.2 Ų | 120.2 | 71% | 0.714 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -117.5 | 24.6 | 179.7 | -90.5 | -83.2 | 0 | 0 | 0 | 113.4 | T253 S254 F258 | T253-Y256 PolarHBondContact O-N 2.75Å; S254-Y256 VanDerWaalsContact C-N 3.34Å; Y256-F258 HydrophobicContact CD1-CD2 4.42Å; Y256-F258 HydrophobicContact CD1-CE2 4.4Å; Y256-F258 PolarHBondContact O-N 2.96Å |
| 257 | D | 44 | Very low | 50.6 | Low | 131 Ų | 131 | 121.9 Ų | 121.9 | 70% | 0.701 | 71% | 0.712 | S | S | * | * | trans | -70.6 | 97.4 | 166.8 | -168.3 | 10.8 | 0 | 0 | 0 | 110.4 | D259 | D257-D259 PolarHBondContact O-N 2.97Å; D257-D259 VanDerWaalsContact O-N 3.11Å | ||
| 258 | F | 47.3 | Very low | 49.5 | Very low | 175 Ų | 175 | 121.7 Ų | 121.7 | 77% | 0.768 | 73% | 0.726 | S | S | * | * | trans | -86 | 52.2 | -179 | -114.1 | -84.6 | 0 | 0 | 0 | 111.2 | Y256 P260 | Y256-F258 HydrophobicContact CD1-CD2 4.42Å; Y256-F258 HydrophobicContact CD1-CE2 4.4Å; Y256-F258 PolarHBondContact O-N 2.96Å; F258-P260 WeakPolarHBondContact O-CD 3.21Å; F258-P260 WeakPolarHBondContact O-CG 3.46Å | ||
| 259 | D | 43.8 | Very low | 48.7 | Very low | 116 Ų | 116 | 121.3 Ų | 121.3 | 62% | 0.62 | 74% | 0.739 | S | S | * | * | trans | -66.3 | 109.6 | -174.8 | -168.8 | 23.1 | 0 | 0 | 0 | 111.9 | D257 C261 | D257-D259 PolarHBondContact O-N 2.97Å; D257-D259 VanDerWaalsContact O-N 3.11Å; D259-C261 PolarHBondContact O-N 3.43Å | ||
| 260 | P | 51.1 | Low | 47.9 | Very low | 107 Ų | 107 | 126.6 Ų | 126.6 | 70% | 0.695 | 75% | 0.747 | S | S | * | * | trans | -85 | 109.9 | -171.6 | -4.9 | 24.2 | 0 | 0 | 0 | 111.1 | F258 | F258-P260 WeakPolarHBondContact O-CD 3.21Å; F258-P260 WeakPolarHBondContact O-CG 3.46Å | ||
| 261 | C | 45.3 | Very low | 47.3 | Very low | 121 Ų | 121 | 128.5 Ų | 128.5 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | trans | 98 | 75.6 | 167.6 | -50.1 | 0 | 0 | 0 | 0 | 117.6 | D259 | D259-C261 PolarHBondContact O-N 3.43Š| ||
| 262 | T | 35.5 | Very low | 46.6 | Very low | 141 Ų | 141 | 127.6 Ų | 127.6 | 87% | 0.865 | 76% | 0.759 | S | S | * | * | -124.3 | 153 | 129.9 | 62.5 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 263 | S | 44.7 | Very low | 46.2 | Very low | 126 Ų | 126 | 127.9 Ų | 127.9 | 88% | 0.881 | 77% | 0.767 | S | S | * | * | trans | -135.3 | 112.2 | -176.7 | 179.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 264 | S | 38.6 | Very low | 46 | Very low | 112 Ų | 112 | 128 Ų | 128 | 78% | 0.783 | 77% | 0.768 | S | S | * | * | trans | -164.4 | 117.1 | 167.7 | 176.4 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 265 | S | 46.3 | Very low | 45.9 | Very low | 124 Ų | 124 | 127.3 Ų | 127.3 | 87% | 0.867 | 76% | 0.763 | S | S | * | * | trans | 16.3 | 124.4 | 146.9 | -163.2 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 266 | G | 39.2 | Very low | 45.9 | Very low | 69 Ų | 69 | 122.8 Ų | 122.8 | 71% | 0.711 | 75% | 0.751 | S | S | * | * | trans | -170 | 77.5 | 171.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 267 | T | 35.8 | Very low | 46.2 | Very low | 135 Ų | 135 | 118.9 Ų | 118.9 | 83% | 0.828 | 74% | 0.742 | S | S | * | * | trans | 26.6 | 110.9 | 161.2 | 54.9 | 0 | 0 | 0 | 0 | 119.9 | S269 | T267-S269 PolarHBondContact O-N 3.36Š| ||
| 268 | A | 38.9 | Very low | 47 | Very low | 102 Ų | 102 | 117.5 Ų | 117.5 | 84% | 0.843 | 74% | 0.735 | S | S | * | * | trans | -74.3 | 119.5 | 167 | 0 | 0 | 0 | 0 | 0 | 112.4 | K270 | A268-K270 PolarHBondContact O-N 2.97Š| ||
| 269 | S | 37.8 | Very low | 47.9 | Very low | 118 Ų | 118 | 114.2 Ų | 114.2 | 83% | 0.825 | 73% | 0.725 | S | S | * | * | trans | -70.5 | 90.6 | 174.1 | -71.1 | 0 | 0 | 0 | 0 | 112 | T267 M271 | T267-S269 PolarHBondContact O-N 3.36Å; S269-M271 PolarHBondContact O-N 3.23Å | ||
| 270 | K | 43.5 | Very low | 48.7 | Very low | 191 Ų | 191 | 114.5 Ų | 114.5 | 83% | 0.83 | 73% | 0.726 | S | S | * | * | trans | -71.8 | 85 | 177.5 | -174.5 | -175 | 176.9 | -178.7 | 0 | 111.5 | A268 A272 | A268-K270 PolarHBondContact O-N 2.97Å; K270-A272 PolarHBondContact O-N 3.29Å | ||
| 271 | M | 48.6 | Very low | 49.1 | Very low | 184 Ų | 184 | 117 Ų | 117 | 91% | 0.906 | 73% | 0.726 | S | S | * | * | trans | -65.3 | 115.1 | 158.9 | -73.3 | -164.8 | -73.3 | 0 | 0 | 108.6 | S269 | S269-M271 PolarHBondContact O-N 3.23Š| ||
| 272 | A | 51.2 | Low | 49.6 | Very low | 70 Ų | 70 | 116.3 Ų | 116.3 | 58% | 0.579 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 147.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | K270 V274 | K270-A272 PolarHBondContact O-N 3.29Å; A272-V274 PolarHBondContact O-N 3.2Å |
| 273 | P | 47.9 | Very low | 50.5 | Low | 130 Ų | 130 | 116.5 Ų | 116.5 | 84% | 0.844 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 119.8 | 174 | 27.5 | -33.5 | 0 | 0 | 0 | 109.9 | S275 | P273-S275 PolarHBondContact O-N 3.17Š|
| 274 | V | 57 | Low | 50.6 | Low | 109 Ų | 109 | 113.3 Ų | 113.3 | 66% | 0.661 | 69% | 0.694 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 123.5 | 170.1 | 176.3 | 0 | 0 | 0 | 0 | 108.1 | A272 | A272-V274 PolarHBondContact O-N 3.2Š|
| 275 | S | 58.6 | Low | 51 | Low | 74 Ų | 74 | 112.6 Ų | 112.6 | 52% | 0.517 | 69% | 0.686 | S | S | . | * | P | Polyproline II helix | trans | -70.6 | 143 | 178.6 | -154.8 | 0 | 0 | 0 | 0 | 111 | P273 D277 D278 | P273-S275 PolarHBondContact O-N 3.17Å; S275-D277 WeakPolarHBondContact CB-OD2 3.41Å; S275-D277 PolarHBondContact O-N 3.34Å; S275-D277 VanDerWaalsContact O-N 3.12Å; S275-D277 PolarHBondContact OG-OD2 3.05Å; S275-D278 PolarHBondContact O-N 3.5Å |
| 276 | A | 56.5 | Low | 51 | Low | 62 Ų | 62 | 116.8 Ų | 116.8 | 51% | 0.512 | 69% | 0.685 | S | S | . | * | H | α-helix | trans | -61.1 | -24.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | D278 L279 L280 | A276-D278 VanDerWaalsContact C-N 3.27Å; A276-D278 PolarHBondContact O-N 3.21Å; A276-L279 PolarHBondContact O-N 3.34Å; A276-L280 WeakPolarHBondContact O-CG 3.25Å; A276-L280 PolarHBondContact O-N 3.32Å |
| 277 | D | 58.2 | Low | 51.6 | Low | 99 Ų | 99 | 118.9 Ų | 118.9 | 53% | 0.529 | 69% | 0.688 | S | S | . | * | H | α-helix | trans | -59.9 | -33.7 | -179.4 | -44.2 | -92.1 | 0 | 0 | 0 | 113.3 | S275 L280 K281 | S275-D277 WeakPolarHBondContact CB-OD2 3.41Å; S275-D277 PolarHBondContact O-N 3.34Å; S275-D277 VanDerWaalsContact O-N 3.12Å; S275-D277 PolarHBondContact OG-OD2 3.05Å; D277-L280 PolarHBondContact O-N 2.77Å; D277-K281 WeakPolarHBondContact O-CG 3.48Å; D277-K281 PolarHBondContact O-N 3.29Å |
| 278 | D | 60.4 | Low | 52.2 | Low | 102 Ų | 102 | 117.5 Ų | 117.5 | 55% | 0.545 | 68% | 0.684 | S | S | . | * | H | α-helix | trans | -81.4 | -31.9 | -176 | -142.5 | 38.6 | 0 | 0 | 0 | 111.4 | S275 A276 K281 T282 | S275-D278 PolarHBondContact O-N 3.5Å; A276-D278 VanDerWaalsContact C-N 3.27Å; A276-D278 PolarHBondContact O-N 3.21Å; D278-K281 PolarHBondContact O-N 2.97Å; D278-T282 WeakPolarHBondContact O-CB 3.31Å; D278-T282 PolarHBondContact O-N 3.42Å; D278-T282 PolarHBondContact O-OG1 3.12Å |
| 279 | L | 66 | Low | 52.3 | Low | 106 Ų | 106 | 120.2 Ų | 120.2 | 56% | 0.555 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -65.3 | -42.5 | 168.2 | -60.1 | 176.4 | 0 | 0 | 0 | 110.9 | A276 K281 T282 L283 | A276-L279 PolarHBondContact O-N 3.34Å; L279-K281 VanDerWaalsContact C-N 3.32Å; L279-K281 PolarHBondContact O-N 3.44Å; L279-T282 PolarHBondContact O-N 3.06Å; L279-L283 WeakPolarHBondContact O-CG 3.49Å; L279-L283 PolarHBondContact O-N 3.46Å |
| 280 | L | 62.5 | Low | 52.6 | Low | 123 Ų | 123 | 120.9 Ų | 120.9 | 64% | 0.644 | 68% | 0.681 | S | S | * | * | H | α-helix | trans | -63.3 | -35.2 | 175.9 | -76.2 | 164.3 | 0 | 0 | 0 | 112.6 | A276 D277 | A276-L280 WeakPolarHBondContact O-CG 3.25Å; A276-L280 PolarHBondContact O-N 3.32Å; D277-L280 PolarHBondContact O-N 2.77Å |
| 281 | K | 58.8 | Low | 52.4 | Low | 159 Ų | 159 | 118 Ų | 118 | 69% | 0.691 | 68% | 0.679 | S | S | * | * | H | α-helix | trans | -73.3 | -37.5 | 173.2 | -76.9 | 179.3 | 177.9 | 176.3 | 0 | 113.4 | D277 D278 L279 L283 A284 | D277-K281 WeakPolarHBondContact O-CG 3.48Å; D277-K281 PolarHBondContact O-N 3.29Å; D278-K281 PolarHBondContact O-N 2.97Å; L279-K281 VanDerWaalsContact C-N 3.32Å; L279-K281 PolarHBondContact O-N 3.44Å; K281-L283 PolarHBondContact O-N 3.22Å; K281-A284 WeakPolarHBondContact O-CB 3.46Å; K281-A284 PolarHBondContact O-N 2.94Å |
| 282 | T | 56.1 | Low | 52.1 | Low | 106 Ų | 106 | 112.9 Ų | 112.9 | 65% | 0.65 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -66.7 | -27 | -179.6 | -56.8 | 0 | 0 | 0 | 0 | 112.1 | D278 L279 A284 | D278-T282 WeakPolarHBondContact O-CB 3.31Å; D278-T282 PolarHBondContact O-N 3.42Å; D278-T282 PolarHBondContact O-OG1 3.12Å; L279-T282 PolarHBondContact O-N 3.06Å; T282-A284 VanDerWaalsContact C-N 3.26Å; T282-A284 PolarHBondContact O-N 3.29Å |
| 283 | L | 53.6 | Low | 51.7 | Low | 146 Ų | 146 | 115.9 Ų | 115.9 | 76% | 0.764 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.7 | 5.6 | 175.3 | -68.7 | 171 | 0 | 0 | 0 | 114.7 | L279 K281 P285 | L279-L283 WeakPolarHBondContact O-CG 3.49Å; L279-L283 PolarHBondContact O-N 3.46Å; K281-L283 PolarHBondContact O-N 3.22Å; L283-P285 WeakPolarHBondContact O-CD 3.37Å |
| 284 | A | 47.7 | Very low | 51.6 | Low | 58 Ų | 58 | 114.7 Ų | 114.7 | 48% | 0.479 | 68% | 0.675 | S | S | . | * | trans | -104.6 | 25.5 | -169.3 | 0 | 0 | 0 | 0 | 0 | 119.4 | K281 T282 | K281-A284 WeakPolarHBondContact O-CB 3.46Å; K281-A284 PolarHBondContact O-N 2.94Å; T282-A284 VanDerWaalsContact C-N 3.26Å; T282-A284 PolarHBondContact O-N 3.29Å | ||
| 285 | P | 47.4 | Very low | 51.5 | Low | 97 Ų | 97 | 116.4 Ų | 116.4 | 63% | 0.63 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | 141.7 | 159.1 | 31.3 | -29.8 | 0 | 0 | 0 | 109.8 | L283 | L283-P285 WeakPolarHBondContact O-CD 3.37Š|
| 286 | Y | 46.3 | Very low | 51.2 | Low | 213 Ų | 213 | 118 Ų | 118 | 84% | 0.835 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 80.2 | 22.5 | -177.7 | -66.7 | -84.2 | 0 | 0 | 0 | 119.4 | S288 | Y286-S288 VanDerWaalsContact C-N 3.3Å; Y286-S288 PolarHBondContact O-N 3.45Å |
| 287 | S | 49.8 | Very low | 50.9 | Low | 112 Ų | 112 | 125 Ų | 125 | 78% | 0.783 | 70% | 0.703 | S | S | * | * | trans | -88.2 | 43.8 | 165.1 | -173.6 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 288 | S | 49.8 | Very low | 50.9 | Low | 107 Ų | 107 | 128.4 Ų | 128.4 | 75% | 0.748 | 71% | 0.713 | S | S | * | * | trans | -157.9 | 49.1 | -171.8 | 53.5 | 0 | 0 | 0 | 0 | 116.5 | Y286 | Y286-S288 VanDerWaalsContact C-N 3.3Å; Y286-S288 PolarHBondContact O-N 3.45Å | ||
| 289 | Q | 41.2 | Very low | 51.1 | Low | 158 Ų | 158 | 129.2 Ų | 129.2 | 74% | 0.738 | 72% | 0.715 | S | S | * | * | trans | -144.1 | 123.3 | 168.6 | -159.2 | 166.2 | -7.7 | 0 | 0 | 113 | V291 | Q289-V291 PolarHBondContact O-N 3.01Š| ||
| 290 | P | 44 | Very low | 51.8 | Low | 132 Ų | 132 | 128.1 Ų | 128.1 | 86% | 0.857 | 71% | 0.71 | S | S | * | * | trans | -80.8 | 109.6 | 179.9 | 31.1 | -32.7 | 0 | 0 | 0 | 111.2 | ||||
| 291 | V | 38.9 | Very low | 52.7 | Low | 130 Ų | 130 | 128.6 Ų | 128.6 | 79% | 0.788 | 71% | 0.712 | S | S | * | * | trans | -94.5 | 143.4 | 169.9 | 178.6 | 0 | 0 | 0 | 0 | 109.4 | Q289 | Q289-V291 PolarHBondContact O-N 3.01Š| ||
| 292 | A | 41.8 | Very low | 53.8 | Low | 78 Ų | 78 | 125.8 Ų | 125.8 | 65% | 0.645 | 71% | 0.709 | S | S | * | * | trans | -63.6 | 149.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | S294 | A292-S294 VanDerWaalsContact C-N 3.32Å; A292-S294 PolarHBondContact O-N 3.45Å | ||
| 293 | P | 43.3 | Very low | 55.3 | Low | 133 Ų | 133 | 126.2 Ų | 126.2 | 86% | 0.864 | 70% | 0.703 | S | S | * | * | trans | -79.4 | 70 | -171 | 33.3 | -37.6 | 0 | 0 | 0 | 113.5 | Q295 | P293-Q295 PolarHBondContact O-N 3.49Š| ||
| 294 | S | 45.4 | Very low | 57.1 | Low | 104 Ų | 104 | 122.9 Ų | 122.9 | 73% | 0.727 | 69% | 0.686 | S | S | * | * | trans | -76.5 | 104.6 | 161.7 | 54.4 | 0 | 0 | 0 | 0 | 109.6 | A292 P296 | A292-S294 VanDerWaalsContact C-N 3.32Å; A292-S294 PolarHBondContact O-N 3.45Å; S294-P296 VanDerWaalsContact O-CD 3.31Å; S294-P296 WeakPolarHBondContact O-CD 3.43Å | ||
| 295 | Q | 54.2 | Low | 59 | Low | 146 Ų | 146 | 124.7 Ų | 124.7 | 68% | 0.682 | 69% | 0.688 | S | S | * | * | trans | -34.3 | 110.4 | -173.9 | -70.6 | -89.9 | 11.7 | 0 | 0 | 116.1 | P293 | P293-Q295 PolarHBondContact O-N 3.49Š| ||
| 296 | P | 53.5 | Low | 61.1 | Low | 107 Ų | 107 | 125.2 Ų | 125.2 | 70% | 0.695 | 68% | 0.682 | S | S | * | * | trans | -94.8 | 105.1 | 157.2 | 32.9 | -22.7 | 0 | 0 | 0 | 109.5 | S294 K298 | S294-P296 VanDerWaalsContact O-CD 3.31Å; S294-P296 WeakPolarHBondContact O-CD 3.43Å; P296-K298 PolarHBondContact O-N 3.46Å; P296-K298 VanDerWaalsContact O-N 3.17Å | ||
| 297 | F | 50.3 | Low | 63.2 | Low | 209 Ų | 209 | 119 Ų | 119 | 92% | 0.917 | 66% | 0.662 | S | S | * | * | trans | 36 | 62.8 | 163.5 | -56.3 | -77.4 | 0 | 0 | 0 | 117.1 | M299 | F297-M299 VanDerWaalsContact C-N 3.28Å; F297-M299 PolarHBondContact O-N 3.35Å | ||
| 298 | K | 58.3 | Low | 65.2 | Low | 170 Ų | 170 | 118.6 Ų | 118.6 | 74% | 0.739 | 65% | 0.649 | S | S | * | * | trans | -67.9 | 96.2 | 148 | -79.9 | -168.4 | 171.5 | -169.2 | 0 | 107.9 | P296 D300 | P296-K298 PolarHBondContact O-N 3.46Å; P296-K298 VanDerWaalsContact O-N 3.17Å; K298-D300 PolarHBondContact O-N 2.87Å; K298-D300 VanDerWaalsContact O-N 3.13Å | ||
| 299 | M | 64.4 | Low | 67.1 | Low | 119 Ų | 119 | 119.3 Ų | 119.3 | 59% | 0.586 | 64% | 0.64 | S | S | * | * | trans | -56.5 | 112.4 | 156.2 | 177.5 | -178.3 | 68.6 | 0 | 0 | 106.2 | F297 L301 L304 | F297-M299 VanDerWaalsContact C-N 3.28Å; F297-M299 PolarHBondContact O-N 3.35Å; M299-L301 PolarHBondContact O-N 2.92Å; M299-L304 HydrophobicContact CE-CD2 3.89Å; M299-L304 HydrophobicContact SD-CD1 4.26Å; M299-L304 HydrophobicContact SD-CD2 4.48Å | ||
| 300 | D | 80.1 | Confident | 69.5 | Low | 84 Ų | 84 | 116.4 Ų | 116.4 | 45% | 0.449 | 63% | 0.633 | S | S | . | * | trans | -70.1 | 133.6 | -178.3 | -159.6 | -56.3 | 0 | 0 | 0 | 108.4 | K298 T302 E303 L304 | K298-D300 PolarHBondContact O-N 2.87Å; K298-D300 VanDerWaalsContact O-N 3.13Å; D300-T302 PolarHBondContact O-N 3.2Å; D300-T302 WeakPolarHBondContact OD1-CB 3.34Å; D300-T302 PolarHBondContact OD1-N 3.22Å; D300-T302 PolarHBondContact OD1-OG1 3.36Å; D300-E303 HydrophobicContact CB-CB 3.99Å; D300-E303 WeakPolarHBondContact O-CB 3.41Å; D300-E303 PolarHBondContact O-N 3.07Å; D300-E303 VanDerWaalsContact O-N 3.08Å; D300-L304 PolarHBondContact O-N 2.91Å | ||
| 301 | L | 82.9 | Confident | 71.5 | Confident | 132 Ų | 132 | 116.9 Ų | 116.9 | 69% | 0.691 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -64.7 | -25.6 | 178.3 | -65.8 | 174.8 | 0 | 0 | 0 | 110.9 | M299 L304 D305 | M299-L301 PolarHBondContact O-N 2.92Å; L301-L304 HydrophobicContact CD2-CD2 4.48Å; L301-D305 VanDerWaalsContact O-CB 3.29Å; L301-D305 WeakPolarHBondContact O-CB 3.31Å; L301-D305 PolarHBondContact O-N 2.95Å |
| 302 | T | 80.4 | Confident | 73.7 | Confident | 101 Ų | 101 | 116.4 Ų | 116.4 | 62% | 0.62 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -74.5 | -31.3 | 172.5 | 62.5 | 0 | 0 | 0 | 0 | 113.1 | D300 H306 | D300-T302 PolarHBondContact O-N 3.2Å; D300-T302 WeakPolarHBondContact OD1-CB 3.34Å; D300-T302 PolarHBondContact OD1-N 3.22Å; D300-T302 PolarHBondContact OD1-OG1 3.36Å; T302-H306 WeakPolarHBondContact O-CB 3.42Å; T302-H306 PolarHBondContact O-N 3.08Å; T302-H306 VanDerWaalsContact O-N 3.07Å |
| 303 | E | 88.4 | Confident | 75.2 | Confident | 114 Ų | 114 | 115 Ų | 115 | 53% | 0.533 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -70.7 | -42.6 | 172.2 | -177.8 | 178 | -149.5 | 0 | 0 | 110.4 | D300 H306 I307 | D300-E303 HydrophobicContact CB-CB 3.99Å; D300-E303 WeakPolarHBondContact O-CB 3.41Å; D300-E303 PolarHBondContact O-N 3.07Å; D300-E303 VanDerWaalsContact O-N 3.08Å; E303-H306 PolarHBondContact O-N 3.26Å; E303-I307 HydrophobicContact CG-CD1 3.97Å; E303-I307 WeakPolarHBondContact O-CB 3.38Å; E303-I307 WeakPolarHBondContact O-CD1 3.45Å; E303-I307 VanDerWaalsContact O-CG1 3.23Å; E303-I307 WeakPolarHBondContact O-CG1 3.45Å; E303-I307 PolarHBondContact O-N 2.86Å |
| 304 | L | 90.2 | Very high | 75.7 | Confident | 77 Ų | 77 | 117.9 Ų | 117.9 | 40% | 0.403 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -61.7 | -43.5 | 174.4 | -179.7 | 65.2 | 0 | 0 | 0 | 112.3 | M299 D300 L301 I307 M308 | M299-L304 HydrophobicContact CE-CD2 3.89Å; M299-L304 HydrophobicContact SD-CD1 4.26Å; M299-L304 HydrophobicContact SD-CD2 4.48Å; D300-L304 PolarHBondContact O-N 2.91Å; L301-L304 HydrophobicContact CD2-CD2 4.48Å; L304-I307 PolarHBondContact O-N 3.04Å; L304-M308 WeakPolarHBondContact O-CB 3.23Å; L304-M308 PolarHBondContact O-N 3.17Å |
| 305 | D | 88.4 | Confident | 77.3 | Confident | 95 Ų | 95 | 118.6 Ų | 118.6 | 51% | 0.508 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -64.5 | -42.7 | 178.5 | -160.8 | 47.3 | 0 | 0 | 0 | 111.1 | L301 M308 E309 | L301-D305 VanDerWaalsContact O-CB 3.29Å; L301-D305 WeakPolarHBondContact O-CB 3.31Å; L301-D305 PolarHBondContact O-N 2.95Å; D305-M308 WeakPolarHBondContact O-CB 3.45Å; D305-M308 PolarHBondContact O-N 3.35Å; D305-M308 VanDerWaalsContact OD1-CE 3.23Å; D305-M308 WeakPolarHBondContact OD1-CE 3.48Å; D305-E309 WeakPolarHBondContact O-CB 3.49Å; D305-E309 PolarHBondContact O-N 2.59Å |
| 306 | H | 91.1 | Very high | 78.5 | Confident | 109 Ų | 109 | 117.1 Ų | 117.1 | 51% | 0.505 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -65.8 | -39.1 | 174.1 | -176 | 52.5 | 0 | 0 | 0 | 113.1 | T302 E303 M308 E309 V310 | T302-H306 WeakPolarHBondContact O-CB 3.42Å; T302-H306 PolarHBondContact O-N 3.08Å; T302-H306 VanDerWaalsContact O-N 3.07Å; E303-H306 PolarHBondContact O-N 3.26Å; H306-M308 VanDerWaalsContact C-N 3.3Å; H306-M308 PolarHBondContact O-N 3.13Å; H306-E309 IonicContact ND1-OE1 2.74Å; H306-E309 PolarHBondContact O-N 3.32Å; H306-V310 WeakPolarHBondContact O-CG2 3.35Å; H306-V310 PolarHBondContact O-N 2.65Å |
| 307 | I | 90.8 | Very high | 79.9 | Confident | 83 Ų | 83 | 117.7 Ų | 117.7 | 43% | 0.426 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -61.6 | -40.5 | 172.8 | -72.4 | 164.9 | 0 | 0 | 0 | 110.5 | E303 L304 L311 | E303-I307 HydrophobicContact CG-CD1 3.97Å; E303-I307 WeakPolarHBondContact O-CB 3.38Å; E303-I307 WeakPolarHBondContact O-CD1 3.45Å; E303-I307 VanDerWaalsContact O-CG1 3.23Å; E303-I307 WeakPolarHBondContact O-CG1 3.45Å; E303-I307 PolarHBondContact O-N 2.86Å; L304-I307 PolarHBondContact O-N 3.04Å; I307-L311 HydrophobicContact CG2-CD1 3.83Å; I307-L311 WeakPolarHBondContact O-CB 3.49Å; I307-L311 VanDerWaalsContact O-CG 3.25Å; I307-L311 WeakPolarHBondContact O-CG 3.41Å; I307-L311 PolarHBondContact O-N 2.98Å; I307-L311 VanDerWaalsContact O-N 3.07Å |
| 308 | M | 91.4 | Very high | 81.6 | Confident | 103 Ų | 103 | 112.3 Ų | 112.3 | 51% | 0.507 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -65.9 | -44.9 | 175.8 | -176.9 | 177.2 | 62.7 | 0 | 0 | 111.8 | L304 D305 H306 V310 L311 V312 | L304-M308 WeakPolarHBondContact O-CB 3.23Å; L304-M308 PolarHBondContact O-N 3.17Å; D305-M308 WeakPolarHBondContact O-CB 3.45Å; D305-M308 PolarHBondContact O-N 3.35Å; D305-M308 VanDerWaalsContact OD1-CE 3.23Å; D305-M308 WeakPolarHBondContact OD1-CE 3.48Å; H306-M308 VanDerWaalsContact C-N 3.3Å; H306-M308 PolarHBondContact O-N 3.13Å; M308-V310 PolarHBondContact O-N 2.85Å; M308-L311 PolarHBondContact O-N 2.87Å; M308-V312 HydrophobicContact CG-CG2 4.17Å; M308-V312 WeakPolarHBondContact O-CB 3.23Å; M308-V312 VanDerWaalsContact O-CG2 3.31Å; M308-V312 WeakPolarHBondContact O-CG2 3.29Å; M308-V312 PolarHBondContact O-N 3.46Å |
| 309 | E | 90.7 | Very high | 83.1 | Confident | 121 Ų | 121 | 108.7 Ų | 108.7 | 57% | 0.565 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -56.4 | -47.5 | 176.1 | -173.5 | -175.8 | 85.1 | 0 | 0 | 111.6 | D305 H306 L311 V312 G313 | D305-E309 WeakPolarHBondContact O-CB 3.49Å; D305-E309 PolarHBondContact O-N 2.59Å; H306-E309 IonicContact ND1-OE1 2.74Å; H306-E309 PolarHBondContact O-N 3.32Å; E309-L311 VanDerWaalsContact C-N 3.35Å; E309-L311 PolarHBondContact O-N 3.42Å; E309-V312 PolarHBondContact O-N 3.07Å; E309-G313 PolarHBondContact O-N 3.41Å |
| 310 | V | 90 | Very high | 84.3 | Confident | 98 Ų | 98 | 108 Ų | 108 | 59% | 0.594 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -66.3 | -33.2 | 178.2 | 171.7 | 0 | 0 | 0 | 0 | 112.7 | H306 M308 | H306-V310 WeakPolarHBondContact O-CG2 3.35Å; H306-V310 PolarHBondContact O-N 2.65Å; M308-V310 PolarHBondContact O-N 2.85Å |
| 311 | L | 87.6 | Confident | 84.6 | Confident | 142 Ų | 142 | 109.7 Ų | 109.7 | 74% | 0.743 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -81.6 | -29.9 | 179.1 | -74.2 | 172.3 | 0 | 0 | 0 | 113.9 | I307 M308 E309 | I307-L311 HydrophobicContact CG2-CD1 3.83Å; I307-L311 WeakPolarHBondContact O-CB 3.49Å; I307-L311 VanDerWaalsContact O-CG 3.25Å; I307-L311 WeakPolarHBondContact O-CG 3.41Å; I307-L311 PolarHBondContact O-N 2.98Å; I307-L311 VanDerWaalsContact O-N 3.07Å; M308-L311 PolarHBondContact O-N 2.87Å; E309-L311 VanDerWaalsContact C-N 3.35Å; E309-L311 PolarHBondContact O-N 3.42Å |
| 312 | V | 85.2 | Confident | 84.7 | Confident | 119 Ų | 119 | 108 Ų | 108 | 72% | 0.721 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -80.2 | -37.7 | 176.1 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | M308 E309 | M308-V312 HydrophobicContact CG-CG2 4.17Å; M308-V312 WeakPolarHBondContact O-CB 3.23Å; M308-V312 VanDerWaalsContact O-CG2 3.31Å; M308-V312 WeakPolarHBondContact O-CG2 3.29Å; M308-V312 PolarHBondContact O-N 3.46Å; E309-V312 PolarHBondContact O-N 3.07Å |
| 313 | G | 72.3 | Confident | 85.1 | Confident | 49 Ų | 49 | 108.6 Ų | 108.6 | 51% | 0.505 | 61% | 0.613 | S | S | . | * | trans | 83.9 | 153 | 175.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | E309 | E309-G313 PolarHBondContact O-N 3.41Š| ||
| 314 | S | 55.3 | Low | 84.8 | Confident | 193 Ų | 193 | 108.1 Ų | 108.1 | 100% | 1.35 | 62% | 0.621 | S | S | * | * | trans | -103.9 | 0 | 168.4 | -60.8 | 0 | 0 | 0 | 0 | 111.2 |
Retrieved 314 of 314 residues in 93.2 ms
(Link to these results)