| 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 | D | 36.7 | Very low | 62.7 | Low | 216 Ų | 216 | 113.2 Ų | 113.2 | 100% | 1.155 | 66% | 0.656 | S | S | * | * | 0 | 93.6 | 0 | -53.2 | -34.5 | 0 | 0 | 0 | 111.1 | |||||
| 2 | S | 48.3 | Very low | 64.8 | Low | 120 Ų | 120 | 103.8 Ų | 103.8 | 84% | 0.839 | 60% | 0.602 | S | S | * | * | trans | -151.6 | 57.2 | -179.2 | 56.9 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 3 | V | 49.2 | Very low | 66 | Low | 129 Ų | 129 | 104.8 Ų | 104.8 | 78% | 0.782 | 61% | 0.614 | S | S | * | * | trans | -125.5 | 132.9 | 171.2 | -175.9 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 4 | T | 50.5 | Low | 66.9 | Low | 115 Ų | 115 | 110.3 Ų | 110.3 | 71% | 0.706 | 62% | 0.619 | S | S | * | * | trans | 120.8 | 24.9 | 170.7 | 69.7 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 5 | S | 50.3 | Low | 68 | Low | 117 Ų | 117 | 105.4 Ų | 105.4 | 82% | 0.818 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -89.9 | 6.2 | 162.9 | -75.5 | 0 | 0 | 0 | 0 | 114.6 | ||
| 6 | C | 55.9 | Low | 68.4 | Low | 126 Ų | 126 | 101.1 Ų | 101.1 | 85% | 0.851 | 58% | 0.58 | S | S | * | * | trans | -116.8 | 29.9 | -168.6 | -63.6 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 7 | E | 67.3 | Low | 68.8 | Low | 104 Ų | 104 | 102.5 Ų | 102.5 | 49% | 0.486 | 58% | 0.581 | S | S | . | * | S | Bend | trans | -101.5 | -4.7 | 178.7 | -73.5 | -167.1 | 160.7 | 0 | 0 | 114.9 | P9 R22 | E7-P9 WeakPolarHBondContact O-CD 3.43Å; E7-R22 WeakPolarHBondContact O-CG 3.32Å; E7-R22 IonicContact OE2-CZ 3.62Å; E7-R22 IonicContact OE2-NE 3.59Å; E7-R22 PolarHBondContact OE2-NE 3.47Å; E7-R22 IonicContact OE2-NH2 2.81Å; E7-R22 PolarHBondContact OE2-NH2 2.95Å |
| 8 | L | 77.4 | Confident | 68.8 | Low | 65 Ų | 65 | 106.4 Ų | 106.4 | 34% | 0.34 | 59% | 0.593 | S | S | . | * | trans | -128.9 | 72 | -171.3 | -58.2 | 163 | 0 | 0 | 0 | 110.9 | F10 R20 F21 R22 | L8-F10 VanDerWaalsContact C-N 3.3Å; L8-F10 PolarHBondContact O-N 3.22Å; L8-R20 HydrophobicContact CB-CB 3.45Å; L8-R20 VanDerWaalsContact CB-CB 3.45Å; L8-R20 HydrophobicContact CD1-CB 4.14Å; L8-R20 HydrophobicContact CG-CB 4.32Å; L8-F21 CarbonylContact C-O 3.46Å; L8-F21 WeakPolarHBondContact CA-O 3.32Å; L8-F21 VanDerWaalsContact CD2-C 3.42Å; L8-R22 HydrophobicContact CD2-CB 4.1Å; L8-R22 HydrophobicContact CD2-CG 3.19Å; L8-R22 VanDerWaalsContact CD2-N 3.3Å; L8-R22 HydrophobicContact CG-CG 4.21Å | ||
| 9 | P | 82.1 | Confident | 69.4 | Low | 89 Ų | 89 | 105.2 Ų | 105.2 | 58% | 0.578 | 58% | 0.582 | S | S | * | * | trans | -73.6 | -21.7 | -174 | 29.1 | -34 | 0 | 0 | 0 | 113.1 | E7 | E7-P9 WeakPolarHBondContact O-CD 3.43Š| ||
| 10 | F | 84.7 | Confident | 70.2 | Confident | 70 Ų | 70 | 104 Ų | 104 | 31% | 0.307 | 57% | 0.569 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.5 | 139.6 | -176.4 | -53.6 | -71.4 | 0 | 0 | 0 | 111.2 | L8 R20 F21 L24 L27 | L8-F10 VanDerWaalsContact C-N 3.3Å; L8-F10 PolarHBondContact O-N 3.22Å; F10-R20 CarbonylContact O-C 3.6Å; F10-R20 VanDerWaalsContact O-CA 3.29Å; F10-R20 WeakPolarHBondContact O-CA 3.28Å; F10-F21 HydrophobicContact CB-CB 4.34Å; F10-F21 PolarHBondContact N-O 3.29Å; F10-F21 PolarHBondContact O-N 3.29Å; F10-L24 HydrophobicContact CD1-CD2 3.4Å; F10-L24 HydrophobicContact CD1-CG 3.87Å; F10-L24 HydrophobicContact CE1-CD1 4.23Å; F10-L24 HydrophobicContact CE1-CD2 3.59Å; F10-L24 HydrophobicContact CE1-CG 3.6Å; F10-L24 HydrophobicContact CE2-CG 4.37Å; F10-L24 HydrophobicContact CG-CD2 4.02Å; F10-L24 HydrophobicContact CG-CG 4.36Å; F10-L24 HydrophobicContact CZ-CD2 4.34Å; F10-L24 HydrophobicContact CZ-CG 3.87Å; F10-L27 HydrophobicContact CB-CD2 4.09Å |
| 11 | R | 87.5 | Confident | 71 | Confident | 94 Ų | 94 | 100.2 Ų | 100.2 | 36% | 0.355 | 55% | 0.547 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 144 | -174.6 | -62.4 | 170.1 | 179.6 | -109.8 | 25.6 | 110.7 | E17 R20 | R11-E17 IonicContact CZ-OE1 3.45Å; R11-E17 VanDerWaalsContact CZ-OE1 3.27Å; R11-E17 IonicContact NH1-OE1 2.63Å; R11-E17 PolarHBondContact NH1-OE1 3.49Å; R11-E17 IonicContact NH1-OE2 2.65Å; R11-E17 PolarHBondContact NH1-OE2 3.24Å; R11-E17 IonicContact NH2-OE1 3.33Å; R11-E17 PolarHBondContact NH2-OE1 2.95Å; R11-R20 HydrophobicContact CG-CG 4.25Å; R11-R20 VanDerWaalsContact NH1-NE 3.11Å |
| 12 | C | 87.5 | Confident | 73.5 | Confident | 1 Ų | 1 | 98 Ų | 98 | 1% | 0.007 | 52% | 0.522 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.7 | 125 | 171.7 | 178.5 | 0 | 0 | 0 | 0 | 109.9 | R14 C15 G16 Q19 F21 L27 | C12-R14 PolarHBondContact O-N 3.19Å; C12-R14 PolarHBondContact SG-N 2.75Å; C12-C15 HydrophobicContact CB-CB 4.02Å; C12-C15 PolarHBondContact O-N 3.1Å; C12-G16 PolarHBondContact O-N 2.98Å; C12-Q19 PolarHBondContact N-O 3.39Å; C12-F21 HydrophobicContact CB-CE2 4.1Å; C12-L27 HydrophobicContact CB-CD1 4.02Å |
| 13 | P | 80.8 | Confident | 75.4 | Confident | 116 Ų | 116 | 94.4 Ų | 94.4 | 75% | 0.753 | 50% | 0.497 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.4 | -28.7 | 178 | -21.1 | 31.4 | 0 | 0 | 0 | 113.4 | ||
| 14 | R | 78.4 | Confident | 77.2 | Confident | 182 Ų | 182 | 92.2 Ų | 92.2 | 69% | 0.687 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.5 | -25.8 | -178.4 | -61.2 | -172 | -174.7 | -173.9 | 3.9 | 113.6 | C12 | C12-R14 PolarHBondContact O-N 3.19Å; C12-R14 PolarHBondContact SG-N 2.75Å |
| 15 | C | 83.6 | Confident | 79 | Confident | 37 Ų | 37 | 90 Ų | 90 | 25% | 0.25 | 47% | 0.474 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -105.7 | -6.3 | -179.2 | -58.8 | 0 | 0 | 0 | 0 | 113.8 | C12 Q18 Q19 H35 | C12-C15 HydrophobicContact CB-CB 4.02Å; C12-C15 PolarHBondContact O-N 3.1Å; C15-Q18 PolarHBondContact O-N 3.36Å; C15-Q19 HydrophobicContact CB-CB 3.86Å; C15-Q19 HydrophobicContact CB-CG 3.9Å; C15-H35 PolarHBondContact SG-NE2 2.8Å |
| 16 | G | 73.9 | Confident | 80.8 | Confident | 36 Ų | 36 | 87.3 Ų | 87.3 | 37% | 0.371 | 46% | 0.455 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 61.2 | -136.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | C12 Q18 | C12-G16 PolarHBondContact O-N 2.98Å; G16-Q18 PolarHBondContact O-N 3.38Å |
| 17 | E | 75.4 | Confident | 82.4 | Confident | 125 Ų | 125 | 82.2 Ų | 82.2 | 58% | 0.584 | 42% | 0.419 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -68.1 | -19.3 | -178 | -69.7 | -101.1 | 141.4 | 0 | 0 | 114 | R11 Q19 R20 | R11-E17 IonicContact CZ-OE1 3.45Å; R11-E17 VanDerWaalsContact CZ-OE1 3.27Å; R11-E17 IonicContact NH1-OE1 2.63Å; R11-E17 PolarHBondContact NH1-OE1 3.49Å; R11-E17 IonicContact NH1-OE2 2.65Å; R11-E17 PolarHBondContact NH1-OE2 3.24Å; R11-E17 IonicContact NH2-OE1 3.33Å; R11-E17 PolarHBondContact NH2-OE1 2.95Å; E17-Q19 VanDerWaalsContact C-N 3.34Å; E17-Q19 PolarHBondContact O-N 3.32Å; E17-R20 IonicContact OE1-NH2 3.22Å; E17-R20 IonicContact OE2-CZ 2.73Å; E17-R20 IonicContact OE2-NH2 3.27Å; E17-R20 PolarHBondContact OE2-NH2 3.19Å |
| 18 | Q | 69.6 | Low | 83.3 | Confident | 174 Ų | 174 | 84.7 Ų | 84.7 | 81% | 0.813 | 42% | 0.424 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78.7 | -17.1 | -169.7 | -60.8 | 174.1 | 18.8 | 0 | 0 | 113.3 | C15 G16 | C15-Q18 PolarHBondContact O-N 3.36Å; G16-Q18 PolarHBondContact O-N 3.38Å |
| 19 | Q | 79.7 | Confident | 83.7 | Confident | 82 Ų | 82 | 84.1 Ų | 84.1 | 38% | 0.383 | 43% | 0.429 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 103.6 | 178.4 | -68.5 | -67.3 | -5.9 | 0 | 0 | 110.3 | C12 C15 E17 F21 | C12-Q19 PolarHBondContact N-O 3.39Å; C15-Q19 HydrophobicContact CB-CB 3.86Å; C15-Q19 HydrophobicContact CB-CG 3.9Å; E17-Q19 VanDerWaalsContact C-N 3.34Å; E17-Q19 PolarHBondContact O-N 3.32Å; Q19-F21 HydrophobicContact CB-CE2 4Å; Q19-F21 HydrophobicContact CB-CZ 3.97Å; Q19-F21 WeakPolarHBondContact O-CE2 3.45Å |
| 20 | R | 86.2 | Confident | 84.1 | Confident | 81 Ų | 81 | 81 Ų | 81 | 31% | 0.306 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 150.2 | 177 | -50.6 | -168.4 | 179.4 | -161.7 | 9.7 | 110.7 | L8 F10 R11 E17 | L8-R20 HydrophobicContact CB-CB 3.45Å; L8-R20 VanDerWaalsContact CB-CB 3.45Å; L8-R20 HydrophobicContact CD1-CB 4.14Å; L8-R20 HydrophobicContact CG-CB 4.32Å; F10-R20 CarbonylContact O-C 3.6Å; F10-R20 VanDerWaalsContact O-CA 3.29Å; F10-R20 WeakPolarHBondContact O-CA 3.28Å; R11-R20 HydrophobicContact CG-CG 4.25Å; R11-R20 VanDerWaalsContact NH1-NE 3.11Å; E17-R20 IonicContact OE1-NH2 3.22Å; E17-R20 IonicContact OE2-CZ 2.73Å; E17-R20 IonicContact OE2-NH2 3.27Å; E17-R20 PolarHBondContact OE2-NH2 3.19Å |
| 21 | F | 87.1 | Confident | 84.1 | Confident | 25 Ų | 25 | 80.4 Ų | 80.4 | 11% | 0.11 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 145.5 | -170.7 | -56 | -87.4 | 0 | 0 | 0 | 111.4 | L8 F10 C12 Q19 S23 L27 H30 | L8-F21 CarbonylContact C-O 3.46Å; L8-F21 WeakPolarHBondContact CA-O 3.32Å; L8-F21 VanDerWaalsContact CD2-C 3.42Å; F10-F21 HydrophobicContact CB-CB 4.34Å; F10-F21 PolarHBondContact N-O 3.29Å; F10-F21 PolarHBondContact O-N 3.29Å; C12-F21 HydrophobicContact CB-CE2 4.1Å; Q19-F21 HydrophobicContact CB-CE2 4Å; Q19-F21 HydrophobicContact CB-CZ 3.97Å; Q19-F21 WeakPolarHBondContact O-CE2 3.45Å; F21-S23 VanDerWaalsContact C-N 3.32Å; F21-L27 HydrophobicContact CB-CB 4.15Å; F21-L27 HydrophobicContact CD2-CB 3.98Å; F21-L27 HydrophobicContact CD2-CD1 3.61Å; F21-L27 HydrophobicContact CD2-CG 4.35Å; F21-L27 HydrophobicContact CE2-CD1 3.67Å; F21-L27 HydrophobicContact CG-CB 4.04Å; F21-L27 HydrophobicContact CG-CD1 4.47Å; F21-H30 HydrophobicContact CD1-CB 4.48Å; F21-H30 HydrophobicContact CE1-CB 3.57Å; F21-H30 AromaticContact CE1-CG 3.74Å; F21-H30 HydrophobicContact CE2-CB 4.44Å; F21-H30 AromaticContact CE2-CD2 3.94Å; F21-H30 HydrophobicContact CZ-CB 3.56Å; F21-H30 AromaticContact CZ-CD2 3.46Å; F21-H30 VanDerWaalsContact CZ-CD2 3.46Å; F21-H30 WeakPolarHBondContact CZ-CD2 3.07Å; F21-H30 AromaticContact CZ-CE1 3.97Å; F21-H30 AromaticContact CZ-CG 3.25Å; F21-H30 AromaticContact CZ-ND1 3.61Å; F21-H30 AromaticContact CZ-NE2 3.89Å |
| 22 | R | 88.1 | Confident | 84 | Confident | 171 Ų | 171 | 82.2 Ų | 82.2 | 65% | 0.645 | 42% | 0.419 | S | S | * | . | S | Bend | trans | -76.3 | -23.5 | -179.6 | -62 | -166.8 | 164 | 152 | -4.2 | 111.9 | E7 L8 | E7-R22 WeakPolarHBondContact O-CG 3.32Å; E7-R22 IonicContact OE2-CZ 3.62Å; E7-R22 IonicContact OE2-NE 3.59Å; E7-R22 PolarHBondContact OE2-NE 3.47Å; E7-R22 IonicContact OE2-NH2 2.81Å; E7-R22 PolarHBondContact OE2-NH2 2.95Å; L8-R22 HydrophobicContact CD2-CB 4.1Å; L8-R22 HydrophobicContact CD2-CG 3.19Å; L8-R22 VanDerWaalsContact CD2-N 3.3Å; L8-R22 HydrophobicContact CG-CG 4.21Å |
| 23 | S | 87.4 | Confident | 83.7 | Confident | 43 Ų | 43 | 91 Ų | 91 | 30% | 0.301 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -143.8 | 156.9 | -177.5 | 76.7 | 0 | 0 | 0 | 0 | 112.1 | F21 A25 S26 L27 | F21-S23 VanDerWaalsContact C-N 3.32Å; S23-A25 PolarHBondContact O-N 3.5Å; S23-A25 PolarHBondContact OG-N 3.34Å; S23-S26 PolarHBondContact O-N 3.04Å; S23-S26 PolarHBondContact OG-N 3.47Å; S23-S26 PolarHBondContact OG-OG 2.83Å; S23-S26 VanDerWaalsContact OG-OG 3.08Å; S23-L27 PolarHBondContact O-N 3.1Å; S23-L27 VanDerWaalsContact O-N 3.16Å |
| 24 | L | 88.1 | Confident | 83.6 | Confident | 83 Ų | 83 | 93.2 Ų | 93.2 | 44% | 0.435 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.5 | -30.1 | 172 | -72.9 | 174.5 | 0 | 0 | 0 | 112.7 | F10 L27 R28 | F10-L24 HydrophobicContact CD1-CD2 3.4Å; F10-L24 HydrophobicContact CD1-CG 3.87Å; F10-L24 HydrophobicContact CE1-CD1 4.23Å; F10-L24 HydrophobicContact CE1-CD2 3.59Å; F10-L24 HydrophobicContact CE1-CG 3.6Å; F10-L24 HydrophobicContact CE2-CG 4.37Å; F10-L24 HydrophobicContact CG-CD2 4.02Å; F10-L24 HydrophobicContact CG-CG 4.36Å; F10-L24 HydrophobicContact CZ-CD2 4.34Å; F10-L24 HydrophobicContact CZ-CG 3.87Å; L24-L27 HydrophobicContact CD2-CD2 4.34Å; L24-L27 PolarHBondContact O-N 3.11Å; L24-R28 WeakPolarHBondContact O-CB 3.48Å; L24-R28 WeakPolarHBondContact O-CG 3.17Å; L24-R28 PolarHBondContact O-N 2.88Å |
| 25 | A | 88.6 | Confident | 83.7 | Confident | 69 Ų | 69 | 86.6 Ų | 86.6 | 57% | 0.57 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -65.9 | -44.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S23 L27 R28 A29 | S23-A25 PolarHBondContact O-N 3.5Å; S23-A25 PolarHBondContact OG-N 3.34Å; A25-L27 VanDerWaalsContact C-N 3.33Å; A25-L27 PolarHBondContact O-N 3.36Å; A25-R28 PolarHBondContact O-N 3.07Å; A25-A29 WeakPolarHBondContact O-CB 3.34Å; A25-A29 PolarHBondContact O-N 2.99Å |
| 26 | S | 88.5 | Confident | 82.7 | Confident | 60 Ų | 60 | 89 Ų | 89 | 42% | 0.42 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -64.7 | -37.6 | 174.8 | -53.9 | 0 | 0 | 0 | 0 | 112.1 | S23 H30 | S23-S26 PolarHBondContact O-N 3.04Å; S23-S26 PolarHBondContact OG-N 3.47Å; S23-S26 PolarHBondContact OG-OG 2.83Å; S23-S26 VanDerWaalsContact OG-OG 3.08Å; S26-H30 WeakPolarHBondContact O-CB 3.23Å; S26-H30 PolarHBondContact O-N 2.82Å |
| 27 | L | 88.6 | Confident | 81.4 | Confident | 19 Ų | 19 | 95.8 Ų | 95.8 | 10% | 0.099 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -65.3 | -44.4 | 173.5 | 174.4 | 60.8 | 0 | 0 | 0 | 111.7 | F10 C12 F21 S23 L24 A25 H30 L31 | F10-L27 HydrophobicContact CB-CD2 4.09Å; C12-L27 HydrophobicContact CB-CD1 4.02Å; F21-L27 HydrophobicContact CB-CB 4.15Å; F21-L27 HydrophobicContact CD2-CB 3.98Å; F21-L27 HydrophobicContact CD2-CD1 3.61Å; F21-L27 HydrophobicContact CD2-CG 4.35Å; F21-L27 HydrophobicContact CE2-CD1 3.67Å; F21-L27 HydrophobicContact CG-CB 4.04Å; F21-L27 HydrophobicContact CG-CD1 4.47Å; S23-L27 PolarHBondContact O-N 3.1Å; S23-L27 VanDerWaalsContact O-N 3.16Å; L24-L27 HydrophobicContact CD2-CD2 4.34Å; L24-L27 PolarHBondContact O-N 3.11Å; A25-L27 VanDerWaalsContact C-N 3.33Å; A25-L27 PolarHBondContact O-N 3.36Å; L27-H30 WeakPolarHBondContact O-CB 3.32Å; L27-H30 PolarHBondContact O-N 3.35Å; L27-L31 HydrophobicContact CD1-CD1 4.28Å; L27-L31 HydrophobicContact CD1-CG 4.17Å; L27-L31 HydrophobicContact CG-CD1 4.2Å; L27-L31 WeakPolarHBondContact O-CG 3.41Å; L27-L31 PolarHBondContact O-N 3.46Å |
| 28 | R | 86.6 | Confident | 80.2 | Confident | 156 Ų | 156 | 100.8 Ų | 100.8 | 59% | 0.589 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -61.7 | -47.7 | 177.3 | -77.5 | 179.2 | -172.5 | 152.3 | 1.5 | 112 | L24 A25 H30 L31 E32 | L24-R28 WeakPolarHBondContact O-CB 3.48Å; L24-R28 WeakPolarHBondContact O-CG 3.17Å; L24-R28 PolarHBondContact O-N 2.88Å; A25-R28 PolarHBondContact O-N 3.07Å; R28-H30 VanDerWaalsContact C-N 3.27Å; R28-H30 PolarHBondContact O-N 2.87Å; R28-L31 PolarHBondContact O-N 3.39Å; R28-L31 VanDerWaalsContact O-N 3.12Å; R28-E32 WeakPolarHBondContact O-CB 3.44Å; R28-E32 WeakPolarHBondContact O-CG 3.31Å; R28-E32 PolarHBondContact O-N 2.99Å |
| 29 | A | 86.4 | Confident | 78.8 | Confident | 54 Ų | 54 | 96.1 Ų | 96.1 | 45% | 0.446 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -60.2 | -38.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | A25 E32 Y33 | A25-A29 WeakPolarHBondContact O-CB 3.34Å; A25-A29 PolarHBondContact O-N 2.99Å; A29-E32 PolarHBondContact O-N 2.85Å; A29-Y33 VanDerWaalsContact O-CB 3.25Å; A29-Y33 WeakPolarHBondContact O-CB 3.39Å; A29-Y33 PolarHBondContact O-N 2.7Å |
| 30 | H | 88.7 | Confident | 77.1 | Confident | 22 Ų | 22 | 96 Ų | 96 | 10% | 0.102 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -63.8 | -46.2 | 173.3 | 171 | 83.7 | 0 | 0 | 0 | 112.1 | F21 S26 L27 R28 E32 Y33 R34 H35 | F21-H30 HydrophobicContact CD1-CB 4.48Å; F21-H30 HydrophobicContact CE1-CB 3.57Å; F21-H30 AromaticContact CE1-CG 3.74Å; F21-H30 HydrophobicContact CE2-CB 4.44Å; F21-H30 AromaticContact CE2-CD2 3.94Å; F21-H30 HydrophobicContact CZ-CB 3.56Å; F21-H30 AromaticContact CZ-CD2 3.46Å; F21-H30 VanDerWaalsContact CZ-CD2 3.46Å; F21-H30 WeakPolarHBondContact CZ-CD2 3.07Å; F21-H30 AromaticContact CZ-CE1 3.97Å; F21-H30 AromaticContact CZ-CG 3.25Å; F21-H30 AromaticContact CZ-ND1 3.61Å; F21-H30 AromaticContact CZ-NE2 3.89Å; S26-H30 WeakPolarHBondContact O-CB 3.23Å; S26-H30 PolarHBondContact O-N 2.82Å; L27-H30 WeakPolarHBondContact O-CB 3.32Å; L27-H30 PolarHBondContact O-N 3.35Å; R28-H30 VanDerWaalsContact C-N 3.27Å; R28-H30 PolarHBondContact O-N 2.87Å; H30-E32 VanDerWaalsContact C-N 3.32Å; H30-E32 PolarHBondContact O-N 3.01Å; H30-Y33 PolarHBondContact O-N 3.03Å; H30-R34 VanDerWaalsContact O-CB 3.31Å; H30-R34 WeakPolarHBondContact O-CB 3.43Å; H30-R34 PolarHBondContact O-N 3.26Å; H30-H35 AromaticContact NE2-CD2 3.87Å; H30-H35 AromaticContact NE2-NE2 3.66Å |
| 31 | L | 86.6 | Confident | 74.9 | Confident | 58 Ų | 58 | 98.9 Ų | 98.9 | 30% | 0.304 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.8 | -41.6 | 175.6 | -69.1 | 172.1 | 0 | 0 | 0 | 111.1 | L27 R28 H35 S36 | L27-L31 HydrophobicContact CD1-CD1 4.28Å; L27-L31 HydrophobicContact CD1-CG 4.17Å; L27-L31 HydrophobicContact CG-CD1 4.2Å; L27-L31 WeakPolarHBondContact O-CG 3.41Å; L27-L31 PolarHBondContact O-N 3.46Å; R28-L31 PolarHBondContact O-N 3.39Å; R28-L31 VanDerWaalsContact O-N 3.12Å; L31-H35 HydrophobicContact CD2-CB 4.47Å; L31-H35 CarbonylContact O-C 3.53Å; L31-H35 WeakPolarHBondContact O-CA 3.44Å; L31-H35 VanDerWaalsContact O-CB 3.27Å; L31-H35 WeakPolarHBondContact O-CB 3.36Å; L31-H35 PolarHBondContact O-N 2.99Å; L31-S36 PolarHBondContact O-N 2.86Å |
| 32 | E | 84.2 | Confident | 72.8 | Confident | 132 Ų | 132 | 104 Ų | 104 | 62% | 0.617 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -69.5 | -36.9 | 179 | -74.6 | 167.1 | -169.7 | 0 | 0 | 113.1 | R28 A29 H30 S36 | R28-E32 WeakPolarHBondContact O-CB 3.44Å; R28-E32 WeakPolarHBondContact O-CG 3.31Å; R28-E32 PolarHBondContact O-N 2.99Å; A29-E32 PolarHBondContact O-N 2.85Å; H30-E32 VanDerWaalsContact C-N 3.32Å; H30-E32 PolarHBondContact O-N 3.01Å; E32-S36 WeakPolarHBondContact O-CA 3.48Å; E32-S36 WeakPolarHBondContact O-CB 3.49Å; E32-S36 PolarHBondContact O-N 3.15Å; E32-S36 PolarHBondContact O-OG 3.41Å |
| 33 | Y | 81.8 | Confident | 70.3 | Confident | 186 Ų | 186 | 101.8 Ų | 101.8 | 73% | 0.729 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -85.3 | -40.5 | -177.5 | -173.8 | -105 | 0 | 0 | 0 | 113.5 | A29 H30 | A29-Y33 VanDerWaalsContact O-CB 3.25Å; A29-Y33 WeakPolarHBondContact O-CB 3.39Å; A29-Y33 PolarHBondContact O-N 2.7Å; H30-Y33 PolarHBondContact O-N 3.03Å |
| 34 | R | 77.7 | Confident | 68.2 | Low | 162 Ų | 162 | 105.3 Ų | 105.3 | 61% | 0.611 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -99.6 | -23.3 | -175.4 | -70.8 | -105.8 | 143.9 | 97.7 | -2.5 | 113.4 | H30 | H30-R34 VanDerWaalsContact O-CB 3.31Å; H30-R34 WeakPolarHBondContact O-CB 3.43Å; H30-R34 PolarHBondContact O-N 3.26Å |
| 35 | H | 80.8 | Confident | 66.1 | Low | 43 Ų | 43 | 103.4 Ų | 103.4 | 20% | 0.199 | 55% | 0.547 | C | S | . | . | S | Bend | trans | -130 | 30.4 | -178.6 | -57.1 | -57.7 | 0 | 0 | 0 | 111.5 | C15 H30 L31 Y37 | C15-H35 PolarHBondContact SG-NE2 2.8Å; H30-H35 AromaticContact NE2-CD2 3.87Å; H30-H35 AromaticContact NE2-NE2 3.66Å; L31-H35 HydrophobicContact CD2-CB 4.47Å; L31-H35 CarbonylContact O-C 3.53Å; L31-H35 WeakPolarHBondContact O-CA 3.44Å; L31-H35 VanDerWaalsContact O-CB 3.27Å; L31-H35 WeakPolarHBondContact O-CB 3.36Å; L31-H35 PolarHBondContact O-N 2.99Å; H35-Y37 PolarHBondContact O-N 2.84Å; H35-Y37 VanDerWaalsContact O-N 3.08Å |
| 36 | S | 63.4 | Low | 63.6 | Low | 88 Ų | 88 | 107.7 Ų | 107.7 | 62% | 0.615 | 56% | 0.56 | S | S | * | * | trans | -35.3 | 119.2 | -176.1 | -171.4 | 0 | 0 | 0 | 0 | 109.6 | L31 E32 R38 | L31-S36 PolarHBondContact O-N 2.86Å; E32-S36 WeakPolarHBondContact O-CA 3.48Å; E32-S36 WeakPolarHBondContact O-CB 3.49Å; E32-S36 PolarHBondContact O-N 3.15Å; E32-S36 PolarHBondContact O-OG 3.41Å; S36-R38 PolarHBondContact O-N 3.21Å | ||
| 37 | Y | 47.1 | Very low | 61 | Low | 179 Ų | 179 | 114 Ų | 114 | 70% | 0.702 | 58% | 0.581 | S | S | * | * | trans | -62.4 | 86 | -179.5 | -173.9 | -94 | 0 | 0 | 0 | 107.7 | H35 S39 | H35-Y37 PolarHBondContact O-N 2.84Å; H35-Y37 VanDerWaalsContact O-N 3.08Å; Y37-S39 VanDerWaalsContact C-N 3.33Å; Y37-S39 PolarHBondContact O-N 2.83Å; Y37-S39 VanDerWaalsContact O-N 3.09Å | ||
| 38 | R | 50.1 | Low | 58.6 | Low | 230 Ų | 230 | 118.1 Ų | 118.1 | 87% | 0.868 | 61% | 0.611 | S | S | * | * | trans | -65 | 107.2 | 155.2 | -168.8 | 174 | -169.6 | 152.3 | 1.5 | 103.6 | S36 P40 | S36-R38 PolarHBondContact O-N 3.21Å; R38-P40 WeakPolarHBondContact O-CD 3.22Å | ||
| 39 | S | 38.6 | Very low | 56.5 | Low | 75 Ų | 75 | 118.1 Ų | 118.1 | 52% | 0.524 | 62% | 0.621 | S | S | . | * | trans | -40.4 | 110.3 | 172.6 | -175.4 | 0 | 0 | 0 | 0 | 107.9 | Y37 D41 | Y37-S39 VanDerWaalsContact C-N 3.33Å; Y37-S39 PolarHBondContact O-N 2.83Å; Y37-S39 VanDerWaalsContact O-N 3.09Å; S39-D41 PolarHBondContact O-N 3.25Å | ||
| 40 | P | 45.7 | Very low | 54.4 | Low | 80 Ų | 80 | 120.8 Ų | 120.8 | 52% | 0.519 | 63% | 0.632 | S | S | . | * | trans | -68.1 | 118.7 | 156.7 | 24.5 | -15 | 0 | 0 | 0 | 103.1 | R38 V42 | R38-P40 WeakPolarHBondContact O-CD 3.22Å; P40-V42 PolarHBondContact O-N 3.08Å | ||
| 41 | D | 38.9 | Very low | 52.5 | Low | 141 Ų | 141 | 124 Ų | 124 | 75% | 0.754 | 67% | 0.67 | S | S | * | * | trans | -42 | 130.6 | 157.5 | -68 | -49.2 | 0 | 0 | 0 | 107 | S39 V43 | S39-D41 PolarHBondContact O-N 3.25Å; D41-V43 VanDerWaalsContact C-N 3.28Å; D41-V43 PolarHBondContact O-N 2.87Å | ||
| 42 | V | 42.7 | Very low | 50.5 | Low | 133 Ų | 133 | 126.5 Ų | 126.5 | 81% | 0.806 | 69% | 0.693 | S | S | * | * | trans | -53.7 | 93.3 | -173.5 | 179 | 0 | 0 | 0 | 0 | 109.2 | P40 | P40-V42 PolarHBondContact O-N 3.08Š| ||
| 43 | V | 37.3 | Very low | 48.5 | Very low | 124 Ų | 124 | 128.1 Ų | 128.1 | 75% | 0.752 | 71% | 0.705 | S | S | * | * | trans | -100.1 | 102.2 | 154.9 | 174.1 | 0 | 0 | 0 | 0 | 103.9 | D41 G45 | D41-V43 VanDerWaalsContact C-N 3.28Å; D41-V43 PolarHBondContact O-N 2.87Å; V43-G45 VanDerWaalsContact C-N 3.34Å; V43-G45 PolarHBondContact O-N 3.29Å | ||
| 44 | S | 41.4 | Very low | 46.8 | Very low | 118 Ų | 118 | 125 Ų | 125 | 83% | 0.825 | 71% | 0.707 | S | S | * | * | trans | -60.4 | 98.2 | 167 | -66.6 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 45 | G | 43.9 | Very low | 45.6 | Very low | 43 Ų | 43 | 121.6 Ų | 121.6 | 44% | 0.443 | 70% | 0.702 | S | S | . | * | trans | 170.8 | 123.4 | 173.2 | 0 | 0 | 0 | 0 | 0 | 105.8 | V43 | V43-G45 VanDerWaalsContact C-N 3.34Å; V43-G45 PolarHBondContact O-N 3.29Å | ||
| 46 | D | 37.7 | Very low | 44.1 | Very low | 158 Ų | 158 | 124.8 Ų | 124.8 | 85% | 0.845 | 73% | 0.726 | S | S | * | * | cis | -164.3 | 141.7 | 37.5 | -61.4 | -49.5 | 0 | 0 | 0 | 108.6 | ||||
| 47 | F | 32.3 | Very low | 43.6 | Very low | 194 Ų | 194 | 123.9 Ų | 123.9 | 85% | 0.851 | 71% | 0.714 | S | S | * | * | trans | -123.4 | 101.5 | 146.8 | -158.3 | -87.5 | 0 | 0 | 0 | 106.4 | I49 | F47-I49 HydrophobicContact CE1-CG1 4.49Š| ||
| 48 | S | 38.2 | Very low | 43.6 | Very low | 104 Ų | 104 | 119.8 Ų | 119.8 | 73% | 0.727 | 72% | 0.717 | S | S | * | * | trans | -144.5 | 134.9 | 168.9 | -111.5 | 0 | 0 | 0 | 0 | 111.9 | T50 | S48-T50 VanDerWaalsContact C-N 3.32Å; S48-T50 PolarHBondContact O-N 2.97Å | ||
| 49 | I | 42.5 | Very low | 43.6 | Very low | 157 Ų | 157 | 113 Ų | 113 | 81% | 0.805 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -81.6 | -1.9 | -167 | -83.8 | 169.4 | 0 | 0 | 0 | 113.5 | F47 | F47-I49 HydrophobicContact CE1-CG1 4.49Š|
| 50 | T | 44.1 | Very low | 43.9 | Very low | 110 Ų | 110 | 111.9 Ų | 111.9 | 68% | 0.675 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -111 | 103.5 | 179 | 55.5 | 0 | 0 | 0 | 0 | 108.9 | S48 S52 | S48-T50 VanDerWaalsContact C-N 3.32Å; S48-T50 PolarHBondContact O-N 2.97Å; T50-S52 PolarHBondContact O-N 3.36Å |
| 51 | G | 47.1 | Very low | 43.9 | Very low | 88 Ų | 88 | 114.9 Ų | 114.9 | 91% | 0.907 | 72% | 0.716 | S | S | * | * | trans | -54.8 | 111.4 | -175.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 52 | S | 45.7 | Very low | 44 | Very low | 112 Ų | 112 | 112.3 Ų | 112.3 | 78% | 0.783 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -97 | 131.6 | 163.4 | 47.9 | 0 | 0 | 0 | 0 | 109.4 | T50 | T50-S52 PolarHBondContact O-N 3.36Š|
| 53 | L | 42.7 | Very low | 44.2 | Very low | 165 Ų | 165 | 117.2 Ų | 117.2 | 86% | 0.864 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 148.8 | 170.7 | -129.5 | 79.1 | 0 | 0 | 0 | 110 | ||
| 54 | P | 46.1 | Very low | 44.6 | Very low | 120 Ų | 120 | 119.9 Ų | 119.9 | 78% | 0.779 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 140.7 | -176.2 | 26.9 | -27.4 | 0 | 0 | 0 | 111.4 | ||
| 55 | D | 50.8 | Low | 44.5 | Very low | 91 Ų | 91 | 120.9 Ų | 120.9 | 49% | 0.487 | 72% | 0.719 | S | S | . | * | P | Polyproline II helix | trans | -62.1 | 128 | -177.9 | -178.6 | 1.1 | 0 | 0 | 0 | 111.9 | L57 A58 | D55-L57 PolarHBondContact O-N 3.49Å; D55-L57 VanDerWaalsContact O-N 3.08Å; D55-L57 WeakPolarHBondContact OD1-CB 3.33Å; D55-L57 WeakPolarHBondContact OD1-CG 3.41Å; D55-L57 PolarHBondContact OD1-N 3.34Å; D55-A58 PolarHBondContact O-N 3.36Å |
| 56 | P | 49.6 | Very low | 44.2 | Very low | 110 Ų | 110 | 125.4 Ų | 125.4 | 71% | 0.714 | 74% | 0.738 | S | S | * | * | G | 310 helix | trans | -60.2 | -13.3 | 175.2 | 24.1 | -34.3 | 0 | 0 | 0 | 114.5 | A58 A59 | P56-A58 VanDerWaalsContact C-N 3.32Å; P56-A58 PolarHBondContact O-N 3.09Å; P56-A59 PolarHBondContact O-N 3.26Å |
| 57 | L | 53.2 | Low | 44.4 | Very low | 69 Ų | 69 | 122.5 Ų | 122.5 | 36% | 0.361 | 73% | 0.73 | S | S | . | * | G | 310 helix | trans | -71.1 | -22 | 177.5 | -69.5 | 169.3 | 0 | 0 | 0 | 114.1 | D55 A59 A60 L203 | D55-L57 PolarHBondContact O-N 3.49Å; D55-L57 VanDerWaalsContact O-N 3.08Å; D55-L57 WeakPolarHBondContact OD1-CB 3.33Å; D55-L57 WeakPolarHBondContact OD1-CG 3.41Å; D55-L57 PolarHBondContact OD1-N 3.34Å; L57-A59 PolarHBondContact O-N 2.99Å; L57-A60 PolarHBondContact O-N 3.43Å; L57-L203 HydrophobicContact CD1-CD2 4.44Å |
| 58 | A | 47.8 | Very low | 44.7 | Very low | 93 Ų | 93 | 120.9 Ų | 120.9 | 77% | 0.769 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -67.1 | -20.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | D55 P56 | D55-A58 PolarHBondContact O-N 3.36Å; P56-A58 VanDerWaalsContact C-N 3.32Å; P56-A58 PolarHBondContact O-N 3.09Å |
| 59 | A | 49 | Very low | 44.9 | Very low | 87 Ų | 87 | 122 Ų | 122 | 72% | 0.719 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -90.1 | -16.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | P56 L57 | P56-A59 PolarHBondContact O-N 3.26Å; L57-A59 PolarHBondContact O-N 2.99Å |
| 60 | A | 46.3 | Very low | 44.6 | Very low | 52 Ų | 52 | 119.2 Ų | 119.2 | 43% | 0.43 | 73% | 0.734 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -91.7 | -13.8 | -171.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | L57 A62 W63 | L57-A60 PolarHBondContact O-N 3.43Å; A60-A62 VanDerWaalsContact C-N 3.27Å; A60-A62 PolarHBondContact O-N 2.94Å; A60-W63 VanDerWaalsContact O-CD1 3.25Å |
| 61 | I | 43.9 | Very low | 44.3 | Very low | 143 Ų | 143 | 125.3 Ų | 125.3 | 73% | 0.733 | 75% | 0.745 | S | S | * | * | trans | -94.9 | 40.8 | -176.9 | -44.3 | 170.9 | 0 | 0 | 0 | 110.9 | ||||
| 62 | A | 41.4 | Very low | 43.8 | Very low | 87 Ų | 87 | 133 Ų | 133 | 72% | 0.719 | 75% | 0.747 | S | S | * | * | trans | -107.1 | 41.5 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111 | A60 | A60-A62 VanDerWaalsContact C-N 3.27Å; A60-A62 PolarHBondContact O-N 2.94Å | ||
| 63 | W | 46.3 | Very low | 43.2 | Very low | 236 Ų | 236 | 131 Ų | 131 | 89% | 0.894 | 74% | 0.743 | S | S | * | * | trans | -102.5 | 58.1 | 173 | -69.9 | 97.4 | 0 | 0 | 0 | 111 | A60 | A60-W63 VanDerWaalsContact O-CD1 3.25Š| ||
| 64 | Q | 46 | Very low | 42.9 | Very low | 181 Ų | 181 | 131.6 Ų | 131.6 | 85% | 0.846 | 74% | 0.741 | S | S | * | * | trans | -146.7 | 83.4 | 167.7 | -62.7 | -173.7 | 37.7 | 0 | 0 | 110.1 | ||||
| 65 | D | 40.3 | Very low | 42.6 | Very low | 139 Ų | 139 | 135.5 Ų | 135.5 | 74% | 0.743 | 75% | 0.749 | S | S | * | * | trans | -170.3 | 78 | 132.2 | -137.1 | -19.6 | 0 | 0 | 0 | 110.5 | S67 | D65-S67 PolarHBondContact OD1-OG 2.84Š| ||
| 66 | T | 38.1 | Very low | 41.7 | Very low | 138 Ų | 138 | 135.1 Ų | 135.1 | 85% | 0.847 | 77% | 0.766 | S | S | * | * | trans | -119.6 | 71.8 | 154.6 | 50 | 0 | 0 | 0 | 0 | 106.9 | L68 | T66-L68 PolarHBondContact O-N 3.27Å; T66-L68 VanDerWaalsContact O-N 3.13Å | ||
| 67 | S | 40.3 | Very low | 41.3 | Very low | 96 Ų | 96 | 134.9 Ų | 134.9 | 67% | 0.671 | 77% | 0.774 | S | S | * | * | trans | -56.4 | 109.9 | 167.7 | 14.7 | 0 | 0 | 0 | 0 | 108.8 | D65 | D65-S67 PolarHBondContact OD1-OG 2.84Š| ||
| 68 | L | 39.3 | Very low | 40.3 | Very low | 160 Ų | 160 | 136.5 Ų | 136.5 | 84% | 0.838 | 80% | 0.797 | S | S | * | * | trans | -58.9 | 137.6 | 168.5 | -66.7 | 166.6 | 0 | 0 | 0 | 109.1 | T66 A70 | T66-L68 PolarHBondContact O-N 3.27Å; T66-L68 VanDerWaalsContact O-N 3.13Å; L68-A70 PolarHBondContact O-N 2.84Å | ||
| 69 | P | 41.5 | Very low | 39.7 | Very low | 128 Ų | 128 | 143 Ų | 143 | 83% | 0.831 | 80% | 0.802 | S | S | * | * | trans | -71.3 | 104.7 | 174.6 | 27.3 | -30.3 | 0 | 0 | 0 | 109.8 | R71 | P69-R71 PolarHBondContact O-N 3.47Å; P69-R71 VanDerWaalsContact O-N 3.12Å | ||
| 70 | A | 36.8 | Very low | 39.8 | Very low | 98 Ų | 98 | 143.7 Ų | 143.7 | 81% | 0.81 | 80% | 0.799 | S | S | * | * | trans | -67.9 | 101.3 | 166.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | L68 R72 | L68-A70 PolarHBondContact O-N 2.84Å; A70-R72 PolarHBondContact O-N 3.37Å; A70-R72 VanDerWaalsContact O-N 3.08Å | ||
| 71 | R | 38.7 | Very low | 40 | Very low | 239 Ų | 239 | 146.6 Ų | 146.6 | 90% | 0.902 | 81% | 0.813 | S | S | * | * | trans | -75.7 | 96 | 169.3 | -156 | -178.1 | -163.5 | -91.6 | 3 | 109 | P69 | P69-R71 PolarHBondContact O-N 3.47Å; P69-R71 VanDerWaalsContact O-N 3.12Å | ||
| 72 | R | 36.6 | Very low | 40.2 | Very low | 250 Ų | 250 | 148 Ų | 148 | 94% | 0.943 | 82% | 0.817 | S | S | * | * | trans | -69.3 | 121.8 | 167.4 | -155.8 | -177.2 | -150.3 | -122 | 6.1 | 108.5 | A70 | A70-R72 PolarHBondContact O-N 3.37Å; A70-R72 VanDerWaalsContact O-N 3.08Å | ||
| 73 | G | 32.5 | Very low | 40.1 | Very low | 68 Ų | 68 | 150.8 Ų | 150.8 | 70% | 0.701 | 82% | 0.824 | S | S | * | * | trans | -175.2 | 72.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 74 | Q | 35.9 | Very low | 39.9 | Very low | 178 Ų | 178 | 150.5 Ų | 150.5 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | trans | -83.6 | 122.7 | 165.9 | -117.7 | 171.8 | 51.6 | 0 | 0 | 107.5 | ||||
| 75 | H | 39.4 | Very low | 39.6 | Very low | 203 Ų | 203 | 146.8 Ų | 146.8 | 94% | 0.94 | 82% | 0.817 | S | S | * | * | trans | -178.6 | 132.2 | 139.8 | -73.5 | -52.4 | 0 | 0 | 0 | 108.6 | ||||
| 76 | G | 33.1 | Very low | 39.6 | Very low | 82 Ų | 82 | 148.2 Ų | 148.2 | 85% | 0.845 | 82% | 0.824 | S | S | * | * | trans | 120 | 106.6 | 157.8 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 77 | A | 40.5 | Very low | 39.8 | Very low | 106 Ų | 106 | 146.2 Ų | 146.2 | 88% | 0.876 | 82% | 0.815 | S | S | * | * | trans | -63.8 | 144.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 78 | A | 33.5 | Very low | 39.6 | Very low | 103 Ų | 103 | 148.9 Ų | 148.9 | 85% | 0.851 | 82% | 0.822 | S | S | * | * | 178.9 | 132 | 128.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 79 | R | 34.9 | Very low | 39.4 | Very low | 229 Ų | 229 | 147.1 Ų | 147.1 | 86% | 0.864 | 82% | 0.823 | S | S | * | * | trans | -108.2 | 177.3 | 162.6 | -150.2 | -160.5 | 166.9 | 176.5 | -1.9 | 105.8 | ||||
| 80 | P | 49.5 | Very low | 39.7 | Very low | 101 Ų | 101 | 152.1 Ų | 152.1 | 66% | 0.656 | 83% | 0.825 | S | S | * | * | cis | -121.4 | -155.4 | -29.8 | 10 | 19 | 0 | 0 | 0 | 109.1 | ||||
| 81 | P | 51.4 | Low | 39.9 | Very low | 113 Ų | 113 | 154.9 Ų | 154.9 | 73% | 0.734 | 83% | 0.827 | S | S | * | * | cis | -138.2 | 164.6 | 10.5 | 34.5 | -10.8 | 0 | 0 | 0 | 119.6 | ||||
| 82 | H | 47.5 | Very low | 40.1 | Very low | 174 Ų | 174 | 149.2 Ų | 149.2 | 81% | 0.806 | 82% | 0.824 | S | S | * | * | trans | 2.5 | 125.2 | 147.8 | -108.4 | -87.1 | 0 | 0 | 0 | 118.7 | ||||
| 83 | V | 39.8 | Very low | 40.8 | Very low | 144 Ų | 144 | 140 Ų | 140 | 87% | 0.873 | 81% | 0.806 | S | S | * | * | trans | -146.8 | 145.4 | 140.5 | -113 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 84 | R | 42.9 | Very low | 41.1 | Very low | 231 Ų | 231 | 146.8 Ų | 146.8 | 87% | 0.872 | 81% | 0.812 | S | S | * | * | trans | -56.7 | 137.4 | -166.4 | -76.9 | 161.6 | 146.6 | 131.5 | -6.3 | 114.4 | ||||
| 85 | S | 39 | Very low | 41.9 | Very low | 103 Ų | 103 | 146.1 Ų | 146.1 | 72% | 0.72 | 81% | 0.813 | S | S | * | * | trans | -77.2 | 121.7 | 159.2 | -168.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 86 | L | 40.3 | Very low | 41.9 | Very low | 169 Ų | 169 | 142.1 Ų | 142.1 | 89% | 0.885 | 80% | 0.795 | S | S | * | * | trans | -118.1 | 112.1 | 157.5 | -70 | 176.4 | 0 | 0 | 0 | 105.4 | ||||
| 87 | S | 42.6 | Very low | 43.1 | Very low | 96 Ų | 96 | 143.9 Ų | 143.9 | 67% | 0.671 | 79% | 0.794 | S | S | * | * | trans | -107.1 | 140.2 | 167.7 | -64.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 88 | D | 35.9 | Very low | 43.2 | Very low | 151 Ų | 151 | 147.8 Ų | 147.8 | 81% | 0.807 | 79% | 0.787 | S | S | * | * | trans | 59.1 | 94.5 | 148.2 | -69 | -21 | 0 | 0 | 0 | 120.2 | ||||
| 89 | S | 36.1 | Very low | 43.6 | Very low | 124 Ų | 124 | 146 Ų | 146 | 87% | 0.867 | 78% | 0.779 | S | S | * | * | trans | -73.4 | 124.7 | 138.7 | -168.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 90 | R | 46.8 | Very low | 44 | Very low | 232 Ų | 232 | 139.9 Ų | 139.9 | 88% | 0.875 | 78% | 0.777 | S | S | * | * | trans | -69.7 | 136.2 | 179.7 | -77.2 | 175.2 | 157.1 | -176.4 | -7.2 | 111.7 | ||||
| 91 | D | 41.6 | Very low | 43.6 | Very low | 157 Ų | 157 | 141.1 Ų | 141.1 | 84% | 0.84 | 78% | 0.783 | S | S | * | * | trans | -38.9 | 125.8 | 152.4 | -171.6 | 22.6 | 0 | 0 | 0 | 112.9 | ||||
| 92 | S | 43.1 | Very low | 43.5 | Very low | 120 Ų | 120 | 146.8 Ų | 146.8 | 84% | 0.839 | 79% | 0.789 | S | S | * | * | trans | -148.8 | 103.6 | 155.9 | -166.2 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 93 | G | 49.8 | Very low | 43.5 | Very low | 55 Ų | 55 | 149.6 Ų | 149.6 | 57% | 0.567 | 79% | 0.793 | S | S | * | * | trans | -63.5 | 158.7 | -172.8 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 94 | Y | 40.5 | Very low | 43.9 | Very low | 211 Ų | 211 | 153.2 Ų | 153.2 | 83% | 0.827 | 79% | 0.791 | S | S | * | * | trans | -161.6 | 124.1 | 134.5 | -131.2 | -101.9 | 0 | 0 | 0 | 107.2 | H96 | Y94-H96 PolarHBondContact O-N 2.87Š| ||
| 95 | L | 50.9 | Low | 44.2 | Very low | 165 Ų | 165 | 148.3 Ų | 148.3 | 86% | 0.864 | 79% | 0.787 | S | S | * | * | trans | -49.6 | 126.3 | 161.5 | -96.2 | 95.9 | 0 | 0 | 0 | 108.1 | ||||
| 96 | H | 39.3 | Very low | 44.5 | Very low | 119 Ų | 119 | 151.7 Ų | 151.7 | 55% | 0.551 | 79% | 0.791 | S | S | * | * | trans | -140.6 | 111.1 | 145 | -99.3 | 67.8 | 0 | 0 | 0 | 109.1 | Y94 Y98 | Y94-H96 PolarHBondContact O-N 2.87Å; H96-Y98 HydrophobicContact CB-CD1 4.05Å; H96-Y98 HydrophobicContact CB-CE1 3.29Å; H96-Y98 HydrophobicContact CB-CE2 3.97Å; H96-Y98 WeakPolarHBondContact CB-OH 3.4Å; H96-Y98 AromaticContact CD2-CE1 3.65Å; H96-Y98 AromaticContact CG-CE1 3.77Å; H96-Y98 WeakPolarHBondContact O-CE2 3.41Å; H96-Y98 PolarHBondContact O-N 3.24Å | ||
| 97 | S | 59.3 | Low | 45.1 | Very low | 118 Ų | 118 | 149 Ų | 149 | 83% | 0.825 | 79% | 0.786 | S | S | * | * | trans | -53.9 | 113.8 | 156.3 | 178 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 98 | Y | 42.4 | Very low | 45.5 | Very low | 189 Ų | 189 | 150.9 Ų | 150.9 | 74% | 0.741 | 79% | 0.794 | S | S | * | * | trans | -135.5 | 133.2 | 155.3 | -9.4 | -96.2 | 0 | 0 | 0 | 108 | H96 | H96-Y98 HydrophobicContact CB-CD1 4.05Å; H96-Y98 HydrophobicContact CB-CE1 3.29Å; H96-Y98 HydrophobicContact CB-CE2 3.97Å; H96-Y98 WeakPolarHBondContact CB-OH 3.4Å; H96-Y98 AromaticContact CD2-CE1 3.65Å; H96-Y98 AromaticContact CG-CE1 3.77Å; H96-Y98 WeakPolarHBondContact O-CE2 3.41Å; H96-Y98 PolarHBondContact O-N 3.24Å | ||
| 99 | G | 41.5 | Very low | 45.7 | Very low | 66 Ų | 66 | 147 Ų | 147 | 68% | 0.68 | 79% | 0.789 | S | S | * | * | trans | -58.2 | 145.8 | -164.9 | 0 | 0 | 0 | 0 | 0 | 114 | V101 | G99-V101 PolarHBondContact O-N 2.77Š| ||
| 100 | A | 44 | Very low | 46 | Very low | 99 Ų | 99 | 147.7 Ų | 147.7 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | -49.1 | 109.8 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | R102 | A100-R102 PolarHBondContact O-N 3.17Š| ||
| 101 | V | 41.8 | Very low | 45.6 | Very low | 127 Ų | 127 | 140.1 Ų | 140.1 | 77% | 0.77 | 78% | 0.782 | S | S | * | * | trans | -65.9 | 90.8 | 160.1 | 174.3 | 0 | 0 | 0 | 0 | 106.1 | G99 R103 | G99-V101 PolarHBondContact O-N 2.77Å; V101-R103 VanDerWaalsContact C-N 3.34Å; V101-R103 HydrophobicContact CG1-CG 4.24Å; V101-R103 PolarHBondContact O-N 2.92Å | ||
| 102 | R | 47.9 | Very low | 45.6 | Very low | 233 Ų | 233 | 138.9 Ų | 138.9 | 88% | 0.879 | 78% | 0.78 | S | S | * | * | trans | -58.8 | 105.5 | 154.5 | -77.1 | -168.5 | 175.1 | -137.1 | 1.6 | 105.7 | A100 R104 | A100-R102 PolarHBondContact O-N 3.17Å; R102-R104 PolarHBondContact O-N 3.37Å | ||
| 103 | R | 48.8 | Very low | 45.3 | Very low | 232 Ų | 232 | 142.1 Ų | 142.1 | 88% | 0.875 | 78% | 0.782 | S | S | * | * | trans | -64.9 | 92.7 | 160.2 | -69.2 | -165.5 | -170.6 | -150.6 | 4.4 | 106.5 | V101 T105 | V101-R103 VanDerWaalsContact C-N 3.34Å; V101-R103 HydrophobicContact CG1-CG 4.24Å; V101-R103 PolarHBondContact O-N 2.92Å; R103-T105 PolarHBondContact O-N 3.44Å; R103-T105 VanDerWaalsContact O-N 3.11Å | ||
| 104 | R | 47.6 | Very low | 45.1 | Very low | 221 Ų | 221 | 148.3 Ų | 148.3 | 83% | 0.834 | 80% | 0.796 | S | S | * | * | trans | -56.8 | 106.6 | 163.4 | 179.5 | -176.4 | -86.7 | 170.7 | -8.1 | 105.8 | R102 Q106 | R102-R104 PolarHBondContact O-N 3.37Å; R104-Q106 PolarHBondContact O-N 2.87Å; R104-Q106 VanDerWaalsContact O-N 3.1Å | ||
| 105 | T | 48.6 | Very low | 45.3 | Very low | 128 Ų | 128 | 147.6 Ų | 147.6 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -60.1 | 111 | 165.1 | 44.9 | 0 | 0 | 0 | 0 | 106.4 | R103 S107 | R103-T105 PolarHBondContact O-N 3.44Å; R103-T105 VanDerWaalsContact O-N 3.11Å; T105-S107 PolarHBondContact O-N 3.35Å; T105-S107 VanDerWaalsContact O-N 3.1Å | ||
| 106 | Q | 45.4 | Very low | 44.9 | Very low | 174 Ų | 174 | 143.2 Ų | 143.2 | 81% | 0.813 | 80% | 0.795 | S | S | * | * | trans | -71 | 103 | 168.8 | -75.9 | -178.8 | 3.7 | 0 | 0 | 106.8 | R104 V108 | R104-Q106 PolarHBondContact O-N 2.87Å; R104-Q106 VanDerWaalsContact O-N 3.1Å; Q106-V108 PolarHBondContact O-N 3.41Å | ||
| 107 | S | 53.8 | Low | 45.2 | Very low | 112 Ų | 112 | 143.2 Ų | 143.2 | 78% | 0.783 | 80% | 0.803 | S | S | * | * | trans | -63.5 | 113.4 | 158.9 | 48.1 | 0 | 0 | 0 | 0 | 107.9 | T105 G109 | T105-S107 PolarHBondContact O-N 3.35Å; T105-S107 VanDerWaalsContact O-N 3.1Å; S107-G109 PolarHBondContact O-N 2.78Å | ||
| 108 | V | 50.2 | Low | 44.5 | Very low | 136 Ų | 136 | 145.2 Ų | 145.2 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | trans | -79.4 | 105.9 | 167.8 | -166.9 | 0 | 0 | 0 | 0 | 105.8 | Q106 | Q106-V108 PolarHBondContact O-N 3.41Š| ||
| 109 | G | 40.1 | Very low | 44.6 | Very low | 68 Ų | 68 | 142.5 Ų | 142.5 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | trans | -69.6 | 129.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | S107 G111 | S107-G109 PolarHBondContact O-N 2.78Å; G109-G111 PolarHBondContact O-N 3.18Å | ||
| 110 | V | 43.1 | Very low | 45 | Very low | 140 Ų | 140 | 147.6 Ų | 147.6 | 85% | 0.848 | 81% | 0.809 | S | S | * | * | trans | -68.2 | 109.7 | 167.7 | 173.5 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 111 | G | 38.7 | Very low | 44.9 | Very low | 73 Ų | 73 | 150.5 Ų | 150.5 | 75% | 0.753 | 81% | 0.811 | S | S | * | * | trans | -90 | 109.8 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | G109 | G109-G111 PolarHBondContact O-N 3.18Š| ||
| 112 | T | 40.4 | Very low | 45.3 | Very low | 131 Ų | 131 | 150 Ų | 150 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | trans | -74.5 | 117.7 | 160.5 | 42.5 | 0 | 0 | 0 | 0 | 108 | ||||
| 113 | Q | 36.6 | Very low | 45.3 | Very low | 188 Ų | 188 | 142.4 Ų | 142.4 | 88% | 0.879 | 80% | 0.802 | S | S | * | * | trans | -123.1 | 112.9 | 168.8 | -166.9 | 168 | 22.9 | 0 | 0 | 107.4 | ||||
| 114 | E | 46.1 | Very low | 45.3 | Very low | 185 Ų | 185 | 139.7 Ų | 139.7 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | trans | -91.9 | 124 | 171.5 | -61.5 | 177.9 | 179.4 | 0 | 0 | 108.4 | ||||
| 115 | E | 44.3 | Very low | 45.4 | Very low | 195 Ų | 195 | 138.4 Ų | 138.4 | 91% | 0.911 | 80% | 0.803 | S | S | * | * | trans | -162.5 | 148.3 | 146.2 | -66 | -159 | 165.7 | 0 | 0 | 104 | ||||
| 116 | G | 42.8 | Very low | 45.6 | Very low | 73 Ų | 73 | 141.2 Ų | 141.2 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | cis | 174.8 | 138.8 | 6.3 | 0 | 0 | 0 | 0 | 0 | 103.6 | ||||
| 117 | V | 45.8 | Very low | 46 | Very low | 120 Ų | 120 | 141.9 Ų | 141.9 | 73% | 0.727 | 81% | 0.81 | S | S | * | * | trans | -74.9 | 144.7 | -178.6 | 178.2 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 118 | D | 43.8 | Very low | 46 | Very low | 159 Ų | 159 | 142.6 Ų | 142.6 | 85% | 0.85 | 81% | 0.805 | S | S | * | * | -169.4 | 133.8 | 125.3 | -84.1 | -24.8 | 0 | 0 | 0 | 111.3 | |||||
| 119 | D | 46.1 | Very low | 46.2 | Very low | 132 Ų | 132 | 139 Ų | 139 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | -46.5 | 165.6 | 171.6 | -70.8 | -59.5 | 0 | 0 | 0 | 114 | ||||
| 120 | E | 48.5 | Very low | 47.1 | Very low | 174 Ų | 174 | 143.8 Ų | 143.8 | 81% | 0.813 | 80% | 0.8 | S | S | * | * | cis | -174.2 | 145.7 | 21.9 | -125.9 | 163.4 | -147.4 | 0 | 0 | 103.4 | ||||
| 121 | D | 42.2 | Very low | 47.9 | Very low | 159 Ų | 159 | 143.2 Ų | 143.2 | 85% | 0.85 | 79% | 0.788 | S | S | * | * | trans | -171.2 | 138 | 131.2 | -155.3 | 9.1 | 0 | 0 | 0 | 111.3 | ||||
| 122 | T | 51.3 | Low | 49.2 | Very low | 116 Ų | 116 | 142.6 Ų | 142.6 | 71% | 0.712 | 78% | 0.777 | S | S | * | * | trans | -85.7 | 128.6 | -170.4 | -53.3 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 123 | G | 47 | Very low | 50.6 | Low | 74 Ų | 74 | 142.4 Ų | 142.4 | 76% | 0.763 | 77% | 0.767 | S | S | * | * | trans | -160.5 | 76.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | E125 | G123-E125 PolarHBondContact O-N 3.21Š| ||
| 124 | E | 49.3 | Very low | 52.3 | Low | 176 Ų | 176 | 139.4 Ų | 139.4 | 82% | 0.822 | 75% | 0.752 | S | S | * | * | trans | -64 | 107.5 | 170.5 | -65.1 | 172.7 | 173.9 | 0 | 0 | 109.1 | ||||
| 125 | E | 49.5 | Very low | 54 | Low | 193 Ų | 193 | 134 Ų | 134 | 90% | 0.902 | 73% | 0.732 | S | S | * | * | trans | -125.5 | 94.4 | 148.4 | -70.1 | -157.8 | -179.1 | 0 | 0 | 107 | G123 | G123-E125 PolarHBondContact O-N 3.21Š| ||
| 126 | E | 53.7 | Low | 55.9 | Low | 187 Ų | 187 | 133.2 Ų | 133.2 | 87% | 0.874 | 72% | 0.721 | S | S | * | * | trans | -82.8 | 113.9 | 164.8 | -70.4 | -153.3 | 169.5 | 0 | 0 | 109 | ||||
| 127 | E | 53.5 | Low | 58.1 | Low | 188 Ų | 188 | 134.7 Ų | 134.7 | 88% | 0.879 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -167.7 | 137.6 | 136.9 | -100.1 | 172.5 | -169.5 | 0 | 0 | 106.2 | ||
| 128 | D | 53.5 | Low | 60.1 | Low | 127 Ų | 127 | 132.8 Ų | 132.8 | 68% | 0.679 | 69% | 0.694 | S | S | * | * | trans | 85.7 | 34.1 | -175.1 | -69.5 | -18.8 | 0 | 0 | 0 | 119.8 | ||||
| 129 | G | 54.8 | Low | 62.3 | Low | 62 Ų | 62 | 130.8 Ų | 130.8 | 64% | 0.639 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -72.4 | -27.3 | 170.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 130 | E | 58.5 | Low | 64.5 | Low | 167 Ų | 167 | 129.2 Ų | 129.2 | 78% | 0.78 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -81.4 | -38.4 | -176 | -69.1 | -177.9 | 165.4 | 0 | 0 | 112.8 | A132 E133 E134 | E130-A132 VanDerWaalsContact C-N 3.34Å; E130-A132 PolarHBondContact O-N 3.37Å; E130-E133 PolarHBondContact O-N 2.88Å; E130-E134 PolarHBondContact O-N 3.5Å |
| 131 | E | 60.1 | Low | 66.6 | Low | 128 Ų | 128 | 128.6 Ų | 128.6 | 60% | 0.598 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -66.3 | -35.1 | 175.5 | -95.8 | -148.9 | 170.1 | 0 | 0 | 112.2 | E133 T135 | E131-E133 VanDerWaalsContact C-N 3.33Å; E131-E133 PolarHBondContact O-N 3.29Å; E131-T135 WeakPolarHBondContact O-CB 3.41Å; E131-T135 WeakPolarHBondContact O-CG2 3.27Å; E131-T135 PolarHBondContact O-N 3.03Å; E131-T135 PolarHBondContact O-OG1 3.37Å |
| 132 | A | 64.9 | Low | 69 | Low | 61 Ų | 61 | 123.8 Ų | 123.8 | 50% | 0.504 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -69.3 | -30.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | E130 T135 R136 | E130-A132 VanDerWaalsContact C-N 3.34Å; E130-A132 PolarHBondContact O-N 3.37Å; A132-T135 WeakPolarHBondContact CA-OG1 3.34Å; A132-T135 PolarHBondContact O-OG1 2.95Å; A132-R136 WeakPolarHBondContact O-CB 3.47Å; A132-R136 PolarHBondContact O-N 2.86Å |
| 133 | E | 69.4 | Low | 71.1 | Confident | 127 Ų | 127 | 120.3 Ų | 120.3 | 59% | 0.593 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -76 | -46.4 | 174.4 | -169.5 | 173.8 | -162.5 | 0 | 0 | 111.2 | E130 E131 T135 R136 E137 | E130-E133 PolarHBondContact O-N 2.88Å; E131-E133 VanDerWaalsContact C-N 3.33Å; E131-E133 PolarHBondContact O-N 3.29Å; E133-T135 PolarHBondContact O-N 2.96Å; E133-R136 WeakPolarHBondContact O-CB 3.37Å; E133-R136 PolarHBondContact O-N 2.93Å; E133-E137 WeakPolarHBondContact O-CG 3.46Å; E133-E137 PolarHBondContact O-N 3.33Å |
| 134 | E | 73.4 | Confident | 73.5 | Confident | 124 Ų | 124 | 120.7 Ų | 120.7 | 58% | 0.579 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -60.9 | -44.9 | 177.4 | -174.9 | 174.2 | -168.1 | 0 | 0 | 112 | E130 R136 E137 D138 | E130-E134 PolarHBondContact O-N 3.5Å; E134-R136 VanDerWaalsContact C-N 3.31Å; E134-R136 PolarHBondContact O-N 3.46Å; E134-E137 PolarHBondContact O-N 3.5Å; E134-D138 PolarHBondContact O-N 3.02Å |
| 135 | T | 81.8 | Confident | 75.7 | Confident | 72 Ų | 72 | 113.3 Ų | 113.3 | 44% | 0.442 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -64.4 | -34.3 | 176.6 | 53.2 | 0 | 0 | 0 | 0 | 112.6 | E131 A132 E133 I139 | E131-T135 WeakPolarHBondContact O-CB 3.41Å; E131-T135 WeakPolarHBondContact O-CG2 3.27Å; E131-T135 PolarHBondContact O-N 3.03Å; E131-T135 PolarHBondContact O-OG1 3.37Å; A132-T135 WeakPolarHBondContact CA-OG1 3.34Å; A132-T135 PolarHBondContact O-OG1 2.95Å; E133-T135 PolarHBondContact O-N 2.96Å; T135-I139 WeakPolarHBondContact O-CD1 3.34Å; T135-I139 VanDerWaalsContact O-CG1 3.23Å; T135-I139 WeakPolarHBondContact O-CG1 3.43Å; T135-I139 PolarHBondContact O-N 2.73Å |
| 136 | R | 84.8 | Confident | 77.9 | Confident | 178 Ų | 178 | 107 Ų | 107 | 67% | 0.672 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -68 | -42.4 | 174.1 | -179.9 | 177.4 | 173.7 | 171.6 | -3.1 | 111.5 | A132 E133 E134 D138 I139 L140 | A132-R136 WeakPolarHBondContact O-CB 3.47Å; A132-R136 PolarHBondContact O-N 2.86Å; E133-R136 WeakPolarHBondContact O-CB 3.37Å; E133-R136 PolarHBondContact O-N 2.93Å; E134-R136 VanDerWaalsContact C-N 3.31Å; E134-R136 PolarHBondContact O-N 3.46Å; R136-D138 VanDerWaalsContact C-N 3.33Å; R136-D138 PolarHBondContact O-N 3.26Å; R136-I139 PolarHBondContact O-N 3.45Å; R136-L140 HydrophobicContact CG-CD1 4.32Å; R136-L140 VanDerWaalsContact O-CG 3.28Å; R136-L140 WeakPolarHBondContact O-CG 3.19Å; R136-L140 PolarHBondContact O-N 2.89Å |
| 137 | E | 88.2 | Confident | 80 | Confident | 104 Ų | 104 | 102.6 Ų | 102.6 | 49% | 0.486 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.6 | -40.2 | 175 | -71.7 | -167.8 | 163.1 | 0 | 0 | 112.4 | E133 E134 L140 R141 | E133-E137 WeakPolarHBondContact O-CG 3.46Å; E133-E137 PolarHBondContact O-N 3.33Å; E134-E137 PolarHBondContact O-N 3.5Å; E137-L140 PolarHBondContact O-N 3.48Å; E137-R141 VanDerWaalsContact O-CB 3.31Å; E137-R141 WeakPolarHBondContact O-CB 3.39Å; E137-R141 PolarHBondContact O-N 3.36Å |
| 138 | D | 87.9 | Confident | 82.1 | Confident | 80 Ų | 80 | 99.7 Ų | 99.7 | 43% | 0.428 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.7 | -40 | 176.8 | -87.8 | -15.7 | 0 | 0 | 0 | 112.8 | E134 R136 R141 A142 | E134-D138 PolarHBondContact O-N 3.02Å; R136-D138 VanDerWaalsContact C-N 3.33Å; R136-D138 PolarHBondContact O-N 3.26Å; D138-R141 PolarHBondContact O-N 2.69Å; D138-R141 IonicContact OD1-NH1 3.86Å; D138-A142 WeakPolarHBondContact O-CB 2.94Å; D138-A142 PolarHBondContact O-N 3.15Å |
| 139 | I | 90.4 | Very high | 84.2 | Confident | 118 Ų | 118 | 101.5 Ų | 101.5 | 61% | 0.605 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.4 | -44.2 | 173.8 | -69 | 164.9 | 0 | 0 | 0 | 110.5 | T135 R136 A142 A143 | T135-I139 WeakPolarHBondContact O-CD1 3.34Å; T135-I139 VanDerWaalsContact O-CG1 3.23Å; T135-I139 WeakPolarHBondContact O-CG1 3.43Å; T135-I139 PolarHBondContact O-N 2.73Å; R136-I139 PolarHBondContact O-N 3.45Å; I139-A142 PolarHBondContact O-N 3.03Å; I139-A143 WeakPolarHBondContact O-CB 3.4Å; I139-A143 PolarHBondContact O-N 3.3Å |
| 140 | L | 91.7 | Very high | 86.3 | Confident | 99 Ų | 99 | 107 Ų | 107 | 52% | 0.518 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.9 | -44.7 | 176.5 | -71.8 | 172.6 | 0 | 0 | 0 | 111.2 | R136 E137 A142 A143 D144 | R136-L140 HydrophobicContact CG-CD1 4.32Å; R136-L140 VanDerWaalsContact O-CG 3.28Å; R136-L140 WeakPolarHBondContact O-CG 3.19Å; R136-L140 PolarHBondContact O-N 2.89Å; E137-L140 PolarHBondContact O-N 3.48Å; L140-A142 PolarHBondContact O-N 3.39Å; L140-A143 PolarHBondContact O-N 3.48Å; L140-D144 WeakPolarHBondContact O-CB 3.38Å; L140-D144 PolarHBondContact O-N 2.92Å |
| 141 | R | 92 | Very high | 88.1 | Confident | 160 Ų | 160 | 105 Ų | 105 | 60% | 0.604 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.7 | -41.2 | 176.9 | -170 | -176.3 | -63.2 | 162.9 | 1.4 | 112 | E137 D138 G145 | E137-R141 VanDerWaalsContact O-CB 3.31Å; E137-R141 WeakPolarHBondContact O-CB 3.39Å; E137-R141 PolarHBondContact O-N 3.36Å; D138-R141 PolarHBondContact O-N 2.69Å; D138-R141 IonicContact OD1-NH1 3.86Å; R141-G145 PolarHBondContact O-N 2.98Å |
| 142 | A | 93.4 | Very high | 89.9 | Confident | 58 Ų | 58 | 101.5 Ų | 101.5 | 48% | 0.479 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.7 | -39.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | D138 I139 L140 T146 | D138-A142 WeakPolarHBondContact O-CB 2.94Å; D138-A142 PolarHBondContact O-N 3.15Å; I139-A142 PolarHBondContact O-N 3.03Å; L140-A142 PolarHBondContact O-N 3.39Å; A142-T146 WeakPolarHBondContact O-CB 3.48Å; A142-T146 PolarHBondContact O-N 3.01Å; A142-T146 PolarHBondContact O-OG1 3.35Å |
| 143 | A | 95.6 | Very high | 91.5 | Very high | 43 Ų | 43 | 104.8 Ų | 104.8 | 36% | 0.355 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64 | -47.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | I139 L140 T146 M147 | I139-A143 WeakPolarHBondContact O-CB 3.4Å; I139-A143 PolarHBondContact O-N 3.3Å; L140-A143 PolarHBondContact O-N 3.48Å; A143-T146 CarbonylContact O-C 2.83Å; A143-T146 WeakPolarHBondContact O-CA 3.42Å; A143-T146 WeakPolarHBondContact O-CB 3.44Å; A143-T146 PolarHBondContact O-N 3.34Å; A143-T146 VanDerWaalsContact O-N 3.08Å; A143-M147 WeakPolarHBondContact O-CG 3.39Å; A143-M147 PolarHBondContact O-N 3.47Å |
| 144 | D | 96.3 | Very high | 92.9 | Very high | 83 Ų | 83 | 102.9 Ų | 102.9 | 44% | 0.444 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 176 | -85.4 | -6.2 | 0 | 0 | 0 | 111.7 | L140 T146 M147 Q148 | L140-D144 WeakPolarHBondContact O-CB 3.38Å; L140-D144 PolarHBondContact O-N 2.92Å; D144-T146 PolarHBondContact O-N 3.01Å; D144-M147 PolarHBondContact O-N 3.36Å; D144-M147 WeakPolarHBondContact OD1-CE 3.31Å; D144-Q148 WeakPolarHBondContact O-CB 3.42Å; D144-Q148 VanDerWaalsContact O-CG 3.22Å; D144-Q148 WeakPolarHBondContact O-CG 3.43Å; D144-Q148 PolarHBondContact O-N 3.34Å |
| 145 | G | 96.1 | Very high | 94.1 | Very high | 21 Ų | 21 | 100.7 Ų | 100.7 | 22% | 0.216 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -62.4 | -28.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113 | R141 R149 | R141-G145 PolarHBondContact O-N 2.98Å; G145-R149 WeakPolarHBondContact O-CG 3.49Å; G145-R149 PolarHBondContact O-N 3.49Å; G145-R149 PolarHBondContact O-NE 3.27Å |
| 146 | T | 96.5 | Very high | 94.9 | Very high | 60 Ų | 60 | 101.7 Ų | 101.7 | 37% | 0.368 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -77.4 | -41.8 | 174.9 | -55.3 | 0 | 0 | 0 | 0 | 111.5 | A142 A143 D144 R149 R150 | A142-T146 WeakPolarHBondContact O-CB 3.48Å; A142-T146 PolarHBondContact O-N 3.01Å; A142-T146 PolarHBondContact O-OG1 3.35Å; A143-T146 CarbonylContact O-C 2.83Å; A143-T146 WeakPolarHBondContact O-CA 3.42Å; A143-T146 WeakPolarHBondContact O-CB 3.44Å; A143-T146 PolarHBondContact O-N 3.34Å; A143-T146 VanDerWaalsContact O-N 3.08Å; D144-T146 PolarHBondContact O-N 3.01Å; T146-R149 PolarHBondContact O-N 2.85Å; T146-R149 PolarHBondContact OG1-NH2 3.12Å; T146-R150 WeakPolarHBondContact O-CG 3.43Å; T146-R150 PolarHBondContact O-N 2.72Å; T146-R150 VanDerWaalsContact O-N 3.09Å |
| 147 | M | 97.4 | Very high | 95.5 | Very high | 95 Ų | 95 | 98 Ų | 98 | 47% | 0.468 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -45.2 | 174 | -72.1 | -170.2 | -71.2 | 0 | 0 | 111.3 | A143 D144 R149 R150 L151 | A143-M147 WeakPolarHBondContact O-CG 3.39Å; A143-M147 PolarHBondContact O-N 3.47Å; D144-M147 PolarHBondContact O-N 3.36Å; D144-M147 WeakPolarHBondContact OD1-CE 3.31Å; M147-R149 PolarHBondContact O-N 3.25Å; M147-R150 PolarHBondContact O-N 2.97Å; M147-R150 VanDerWaalsContact O-N 3.15Å; M147-L151 WeakPolarHBondContact O-CB 3.34Å; M147-L151 WeakPolarHBondContact O-CG 3.24Å; M147-L151 PolarHBondContact O-N 3.41Å |
| 148 | Q | 97.5 | Very high | 96 | Very high | 127 Ų | 127 | 97.8 Ų | 97.8 | 59% | 0.593 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -59.3 | -42.6 | 176.5 | -74 | 167.8 | 2 | 0 | 0 | 112.1 | D144 R150 L151 A152 | D144-Q148 WeakPolarHBondContact O-CB 3.42Å; D144-Q148 VanDerWaalsContact O-CG 3.22Å; D144-Q148 WeakPolarHBondContact O-CG 3.43Å; D144-Q148 PolarHBondContact O-N 3.34Å; Q148-R150 PolarHBondContact O-N 3.28Å; Q148-L151 PolarHBondContact O-N 3.47Å; Q148-A152 WeakPolarHBondContact O-CB 3.46Å; Q148-A152 PolarHBondContact O-N 3.15Å |
| 149 | R | 97.7 | Very high | 96.5 | Very high | 164 Ų | 164 | 96.5 Ų | 96.5 | 62% | 0.619 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -62.4 | -41.8 | 174.3 | -82.5 | 177.5 | -78.2 | 144.2 | -4.9 | 112.6 | G145 T146 M147 K153 | G145-R149 WeakPolarHBondContact O-CG 3.49Å; G145-R149 PolarHBondContact O-N 3.49Å; G145-R149 PolarHBondContact O-NE 3.27Å; T146-R149 PolarHBondContact O-N 2.85Å; T146-R149 PolarHBondContact OG1-NH2 3.12Å; M147-R149 PolarHBondContact O-N 3.25Å; R149-K153 WeakPolarHBondContact O-CB 3.43Å; R149-K153 PolarHBondContact O-N 2.98Å |
| 150 | R | 97.9 | Very high | 96.9 | Very high | 179 Ų | 179 | 98.8 Ų | 98.8 | 68% | 0.675 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.9 | -42.6 | 176.4 | -71 | 176.8 | 66 | -164 | -0.7 | 111.6 | T146 M147 Q148 K153 V154 | T146-R150 WeakPolarHBondContact O-CG 3.43Å; T146-R150 PolarHBondContact O-N 2.72Å; T146-R150 VanDerWaalsContact O-N 3.09Å; M147-R150 PolarHBondContact O-N 2.97Å; M147-R150 VanDerWaalsContact O-N 3.15Å; Q148-R150 PolarHBondContact O-N 3.28Å; R150-K153 PolarHBondContact O-N 3.01Å; R150-V154 WeakPolarHBondContact O-CG2 3.47Å; R150-V154 PolarHBondContact O-N 3.38Å |
| 151 | L | 98.1 | Very high | 97.2 | Very high | 123 Ų | 123 | 97 Ų | 97 | 64% | 0.644 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.9 | -45.7 | 175.6 | -73.7 | 172 | 0 | 0 | 0 | 111.4 | M147 Q148 K153 V154 S155 | M147-L151 WeakPolarHBondContact O-CB 3.34Å; M147-L151 WeakPolarHBondContact O-CG 3.24Å; M147-L151 PolarHBondContact O-N 3.41Å; Q148-L151 PolarHBondContact O-N 3.47Å; L151-K153 VanDerWaalsContact C-N 3.34Å; L151-K153 PolarHBondContact O-N 3.05Å; L151-V154 PolarHBondContact O-N 2.94Å; L151-S155 WeakPolarHBondContact O-CB 3.37Å; L151-S155 PolarHBondContact O-N 3.43Å |
| 152 | A | 97.9 | Very high | 97.5 | Very high | 56 Ų | 56 | 93.5 Ų | 93.5 | 46% | 0.463 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.9 | -44.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q148 S155 T156 | Q148-A152 WeakPolarHBondContact O-CB 3.46Å; Q148-A152 PolarHBondContact O-N 3.15Å; A152-S155 WeakPolarHBondContact O-CB 3.36Å; A152-S155 PolarHBondContact O-N 3.35Å; A152-T156 WeakPolarHBondContact O-CG2 3.32Å; A152-T156 PolarHBondContact O-N 3.47Å; A152-T156 PolarHBondContact O-OG1 3.02Å |
| 153 | K | 98.2 | Very high | 97.7 | Very high | 129 Ų | 129 | 94.5 Ų | 94.5 | 56% | 0.561 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.4 | -51.5 | 176.5 | -175.6 | 174.8 | 176.1 | 178.2 | 0 | 111.7 | R149 R150 L151 S155 T156 E157 | R149-K153 WeakPolarHBondContact O-CB 3.43Å; R149-K153 PolarHBondContact O-N 2.98Å; R150-K153 PolarHBondContact O-N 3.01Å; L151-K153 VanDerWaalsContact C-N 3.34Å; L151-K153 PolarHBondContact O-N 3.05Å; K153-S155 VanDerWaalsContact C-N 3.28Å; K153-S155 PolarHBondContact O-N 3.11Å; K153-T156 PolarHBondContact O-N 2.99Å; K153-T156 VanDerWaalsContact O-N 3.17Å; K153-T156 PolarHBondContact O-OG1 3.02Å; K153-E157 WeakPolarHBondContact CE-OE1 3.44Å; K153-E157 IonicContact NZ-OE1 3.56Å; K153-E157 WeakPolarHBondContact O-CG 3.43Å; K153-E157 PolarHBondContact O-N 3.01Å |
| 154 | V | 98.4 | Very high | 97.9 | Very high | 88 Ų | 88 | 96.5 Ų | 96.5 | 53% | 0.533 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.7 | -39 | 177.4 | 173 | 0 | 0 | 0 | 0 | 111.3 | R150 L151 T156 E157 L158 | R150-V154 WeakPolarHBondContact O-CG2 3.47Å; R150-V154 PolarHBondContact O-N 3.38Å; L151-V154 PolarHBondContact O-N 2.94Å; V154-T156 PolarHBondContact O-N 3.5Å; V154-E157 PolarHBondContact O-N 3.47Å; V154-L158 VanDerWaalsContact O-CB 3.27Å; V154-L158 WeakPolarHBondContact O-CB 3.44Å; V154-L158 PolarHBondContact O-N 2.93Å |
| 155 | S | 98.2 | Very high | 98 | Very high | 77 Ų | 77 | 96.3 Ų | 96.3 | 54% | 0.538 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 176.1 | -174.7 | 0 | 0 | 0 | 0 | 112.2 | L151 A152 K153 A159 | L151-S155 WeakPolarHBondContact O-CB 3.37Å; L151-S155 PolarHBondContact O-N 3.43Å; A152-S155 WeakPolarHBondContact O-CB 3.36Å; A152-S155 PolarHBondContact O-N 3.35Å; K153-S155 VanDerWaalsContact C-N 3.28Å; K153-S155 PolarHBondContact O-N 3.11Å; S155-A159 WeakPolarHBondContact O-CB 3.41Å; S155-A159 PolarHBondContact O-N 3.48Å |
| 156 | T | 98.2 | Very high | 98.1 | Very high | 94 Ų | 94 | 100.3 Ų | 100.3 | 58% | 0.577 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -71.3 | -37.6 | 177.4 | 58 | 0 | 0 | 0 | 0 | 112.5 | A152 K153 V154 A159 R160 | A152-T156 WeakPolarHBondContact O-CG2 3.32Å; A152-T156 PolarHBondContact O-N 3.47Å; A152-T156 PolarHBondContact O-OG1 3.02Å; K153-T156 PolarHBondContact O-N 2.99Å; K153-T156 VanDerWaalsContact O-N 3.17Å; K153-T156 PolarHBondContact O-OG1 3.02Å; V154-T156 PolarHBondContact O-N 3.5Å; T156-A159 PolarHBondContact O-N 2.93Å; T156-R160 WeakPolarHBondContact O-CB 3.43Å; T156-R160 PolarHBondContact O-N 3.38Å |
| 157 | E | 98.4 | Very high | 98.2 | Very high | 99 Ų | 99 | 100.9 Ų | 100.9 | 46% | 0.463 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.9 | -43.9 | 175.1 | -73.7 | 175.8 | -177.5 | 0 | 0 | 110.7 | K153 V154 R160 T161 | K153-E157 WeakPolarHBondContact CE-OE1 3.44Å; K153-E157 IonicContact NZ-OE1 3.56Å; K153-E157 WeakPolarHBondContact O-CG 3.43Å; K153-E157 PolarHBondContact O-N 3.01Å; V154-E157 PolarHBondContact O-N 3.47Å; E157-R160 PolarHBondContact O-N 3.36Å; E157-T161 WeakPolarHBondContact O-CG2 3.41Å; E157-T161 PolarHBondContact O-N 3.35Å; E157-T161 PolarHBondContact O-OG1 3.41Å |
| 158 | L | 98.4 | Very high | 98.2 | Very high | 101 Ų | 101 | 102.6 Ų | 102.6 | 53% | 0.529 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60 | -49.4 | 175.7 | -177.9 | 62.7 | 0 | 0 | 0 | 111.5 | V154 R160 T161 D162 | V154-L158 VanDerWaalsContact O-CB 3.27Å; V154-L158 WeakPolarHBondContact O-CB 3.44Å; V154-L158 PolarHBondContact O-N 2.93Å; L158-R160 VanDerWaalsContact C-N 3.3Å; L158-R160 PolarHBondContact O-N 2.93Å; L158-T161 WeakPolarHBondContact CA-OG1 3.4Å; L158-T161 PolarHBondContact O-N 3.28Å; L158-T161 PolarHBondContact O-OG1 3.42Å; L158-D162 PolarHBondContact O-N 3.05Å |
| 159 | A | 98.2 | Very high | 98.3 | Very high | 53 Ų | 53 | 103.5 Ų | 103.5 | 44% | 0.438 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.9 | -41.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | S155 T156 D162 T163 | S155-A159 WeakPolarHBondContact O-CB 3.41Å; S155-A159 PolarHBondContact O-N 3.48Å; T156-A159 PolarHBondContact O-N 2.93Å; A159-D162 PolarHBondContact O-N 3.41Å; A159-T163 WeakPolarHBondContact O-CG2 3.37Å; A159-T163 PolarHBondContact O-N 3.41Å; A159-T163 VanDerWaalsContact O-N 3.12Å |
| 160 | R | 98.4 | Very high | 98.3 | Very high | 166 Ų | 166 | 98.3 Ų | 98.3 | 63% | 0.626 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.1 | -49.8 | 174.9 | -179.7 | -179.8 | 171.3 | 168.1 | 1.1 | 111.2 | T156 E157 L158 D162 T163 E164 | T156-R160 WeakPolarHBondContact O-CB 3.43Å; T156-R160 PolarHBondContact O-N 3.38Å; E157-R160 PolarHBondContact O-N 3.36Å; L158-R160 VanDerWaalsContact C-N 3.3Å; L158-R160 PolarHBondContact O-N 2.93Å; R160-D162 VanDerWaalsContact C-N 3.27Å; R160-D162 PolarHBondContact O-N 3.05Å; R160-T163 PolarHBondContact O-N 3.21Å; R160-T163 VanDerWaalsContact O-N 3.15Å; R160-T163 PolarHBondContact O-OG1 3.01Å; R160-E164 IonicContact CZ-OE1 3.47Å; R160-E164 IonicContact NE-OE1 4Å; R160-E164 PolarHBondContact NE-OE1 3.27Å; R160-E164 IonicContact NH2-OE1 2.86Å; R160-E164 PolarHBondContact NH2-OE1 2.94Å; R160-E164 PolarHBondContact O-N 3.42Å |
| 161 | T | 98.4 | Very high | 98.4 | Very high | 62 Ų | 62 | 95.8 Ų | 95.8 | 38% | 0.38 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.7 | -35.6 | 178.7 | 54 | 0 | 0 | 0 | 0 | 112.5 | E157 L158 T163 E164 L165 | E157-T161 WeakPolarHBondContact O-CG2 3.41Å; E157-T161 PolarHBondContact O-N 3.35Å; E157-T161 PolarHBondContact O-OG1 3.41Å; L158-T161 WeakPolarHBondContact CA-OG1 3.4Å; L158-T161 PolarHBondContact O-N 3.28Å; L158-T161 PolarHBondContact O-OG1 3.42Å; T161-T163 PolarHBondContact O-N 2.8Å; T161-E164 PolarHBondContact O-N 3.16Å; T161-L165 WeakPolarHBondContact O-CB 3.41Å; T161-L165 WeakPolarHBondContact O-CG 3.35Å; T161-L165 PolarHBondContact O-N 3.4Å |
| 162 | D | 98.4 | Very high | 98.4 | Very high | 85 Ų | 85 | 93.2 Ų | 93.2 | 46% | 0.455 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63 | -42.6 | 175.4 | -85.3 | -9 | 0 | 0 | 0 | 111.4 | L158 A159 R160 L165 L166 | L158-D162 PolarHBondContact O-N 3.05Å; A159-D162 PolarHBondContact O-N 3.41Å; R160-D162 VanDerWaalsContact C-N 3.27Å; R160-D162 PolarHBondContact O-N 3.05Å; D162-L165 PolarHBondContact O-N 3.28Å; D162-L166 VanDerWaalsContact O-CG 3.31Å; D162-L166 WeakPolarHBondContact O-CG 3.4Å; D162-L166 PolarHBondContact O-N 3.19Å |
| 163 | T | 98.3 | Very high | 98.4 | Very high | 80 Ų | 80 | 96.2 Ų | 96.2 | 49% | 0.491 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.8 | -40.5 | 175.9 | 61.9 | 0 | 0 | 0 | 0 | 112.6 | A159 R160 T161 L166 C167 | A159-T163 WeakPolarHBondContact O-CG2 3.37Å; A159-T163 PolarHBondContact O-N 3.41Å; A159-T163 VanDerWaalsContact O-N 3.12Å; R160-T163 PolarHBondContact O-N 3.21Å; R160-T163 VanDerWaalsContact O-N 3.15Å; R160-T163 PolarHBondContact O-OG1 3.01Å; T161-T163 PolarHBondContact O-N 2.8Å; T163-L166 PolarHBondContact O-N 3.47Å; T163-C167 PolarHBondContact O-N 2.92Å; T163-C167 PolarHBondContact O-SG 2.91Å; T163-C167 VanDerWaalsContact O-SG 3.35Å |
| 164 | E | 98.4 | Very high | 98.4 | Very high | 85 Ų | 85 | 94.8 Ų | 94.8 | 40% | 0.397 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.2 | -44.3 | 177.4 | -71.3 | 173.5 | -175.3 | 0 | 0 | 110.5 | R160 T161 L166 C167 E168 | R160-E164 IonicContact CZ-OE1 3.47Å; R160-E164 IonicContact NE-OE1 4Å; R160-E164 PolarHBondContact NE-OE1 3.27Å; R160-E164 IonicContact NH2-OE1 2.86Å; R160-E164 PolarHBondContact NH2-OE1 2.94Å; R160-E164 PolarHBondContact O-N 3.42Å; T161-E164 PolarHBondContact O-N 3.16Å; E164-L166 PolarHBondContact O-N 3.37Å; E164-C167 WeakPolarHBondContact O-CB 3.43Å; E164-C167 PolarHBondContact O-N 3.09Å; E164-E168 WeakPolarHBondContact O-CG 3.48Å; E164-E168 PolarHBondContact O-N 3.08Å |
| 165 | L | 98.6 | Very high | 98.4 | Very high | 78 Ų | 78 | 95.2 Ų | 95.2 | 41% | 0.408 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.4 | -40.3 | 175.6 | -76.5 | 171.7 | 0 | 0 | 0 | 113 | T161 D162 E168 R169 | T161-L165 WeakPolarHBondContact O-CB 3.41Å; T161-L165 WeakPolarHBondContact O-CG 3.35Å; T161-L165 PolarHBondContact O-N 3.4Å; D162-L165 PolarHBondContact O-N 3.28Å; L165-E168 PolarHBondContact O-N 3.21Å; L165-R169 WeakPolarHBondContact O-CB 3.42Å; L165-R169 VanDerWaalsContact O-CG 3.24Å; L165-R169 WeakPolarHBondContact O-CG 3.35Å; L165-R169 PolarHBondContact O-N 3.36Å |
| 166 | L | 98.5 | Very high | 98.4 | Very high | 105 Ų | 105 | 94.3 Ų | 94.3 | 55% | 0.55 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -65.4 | -42 | 176 | -71.9 | 174.6 | 0 | 0 | 0 | 111.4 | D162 T163 E164 R169 A170 | D162-L166 VanDerWaalsContact O-CG 3.31Å; D162-L166 WeakPolarHBondContact O-CG 3.4Å; D162-L166 PolarHBondContact O-N 3.19Å; T163-L166 PolarHBondContact O-N 3.47Å; E164-L166 PolarHBondContact O-N 3.37Å; L166-R169 PolarHBondContact O-N 2.88Å; L166-A170 PolarHBondContact O-N 2.84Å |
| 167 | C | 98.3 | Very high | 98.5 | Very high | 72 Ų | 72 | 95.4 Ų | 95.4 | 49% | 0.486 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.2 | -51.8 | 173.5 | -74.4 | 0 | 0 | 0 | 0 | 110.9 | T163 E164 R169 A170 H171 | T163-C167 PolarHBondContact O-N 2.92Å; T163-C167 PolarHBondContact O-SG 2.91Å; T163-C167 VanDerWaalsContact O-SG 3.35Å; E164-C167 WeakPolarHBondContact O-CB 3.43Å; E164-C167 PolarHBondContact O-N 3.09Å; C167-R169 VanDerWaalsContact C-N 3.31Å; C167-R169 PolarHBondContact O-N 3.42Å; C167-A170 PolarHBondContact O-N 3.19Å; C167-A170 VanDerWaalsContact O-N 3.15Å; C167-H171 PolarHBondContact O-N 3.24Å; C167-H171 PolarHBondContact O-ND1 3.42Å |
| 168 | E | 98.6 | Very high | 98.5 | Very high | 131 Ų | 131 | 95 Ų | 95 | 61% | 0.612 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.7 | -40.2 | 178.5 | -73.6 | -175.8 | 169.1 | 0 | 0 | 112.4 | E164 L165 A170 H171 S172 | E164-E168 WeakPolarHBondContact O-CG 3.48Å; E164-E168 PolarHBondContact O-N 3.08Å; L165-E168 PolarHBondContact O-N 3.21Å; E168-A170 PolarHBondContact O-N 3.03Å; E168-H171 PolarHBondContact O-N 2.98Å; E168-S172 WeakPolarHBondContact O-CB 3.28Å; E168-S172 PolarHBondContact O-N 3.26Å |
| 169 | R | 98.5 | Very high | 98.5 | Very high | 146 Ų | 146 | 99.7 Ų | 99.7 | 55% | 0.551 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -59 | -46.5 | 174.1 | -77.7 | 173.5 | -175.9 | 168.4 | 4.8 | 111.5 | L165 L166 C167 H171 S172 Q173 | L165-R169 WeakPolarHBondContact O-CB 3.42Å; L165-R169 VanDerWaalsContact O-CG 3.24Å; L165-R169 WeakPolarHBondContact O-CG 3.35Å; L165-R169 PolarHBondContact O-N 3.36Å; L166-R169 PolarHBondContact O-N 2.88Å; C167-R169 VanDerWaalsContact C-N 3.31Å; C167-R169 PolarHBondContact O-N 3.42Å; R169-H171 PolarHBondContact O-N 3.17Å; R169-S172 PolarHBondContact O-N 2.98Å; R169-S172 PolarHBondContact O-OG 3.28Å; R169-Q173 WeakPolarHBondContact O-CG 3.46Å; R169-Q173 PolarHBondContact O-N 2.85Å |
| 170 | A | 98.5 | Very high | 98.5 | Very high | 55 Ų | 55 | 102.1 Ų | 102.1 | 46% | 0.455 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | L166 C167 E168 Q173 H174 | L166-A170 PolarHBondContact O-N 2.84Å; C167-A170 PolarHBondContact O-N 3.19Å; C167-A170 VanDerWaalsContact O-N 3.15Å; E168-A170 PolarHBondContact O-N 3.03Å; A170-Q173 PolarHBondContact O-N 2.94Å; A170-H174 PolarHBondContact O-N 3.22Å |
| 171 | H | 98.6 | Very high | 98.5 | Very high | 127 Ų | 127 | 98.3 Ų | 98.3 | 59% | 0.588 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.2 | -42.6 | 176.1 | -70.5 | 89.7 | 0 | 0 | 0 | 112.1 | C167 E168 R169 Q173 H174 L175 | C167-H171 PolarHBondContact O-N 3.24Å; C167-H171 PolarHBondContact O-ND1 3.42Å; E168-H171 PolarHBondContact O-N 2.98Å; R169-H171 PolarHBondContact O-N 3.17Å; H171-Q173 VanDerWaalsContact C-N 3.31Å; H171-Q173 PolarHBondContact O-N 3.48Å; H171-H174 PolarHBondContact O-N 3.37Å; H171-L175 WeakPolarHBondContact O-CG 3.34Å; H171-L175 PolarHBondContact O-N 3.1Å |
| 172 | S | 98.4 | Very high | 98.5 | Very high | 68 Ų | 68 | 99.5 Ų | 99.5 | 48% | 0.476 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.5 | -38.6 | 177.9 | 74.9 | 0 | 0 | 0 | 0 | 112.3 | E168 R169 L175 A176 | E168-S172 WeakPolarHBondContact O-CB 3.28Å; E168-S172 PolarHBondContact O-N 3.26Å; R169-S172 PolarHBondContact O-N 2.98Å; R169-S172 PolarHBondContact O-OG 3.28Å; S172-L175 PolarHBondContact O-N 2.94Å; S172-A176 WeakPolarHBondContact O-CB 3.43Å; S172-A176 PolarHBondContact O-N 2.86Å |
| 173 | Q | 98.7 | Very high | 98.5 | Very high | 119 Ų | 119 | 97 Ų | 97 | 56% | 0.556 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.1 | -42.5 | 176.2 | -71.9 | 174.4 | 10.9 | 0 | 0 | 111.4 | R169 A170 H171 A176 Q177 | R169-Q173 WeakPolarHBondContact O-CG 3.46Å; R169-Q173 PolarHBondContact O-N 2.85Å; A170-Q173 PolarHBondContact O-N 2.94Å; H171-Q173 VanDerWaalsContact C-N 3.31Å; H171-Q173 PolarHBondContact O-N 3.48Å; Q173-A176 WeakPolarHBondContact O-CB 3.45Å; Q173-A176 PolarHBondContact O-N 2.83Å; Q173-Q177 WeakPolarHBondContact O-CG 3.48Å; Q173-Q177 PolarHBondContact O-N 2.87Å |
| 174 | H | 98.4 | Very high | 98.6 | Very high | 99 Ų | 99 | 97.6 Ų | 97.6 | 46% | 0.458 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.5 | -48.3 | 175.2 | -178.1 | -93.4 | 0 | 0 | 0 | 111.7 | A170 H171 A176 Q177 E178 | A170-H174 PolarHBondContact O-N 3.22Å; H171-H174 PolarHBondContact O-N 3.37Å; H174-A176 VanDerWaalsContact C-N 3.29Å; H174-A176 PolarHBondContact O-N 3.43Å; H174-Q177 WeakPolarHBondContact O-CB 3.46Å; H174-Q177 PolarHBondContact O-N 3.3Å; H174-Q177 VanDerWaalsContact O-N 3.11Å; H174-E178 IonicContact CE1-OE1 3.49Å; H174-E178 PolarHBondContact CE1-OE1 3.39Å; H174-E178 IonicContact CE1-OE2 3.64Å; H174-E178 IonicContact ND1-OE1 2.72Å; H174-E178 IonicContact ND1-OE2 3.89Å; H174-E178 IonicContact NE2-OE1 2.62Å; H174-E178 PolarHBondContact O-N 3.01Å |
| 175 | L | 98.8 | Very high | 98.6 | Very high | 97 Ų | 97 | 100.8 Ų | 100.8 | 51% | 0.508 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.6 | -35.9 | 176.9 | -70.6 | 172 | 0 | 0 | 0 | 112.4 | H171 S172 Q177 E178 R179 | H171-L175 WeakPolarHBondContact O-CG 3.34Å; H171-L175 PolarHBondContact O-N 3.1Å; S172-L175 PolarHBondContact O-N 2.94Å; L175-Q177 VanDerWaalsContact C-N 3.34Å; L175-E178 PolarHBondContact O-N 3.41Å; L175-R179 WeakPolarHBondContact O-CB 3.21Å; L175-R179 WeakPolarHBondContact O-CG 3.31Å; L175-R179 PolarHBondContact O-N 3.36Å |
| 176 | A | 98.5 | Very high | 98.6 | Very high | 58 Ų | 58 | 103 Ų | 103 | 48% | 0.479 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.9 | -39.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | S172 Q173 H174 R179 Q180 | S172-A176 WeakPolarHBondContact O-CB 3.43Å; S172-A176 PolarHBondContact O-N 2.86Å; Q173-A176 WeakPolarHBondContact O-CB 3.45Å; Q173-A176 PolarHBondContact O-N 2.83Å; H174-A176 VanDerWaalsContact C-N 3.29Å; H174-A176 PolarHBondContact O-N 3.43Å; A176-R179 PolarHBondContact O-N 3.47Å; A176-Q180 PolarHBondContact O-N 3.21Å |
| 177 | Q | 98.7 | Very high | 98.6 | Very high | 117 Ų | 117 | 103.8 Ų | 103.8 | 55% | 0.547 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.9 | -43.5 | 174.9 | -68.5 | 170.9 | 10.7 | 0 | 0 | 111.9 | Q173 H174 L175 R179 Q180 Q181 | Q173-Q177 WeakPolarHBondContact O-CG 3.48Å; Q173-Q177 PolarHBondContact O-N 2.87Å; H174-Q177 WeakPolarHBondContact O-CB 3.46Å; H174-Q177 PolarHBondContact O-N 3.3Å; H174-Q177 VanDerWaalsContact O-N 3.11Å; L175-Q177 VanDerWaalsContact C-N 3.34Å; Q177-R179 VanDerWaalsContact C-N 3.35Å; Q177-R179 PolarHBondContact O-N 2.98Å; Q177-Q180 WeakPolarHBondContact O-CB 3.39Å; Q177-Q180 PolarHBondContact O-N 3.34Å; Q177-Q181 WeakPolarHBondContact O-CG 3.27Å; Q177-Q181 PolarHBondContact O-N 2.93Å |
| 178 | E | 98.5 | Very high | 98.6 | Very high | 90 Ų | 90 | 103.2 Ų | 103.2 | 42% | 0.421 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.2 | -42.8 | 175.9 | -72 | -171.7 | 147.3 | 0 | 0 | 111.8 | H174 L175 Q180 Q181 V182 | H174-E178 IonicContact CE1-OE1 3.49Å; H174-E178 PolarHBondContact CE1-OE1 3.39Å; H174-E178 IonicContact CE1-OE2 3.64Å; H174-E178 IonicContact ND1-OE1 2.72Å; H174-E178 IonicContact ND1-OE2 3.89Å; H174-E178 IonicContact NE2-OE1 2.62Å; H174-E178 PolarHBondContact O-N 3.01Å; L175-E178 PolarHBondContact O-N 3.41Å; E178-Q180 VanDerWaalsContact C-N 3.32Å; E178-Q180 PolarHBondContact O-N 2.98Å; E178-Q181 PolarHBondContact O-N 3.45Å; E178-V182 WeakPolarHBondContact O-CG2 3.47Å; E178-V182 PolarHBondContact O-N 2.92Å |
| 179 | R | 98.6 | Very high | 98.6 | Very high | 201 Ų | 201 | 101.9 Ų | 101.9 | 76% | 0.758 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.3 | -42.4 | 174.7 | -79.6 | -177.7 | 168.1 | 177 | -2.4 | 112.1 | L175 A176 Q177 V182 A183 | L175-R179 WeakPolarHBondContact O-CB 3.21Å; L175-R179 WeakPolarHBondContact O-CG 3.31Å; L175-R179 PolarHBondContact O-N 3.36Å; A176-R179 PolarHBondContact O-N 3.47Å; Q177-R179 VanDerWaalsContact C-N 3.35Å; Q177-R179 PolarHBondContact O-N 2.98Å; R179-V182 PolarHBondContact O-N 3.27Å; R179-A183 WeakPolarHBondContact O-CB 3.43Å; R179-A183 PolarHBondContact O-N 2.97Å |
| 180 | Q | 98.7 | Very high | 98.6 | Very high | 104 Ų | 104 | 97.6 Ų | 97.6 | 49% | 0.486 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.5 | -44.8 | 175.7 | -177.2 | 70.6 | 19.8 | 0 | 0 | 111.5 | A176 Q177 E178 V182 A183 E184 | A176-Q180 PolarHBondContact O-N 3.21Å; Q177-Q180 WeakPolarHBondContact O-CB 3.39Å; Q177-Q180 PolarHBondContact O-N 3.34Å; E178-Q180 VanDerWaalsContact C-N 3.32Å; E178-Q180 PolarHBondContact O-N 2.98Å; Q180-V182 PolarHBondContact O-N 3.01Å; Q180-A183 PolarHBondContact O-N 3.08Å; Q180-E184 PolarHBondContact NE2-OE1 3.46Å; Q180-E184 WeakPolarHBondContact O-CG 3.46Å; Q180-E184 PolarHBondContact O-N 3.28Å |
| 181 | Q | 98.6 | Very high | 98.6 | Very high | 86 Ų | 86 | 103.4 Ų | 103.4 | 40% | 0.402 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.5 | -42.3 | 177.2 | -71.4 | 177.1 | 52 | 0 | 0 | 112.3 | Q177 E178 E184 R185 | Q177-Q181 WeakPolarHBondContact O-CG 3.27Å; Q177-Q181 PolarHBondContact O-N 2.93Å; E178-Q181 PolarHBondContact O-N 3.45Å; Q181-E184 PolarHBondContact O-N 3.39Å; Q181-R185 WeakPolarHBondContact O-CG 3.32Å; Q181-R185 PolarHBondContact O-N 3.22Å |
| 182 | V | 98.8 | Very high | 98.6 | Very high | 86 Ų | 86 | 102.9 Ų | 102.9 | 52% | 0.521 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.9 | -45.2 | 175.9 | 173 | 0 | 0 | 0 | 0 | 110.3 | E178 R179 Q180 E184 R185 E186 | E178-V182 WeakPolarHBondContact O-CG2 3.47Å; E178-V182 PolarHBondContact O-N 2.92Å; R179-V182 PolarHBondContact O-N 3.27Å; Q180-V182 PolarHBondContact O-N 3.01Å; V182-E184 VanDerWaalsContact C-N 3.3Å; V182-E184 PolarHBondContact O-N 3.46Å; V182-R185 PolarHBondContact O-N 3.36Å; V182-E186 WeakPolarHBondContact O-CB 3.45Å; V182-E186 PolarHBondContact O-N 3.3Å |
| 183 | A | 98.6 | Very high | 98.6 | Very high | 33 Ų | 33 | 103.8 Ų | 103.8 | 27% | 0.273 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.4 | -34.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | R179 Q180 R187 | R179-A183 WeakPolarHBondContact O-CB 3.43Å; R179-A183 PolarHBondContact O-N 2.97Å; Q180-A183 PolarHBondContact O-N 3.08Å; A183-R187 WeakPolarHBondContact O-CB 3.46Å; A183-R187 VanDerWaalsContact O-CG 3.32Å; A183-R187 WeakPolarHBondContact O-CG 3.46Å; A183-R187 PolarHBondContact O-N 3.15Å; A183-R187 PolarHBondContact O-NE 3.47Å |
| 184 | E | 98.6 | Very high | 98.6 | Very high | 92 Ų | 92 | 102.8 Ų | 102.8 | 43% | 0.43 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.1 | -43.7 | 173.8 | -77.4 | 169.7 | -169.3 | 0 | 0 | 112.4 | Q180 Q181 V182 R187 S188 | Q180-E184 PolarHBondContact NE2-OE1 3.46Å; Q180-E184 WeakPolarHBondContact O-CG 3.46Å; Q180-E184 PolarHBondContact O-N 3.28Å; Q181-E184 PolarHBondContact O-N 3.39Å; V182-E184 VanDerWaalsContact C-N 3.3Å; V182-E184 PolarHBondContact O-N 3.46Å; E184-R187 PolarHBondContact O-N 3.19Å; E184-R187 IonicContact OE1-NH2 3.62Å; E184-S188 PolarHBondContact O-N 3.04Å |
| 185 | R | 98.6 | Very high | 98.6 | Very high | 153 Ų | 153 | 102.3 Ų | 102.3 | 58% | 0.577 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.9 | -43.5 | 176.1 | -69.8 | 174.3 | -171 | 156.2 | 8.5 | 111.4 | Q181 V182 R187 S188 L189 | Q181-R185 WeakPolarHBondContact O-CG 3.32Å; Q181-R185 PolarHBondContact O-N 3.22Å; V182-R185 PolarHBondContact O-N 3.36Å; R185-R187 VanDerWaalsContact C-N 3.34Å; R185-R187 PolarHBondContact O-N 2.84Å; R185-S188 WeakPolarHBondContact O-CB 3.48Å; R185-S188 PolarHBondContact O-N 2.86Å; R185-L189 WeakPolarHBondContact O-CG 3.43Å; R185-L189 PolarHBondContact O-N 2.96Å |
| 186 | E | 98.5 | Very high | 98.6 | Very high | 125 Ų | 125 | 99.9 Ų | 99.9 | 58% | 0.584 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -58.3 | -45.9 | 174.9 | -176.2 | -172.1 | 176.1 | 0 | 0 | 111.3 | V182 S188 L189 S190 | V182-E186 WeakPolarHBondContact O-CB 3.45Å; V182-E186 PolarHBondContact O-N 3.3Å; E186-S188 VanDerWaalsContact C-N 3.32Å; E186-S188 PolarHBondContact O-N 3.16Å; E186-L189 PolarHBondContact O-N 3.36Å; E186-S190 WeakPolarHBondContact O-CB 3.44Å; E186-S190 PolarHBondContact O-N 2.76Å; E186-S190 PolarHBondContact O-OG 2.81Å |
| 187 | R | 98.8 | Very high | 98.6 | Very high | 121 Ų | 121 | 101.3 Ų | 101.3 | 46% | 0.457 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.4 | -39.2 | 175.3 | -79.1 | -175.2 | -79.4 | 115.5 | -16.2 | 112.6 | A183 E184 R185 R191 | A183-R187 WeakPolarHBondContact O-CB 3.46Å; A183-R187 VanDerWaalsContact O-CG 3.32Å; A183-R187 WeakPolarHBondContact O-CG 3.46Å; A183-R187 PolarHBondContact O-N 3.15Å; A183-R187 PolarHBondContact O-NE 3.47Å; E184-R187 PolarHBondContact O-N 3.19Å; E184-R187 IonicContact OE1-NH2 3.62Å; R185-R187 VanDerWaalsContact C-N 3.34Å; R185-R187 PolarHBondContact O-N 2.84Å; R187-R191 WeakPolarHBondContact O-CG 3.46Å; R187-R191 PolarHBondContact O-N 3.26Å |
| 188 | S | 98.6 | Very high | 98.6 | Very high | 60 Ų | 60 | 102.2 Ų | 102.2 | 42% | 0.42 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.7 | -48.1 | 176.5 | -176 | 0 | 0 | 0 | 0 | 111.6 | E184 R185 E186 S190 R191 Q192 | E184-S188 PolarHBondContact O-N 3.04Å; R185-S188 WeakPolarHBondContact O-CB 3.48Å; R185-S188 PolarHBondContact O-N 2.86Å; E186-S188 VanDerWaalsContact C-N 3.32Å; E186-S188 PolarHBondContact O-N 3.16Å; S188-S190 PolarHBondContact O-N 3.3Å; S188-R191 PolarHBondContact O-N 3.27Å; S188-Q192 WeakPolarHBondContact O-CG 3.4Å; S188-Q192 PolarHBondContact O-N 2.99Å; S188-Q192 VanDerWaalsContact O-N 3.08Å |
| 189 | L | 98.8 | Very high | 98.6 | Very high | 102 Ų | 102 | 101.1 Ų | 101.1 | 53% | 0.534 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.2 | -40.8 | 177.7 | -70.5 | 172.2 | 0 | 0 | 0 | 111.9 | R185 E186 R191 Q192 V193 | R185-L189 WeakPolarHBondContact O-CG 3.43Å; R185-L189 PolarHBondContact O-N 2.96Å; E186-L189 PolarHBondContact O-N 3.36Å; L189-R191 VanDerWaalsContact C-N 3.32Å; L189-R191 PolarHBondContact O-N 3.13Å; L189-Q192 WeakPolarHBondContact O-CB 3.35Å; L189-Q192 PolarHBondContact O-N 3.12Å; L189-Q192 VanDerWaalsContact O-N 3.09Å; L189-V193 WeakPolarHBondContact O-CG2 3.31Å; L189-V193 PolarHBondContact O-N 3.32Å |
| 190 | S | 98.7 | Very high | 98.6 | Very high | 56 Ų | 56 | 95.4 Ų | 95.4 | 39% | 0.392 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57.9 | -45.7 | 176.2 | -59.7 | 0 | 0 | 0 | 0 | 111.2 | E186 S188 Q192 V193 D194 | E186-S190 WeakPolarHBondContact O-CB 3.44Å; E186-S190 PolarHBondContact O-N 2.76Å; E186-S190 PolarHBondContact O-OG 2.81Å; S188-S190 PolarHBondContact O-N 3.3Å; S190-Q192 VanDerWaalsContact C-N 3.32Å; S190-Q192 PolarHBondContact O-N 3.07Å; S190-V193 PolarHBondContact O-N 3.45Å; S190-D194 VanDerWaalsContact O-CG 3.22Å; S190-D194 PolarHBondContact O-N 3.3Å |
| 191 | R | 98.7 | Very high | 98.5 | Very high | 178 Ų | 178 | 93.2 Ų | 93.2 | 67% | 0.672 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -62 | -37.4 | 175.1 | -69.6 | 173.2 | -174.6 | -131.5 | 0.4 | 112.9 | R187 S188 L189 D194 V195 | R187-R191 WeakPolarHBondContact O-CG 3.46Å; R187-R191 PolarHBondContact O-N 3.26Å; S188-R191 PolarHBondContact O-N 3.27Å; L189-R191 VanDerWaalsContact C-N 3.32Å; L189-R191 PolarHBondContact O-N 3.13Å; R191-D194 PolarHBondContact O-N 2.83Å; R191-V195 WeakPolarHBondContact O-CG2 3.49Å; R191-V195 PolarHBondContact O-N 3.34Å |
| 192 | Q | 98.6 | Very high | 98.5 | Very high | 115 Ų | 115 | 91.7 Ų | 91.7 | 54% | 0.537 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -65.6 | -41.5 | 175.9 | -69.4 | 176.7 | 20.3 | 0 | 0 | 111.5 | S188 L189 S190 V195 A196 | S188-Q192 WeakPolarHBondContact O-CG 3.4Å; S188-Q192 PolarHBondContact O-N 2.99Å; S188-Q192 VanDerWaalsContact O-N 3.08Å; L189-Q192 WeakPolarHBondContact O-CB 3.35Å; L189-Q192 PolarHBondContact O-N 3.12Å; L189-Q192 VanDerWaalsContact O-N 3.09Å; S190-Q192 VanDerWaalsContact C-N 3.32Å; S190-Q192 PolarHBondContact O-N 3.07Å; Q192-V195 PolarHBondContact O-N 3.11Å; Q192-A196 VanDerWaalsContact O-CB 3.31Å; Q192-A196 WeakPolarHBondContact O-CB 3.41Å; Q192-A196 PolarHBondContact O-N 3.02Å |
| 193 | V | 98.7 | Very high | 98.5 | Very high | 87 Ų | 87 | 91.4 Ų | 91.4 | 53% | 0.527 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -62.1 | -44.7 | 174.5 | 173.6 | 0 | 0 | 0 | 0 | 110.4 | L189 S190 V195 A196 V197 | L189-V193 WeakPolarHBondContact O-CG2 3.31Å; L189-V193 PolarHBondContact O-N 3.32Å; S190-V193 PolarHBondContact O-N 3.45Å; V193-V195 PolarHBondContact O-N 3.48Å; V193-A196 PolarHBondContact O-N 2.93Å; V193-V197 HydrophobicContact CG1-CG2 4.22Å; V193-V197 WeakPolarHBondContact O-CB 3.49Å; V193-V197 VanDerWaalsContact O-CG2 3.28Å; V193-V197 WeakPolarHBondContact O-CG2 3.41Å; V193-V197 PolarHBondContact O-N 3.14Å |
| 194 | D | 98.5 | Very high | 98.5 | Very high | 99 Ų | 99 | 97.9 Ų | 97.9 | 53% | 0.529 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.1 | -46.7 | 177.8 | -64.7 | -29.7 | 0 | 0 | 0 | 111.8 | S190 R191 V197 M198 | S190-D194 VanDerWaalsContact O-CG 3.22Å; S190-D194 PolarHBondContact O-N 3.3Å; R191-D194 PolarHBondContact O-N 2.83Å; D194-V197 PolarHBondContact O-N 3.32Å; D194-M198 PolarHBondContact O-N 3.15Å |
| 195 | V | 98.3 | Very high | 98.5 | Very high | 88 Ų | 88 | 99.6 Ų | 99.6 | 53% | 0.533 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.2 | -44.5 | 176.5 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | R191 Q192 V193 V197 M198 V199 | R191-V195 WeakPolarHBondContact O-CG2 3.49Å; R191-V195 PolarHBondContact O-N 3.34Å; Q192-V195 PolarHBondContact O-N 3.11Å; V193-V195 PolarHBondContact O-N 3.48Å; V195-V197 VanDerWaalsContact C-N 3.32Å; V195-V197 PolarHBondContact O-N 2.9Å; V195-M198 WeakPolarHBondContact O-CB 3.37Å; V195-M198 PolarHBondContact O-N 3.12Å; V195-V199 HydrophobicContact CG1-CG2 4.42Å; V195-V199 WeakPolarHBondContact O-CG2 3.38Å; V195-V199 PolarHBondContact O-N 2.62Å |
| 196 | A | 98.1 | Very high | 98.5 | Very high | 46 Ų | 46 | 98 Ų | 98 | 38% | 0.38 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.6 | -41.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q192 V193 M198 V199 I200 | Q192-A196 VanDerWaalsContact O-CB 3.31Å; Q192-A196 WeakPolarHBondContact O-CB 3.41Å; Q192-A196 PolarHBondContact O-N 3.02Å; V193-A196 PolarHBondContact O-N 2.93Å; A196-M198 VanDerWaalsContact C-N 3.35Å; A196-M198 PolarHBondContact O-N 2.89Å; A196-V199 PolarHBondContact O-N 2.72Å; A196-I200 WeakPolarHBondContact O-CB 3.44Å; A196-I200 WeakPolarHBondContact O-CD1 3.44Å; A196-I200 WeakPolarHBondContact O-CG1 3.35Å; A196-I200 PolarHBondContact O-N 3.22Å |
| 197 | V | 98.7 | Very high | 98.5 | Very high | 88 Ų | 88 | 96.6 Ų | 96.6 | 53% | 0.533 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 175.4 | 168.9 | 0 | 0 | 0 | 0 | 110.9 | V193 D194 V195 I200 A201 | V193-V197 HydrophobicContact CG1-CG2 4.22Å; V193-V197 WeakPolarHBondContact O-CB 3.49Å; V193-V197 VanDerWaalsContact O-CG2 3.28Å; V193-V197 WeakPolarHBondContact O-CG2 3.41Å; V193-V197 PolarHBondContact O-N 3.14Å; D194-V197 PolarHBondContact O-N 3.32Å; V195-V197 VanDerWaalsContact C-N 3.32Å; V195-V197 PolarHBondContact O-N 2.9Å; V197-I200 PolarHBondContact O-N 2.85Å; V197-A201 WeakPolarHBondContact O-CB 3.44Å; V197-A201 PolarHBondContact O-N 2.78Å |
| 198 | M | 98 | Very high | 98.5 | Very high | 136 Ų | 136 | 94.9 Ų | 94.9 | 67% | 0.67 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.7 | -46.2 | 174.5 | -76.4 | -179.4 | 45.3 | 0 | 0 | 112.5 | D194 V195 A196 A201 A202 | D194-M198 PolarHBondContact O-N 3.15Å; V195-M198 WeakPolarHBondContact O-CB 3.37Å; V195-M198 PolarHBondContact O-N 3.12Å; A196-M198 VanDerWaalsContact C-N 3.35Å; A196-M198 PolarHBondContact O-N 2.89Å; M198-A201 PolarHBondContact O-N 3.17Å; M198-A202 PolarHBondContact O-N 3.1Å |
| 199 | V | 98.6 | Very high | 98.5 | Very high | 67 Ų | 67 | 94.8 Ų | 94.8 | 41% | 0.406 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 178.6 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | V195 A196 A201 A202 L203 | V195-V199 HydrophobicContact CG1-CG2 4.42Å; V195-V199 WeakPolarHBondContact O-CG2 3.38Å; V195-V199 PolarHBondContact O-N 2.62Å; A196-V199 PolarHBondContact O-N 2.72Å; V199-A201 VanDerWaalsContact C-N 3.32Å; V199-A201 PolarHBondContact O-N 3.08Å; V199-A202 PolarHBondContact O-N 3.1Å; V199-L203 HydrophobicContact CG1-CD1 3.92Å; V199-L203 HydrophobicContact CG1-CG 4.29Å; V199-L203 WeakPolarHBondContact O-CG 3.38Å; V199-L203 PolarHBondContact O-N 3.33Å |
| 200 | I | 98.5 | Very high | 98.5 | Very high | 82 Ų | 82 | 92.9 Ų | 92.9 | 42% | 0.421 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 176.5 | -70 | 164.6 | 0 | 0 | 0 | 110.8 | A196 V197 L203 R204 | A196-I200 WeakPolarHBondContact O-CB 3.44Å; A196-I200 WeakPolarHBondContact O-CD1 3.44Å; A196-I200 WeakPolarHBondContact O-CG1 3.35Å; A196-I200 PolarHBondContact O-N 3.22Å; V197-I200 PolarHBondContact O-N 2.85Å; I200-L203 PolarHBondContact O-N 2.9Å; I200-R204 HydrophobicContact CG2-CG 4.48Å; I200-R204 WeakPolarHBondContact O-CB 3.31Å; I200-R204 VanDerWaalsContact O-CG 3.27Å; I200-R204 WeakPolarHBondContact O-CG 3.43Å; I200-R204 PolarHBondContact O-N 2.98Å |
| 201 | A | 98.3 | Very high | 98.5 | Very high | 57 Ų | 57 | 93.7 Ų | 93.7 | 47% | 0.471 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.2 | -44 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | V197 M198 V199 R204 E205 | V197-A201 WeakPolarHBondContact O-CB 3.44Å; V197-A201 PolarHBondContact O-N 2.78Å; M198-A201 PolarHBondContact O-N 3.17Å; V199-A201 VanDerWaalsContact C-N 3.32Å; V199-A201 PolarHBondContact O-N 3.08Å; A201-R204 PolarHBondContact O-N 3.43Å; A201-E205 PolarHBondContact O-N 2.83Å; A201-E205 VanDerWaalsContact O-N 3.1Å |
| 202 | A | 98.2 | Very high | 98.5 | Very high | 55 Ų | 55 | 88.6 Ų | 88.6 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | M198 V199 R204 E205 Q206 | M198-A202 PolarHBondContact O-N 3.1Å; V199-A202 PolarHBondContact O-N 3.1Å; A202-R204 VanDerWaalsContact C-N 3.33Å; A202-R204 PolarHBondContact O-N 3.27Å; A202-E205 PolarHBondContact O-N 3.15Å; A202-Q206 WeakPolarHBondContact O-CG 3.42Å; A202-Q206 PolarHBondContact O-N 3.27Å |
| 203 | L | 98.6 | Very high | 98.5 | Very high | 80 Ų | 80 | 86.7 Ų | 86.7 | 42% | 0.419 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.4 | -37.6 | 177.7 | -70.1 | 174.2 | 0 | 0 | 0 | 112.1 | L57 V199 I200 Q206 L207 | L57-L203 HydrophobicContact CD1-CD2 4.44Å; V199-L203 HydrophobicContact CG1-CD1 3.92Å; V199-L203 HydrophobicContact CG1-CG 4.29Å; V199-L203 WeakPolarHBondContact O-CG 3.38Å; V199-L203 PolarHBondContact O-N 3.33Å; I200-L203 PolarHBondContact O-N 2.9Å; L203-Q206 PolarHBondContact O-N 3.23Å; L203-L207 WeakPolarHBondContact O-CB 3.4Å; L203-L207 PolarHBondContact O-N 3.45Å |
| 204 | R | 98.6 | Very high | 98.5 | Very high | 169 Ų | 169 | 87.2 Ų | 87.2 | 64% | 0.638 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.7 | -42.9 | 174.5 | -76.6 | 173.5 | 177.3 | -178.8 | 0.4 | 111.8 | I200 A201 A202 L207 N208 | I200-R204 HydrophobicContact CG2-CG 4.48Å; I200-R204 WeakPolarHBondContact O-CB 3.31Å; I200-R204 VanDerWaalsContact O-CG 3.27Å; I200-R204 WeakPolarHBondContact O-CG 3.43Å; I200-R204 PolarHBondContact O-N 2.98Å; A201-R204 PolarHBondContact O-N 3.43Å; A202-R204 VanDerWaalsContact C-N 3.33Å; A202-R204 PolarHBondContact O-N 3.27Å; R204-L207 PolarHBondContact O-N 2.93Å; R204-N208 PolarHBondContact O-N 3.43Å; R204-N208 PolarHBondContact O-ND2 3.48Å |
| 205 | E | 98.7 | Very high | 98.5 | Very high | 128 Ų | 128 | 87.4 Ų | 87.4 | 60% | 0.598 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.8 | -43 | 177.2 | -172.2 | 59.2 | -154.1 | 0 | 0 | 111.5 | A201 A202 L207 N208 A209 | A201-E205 PolarHBondContact O-N 2.83Å; A201-E205 VanDerWaalsContact O-N 3.1Å; A202-E205 PolarHBondContact O-N 3.15Å; E205-L207 PolarHBondContact O-N 3.41Å; E205-N208 PolarHBondContact O-N 2.67Å; E205-A209 WeakPolarHBondContact O-CB 3.38Å; E205-A209 PolarHBondContact O-N 2.96Å |
| 206 | Q | 98.6 | Very high | 98.5 | Very high | 118 Ų | 118 | 87 Ų | 87 | 55% | 0.551 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -61.2 | -43 | 175.2 | -73.5 | -179.9 | -22.9 | 0 | 0 | 112.3 | A202 L203 A209 S210 | A202-Q206 WeakPolarHBondContact O-CG 3.42Å; A202-Q206 PolarHBondContact O-N 3.27Å; L203-Q206 PolarHBondContact O-N 3.23Å; Q206-A209 PolarHBondContact O-N 3.28Å; Q206-S210 PolarHBondContact O-N 2.92Å; Q206-S210 PolarHBondContact O-OG 3.32Å |
| 207 | L | 98.7 | Very high | 98.6 | Very high | 96 Ų | 96 | 91 Ų | 91 | 50% | 0.503 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.4 | -46.3 | 177.3 | -175.9 | 62 | 0 | 0 | 0 | 111.3 | L203 R204 E205 A209 S210 D211 | L203-L207 WeakPolarHBondContact O-CB 3.4Å; L203-L207 PolarHBondContact O-N 3.45Å; R204-L207 PolarHBondContact O-N 2.93Å; E205-L207 PolarHBondContact O-N 3.41Å; L207-A209 VanDerWaalsContact C-N 3.29Å; L207-A209 PolarHBondContact O-N 3.34Å; L207-S210 WeakPolarHBondContact CA-OG 3.36Å; L207-S210 PolarHBondContact O-N 3.42Å; L207-S210 VanDerWaalsContact O-N 3.16Å; L207-S210 PolarHBondContact O-OG 2.82Å; L207-D211 PolarHBondContact O-N 3.44Å |
| 208 | N | 98.6 | Very high | 98.6 | Very high | 86 Ų | 86 | 92 Ų | 92 | 46% | 0.46 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -60 | -40.1 | 176.9 | -68.7 | -21.4 | 0 | 0 | 0 | 112.1 | R204 E205 S212 | R204-N208 PolarHBondContact O-N 3.43Å; R204-N208 PolarHBondContact O-ND2 3.48Å; E205-N208 PolarHBondContact O-N 2.67Å; N208-S212 WeakPolarHBondContact O-CB 3.39Å; N208-S212 PolarHBondContact O-N 3.02Å; N208-S212 PolarHBondContact O-OG 3.05Å |
| 209 | A | 98.4 | Very high | 98.6 | Very high | 57 Ų | 57 | 91.7 Ų | 91.7 | 47% | 0.471 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.3 | -42.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | E205 Q206 L207 S212 E213 | E205-A209 WeakPolarHBondContact O-CB 3.38Å; E205-A209 PolarHBondContact O-N 2.96Å; Q206-A209 PolarHBondContact O-N 3.28Å; L207-A209 VanDerWaalsContact C-N 3.29Å; L207-A209 PolarHBondContact O-N 3.34Å; A209-S212 PolarHBondContact O-N 2.73Å; A209-E213 PolarHBondContact O-N 3.02Å; A209-E213 VanDerWaalsContact O-N 3.15Å |
| 210 | S | 98.5 | Very high | 98.6 | Very high | 62 Ų | 62 | 92.1 Ų | 92.1 | 43% | 0.434 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -66.4 | -39.4 | 176.2 | 57.4 | 0 | 0 | 0 | 0 | 112.9 | Q206 L207 E213 L214 | Q206-S210 PolarHBondContact O-N 2.92Å; Q206-S210 PolarHBondContact O-OG 3.32Å; L207-S210 WeakPolarHBondContact CA-OG 3.36Å; L207-S210 PolarHBondContact O-N 3.42Å; L207-S210 VanDerWaalsContact O-N 3.16Å; L207-S210 PolarHBondContact O-OG 2.82Å; S210-E213 PolarHBondContact O-N 3.34Å; S210-L214 WeakPolarHBondContact O-CB 3.33Å; S210-L214 PolarHBondContact O-N 3.44Å |
| 211 | D | 98.7 | Very high | 98.6 | Very high | 73 Ų | 73 | 92.5 Ų | 92.5 | 39% | 0.39 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.7 | -43.2 | 177.1 | -73.7 | -13.5 | 0 | 0 | 0 | 110.6 | L207 E213 L214 E215 | L207-D211 PolarHBondContact O-N 3.44Å; D211-E213 VanDerWaalsContact C-N 3.31Å; D211-E213 PolarHBondContact O-N 3.15Å; D211-L214 WeakPolarHBondContact O-CB 3.27Å; D211-L214 PolarHBondContact O-N 3.4Å; D211-L214 VanDerWaalsContact O-N 3.12Å; D211-E215 WeakPolarHBondContact O-CG 3.13Å; D211-E215 PolarHBondContact O-N 2.88Å |
| 212 | S | 98.6 | Very high | 98.6 | Very high | 72 Ų | 72 | 94.6 Ų | 94.6 | 50% | 0.503 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.2 | -38.9 | 176.9 | -59.8 | 0 | 0 | 0 | 0 | 112.6 | N208 A209 R216 | N208-S212 WeakPolarHBondContact O-CB 3.39Å; N208-S212 PolarHBondContact O-N 3.02Å; N208-S212 PolarHBondContact O-OG 3.05Å; A209-S212 PolarHBondContact O-N 2.73Å; S212-R216 PolarHBondContact O-N 3.46Å |
| 213 | E | 98.7 | Very high | 98.7 | Very high | 75 Ų | 75 | 96.3 Ų | 96.3 | 35% | 0.35 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -69.5 | -40.2 | 174.6 | 178.2 | 60.5 | -164.9 | 0 | 0 | 111 | A209 S210 D211 R216 R217 | A209-E213 PolarHBondContact O-N 3.02Å; A209-E213 VanDerWaalsContact O-N 3.15Å; S210-E213 PolarHBondContact O-N 3.34Å; D211-E213 VanDerWaalsContact C-N 3.31Å; D211-E213 PolarHBondContact O-N 3.15Å; E213-R216 VanDerWaalsContact O-CB 3.31Å; E213-R216 WeakPolarHBondContact O-CB 3.43Å; E213-R216 PolarHBondContact O-N 3.09Å; E213-R216 VanDerWaalsContact O-N 3.14Å; E213-R216 IonicContact OE1-CZ 3.99Å; E213-R216 IonicContact OE1-NE 3.91Å; E213-R216 PolarHBondContact OE1-NE 3.05Å; E213-R216 IonicContact OE1-NH2 3.16Å; E213-R216 PolarHBondContact OE1-NH2 3.44Å; E213-R216 IonicContact OE2-CZ 3.38Å; E213-R216 IonicContact OE2-NE 3.95Å; E213-R216 PolarHBondContact OE2-NE 3.49Å; E213-R216 IonicContact OE2-NH2 2.78Å; E213-R217 WeakPolarHBondContact O-CG 3.18Å; E213-R217 PolarHBondContact O-N 2.91Å; E213-R217 IonicContact OE1-CZ 3.94Å; E213-R217 IonicContact OE1-NE 3.22Å; E213-R217 PolarHBondContact OE1-NE 3.42Å; E213-R217 IonicContact OE1-NH2 3.02Å; E213-R217 PolarHBondContact OE1-NH2 3.08Å |
| 214 | L | 98.8 | Very high | 98.7 | Very high | 97 Ų | 97 | 97.3 Ų | 97.3 | 51% | 0.508 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.4 | -49 | 176.6 | -174.1 | 66.3 | 0 | 0 | 0 | 111.1 | S210 D211 R216 R217 E218 | S210-L214 WeakPolarHBondContact O-CB 3.33Å; S210-L214 PolarHBondContact O-N 3.44Å; D211-L214 WeakPolarHBondContact O-CB 3.27Å; D211-L214 PolarHBondContact O-N 3.4Å; D211-L214 VanDerWaalsContact O-N 3.12Å; L214-R216 PolarHBondContact O-N 2.71Å; L214-R217 CarbonylContact O-C 3.59Å; L214-R217 WeakPolarHBondContact O-CA 3.46Å; L214-R217 WeakPolarHBondContact O-CB 3.09Å; L214-R217 PolarHBondContact O-N 3.4Å; L214-E218 WeakPolarHBondContact O-CG 3.13Å; L214-E218 PolarHBondContact O-N 2.8Å |
| 215 | E | 98.7 | Very high | 98.7 | Very high | 103 Ų | 103 | 93.7 Ų | 93.7 | 48% | 0.481 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.3 | -35.3 | 175.7 | -69.1 | -177.5 | 176.6 | 0 | 0 | 112.1 | D211 E218 R219 | D211-E215 WeakPolarHBondContact O-CG 3.13Å; D211-E215 PolarHBondContact O-N 2.88Å; E215-E218 PolarHBondContact O-N 3.24Å; E215-R219 VanDerWaalsContact CB-NH2 3.29Å; E215-R219 WeakPolarHBondContact O-CG 3.46Å; E215-R219 PolarHBondContact O-N 3.18Å; E215-R219 VanDerWaalsContact O-N 3.11Å; E215-R219 PolarHBondContact O-NE 2.88Å; E215-R219 IonicContact OE2-NH2 3.94Å; E215-R219 PolarHBondContact OE2-NH2 3.46Å |
| 216 | R | 98.8 | Very high | 98.7 | Very high | 81 Ų | 81 | 96.6 Ų | 96.6 | 31% | 0.306 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -65.1 | -44.4 | 175.2 | -166 | -170.4 | 72.3 | 70.5 | 6.6 | 111.3 | S212 E213 L214 R219 E220 | S212-R216 PolarHBondContact O-N 3.46Å; E213-R216 VanDerWaalsContact O-CB 3.31Å; E213-R216 WeakPolarHBondContact O-CB 3.43Å; E213-R216 PolarHBondContact O-N 3.09Å; E213-R216 VanDerWaalsContact O-N 3.14Å; E213-R216 IonicContact OE1-CZ 3.99Å; E213-R216 IonicContact OE1-NE 3.91Å; E213-R216 PolarHBondContact OE1-NE 3.05Å; E213-R216 IonicContact OE1-NH2 3.16Å; E213-R216 PolarHBondContact OE1-NH2 3.44Å; E213-R216 IonicContact OE2-CZ 3.38Å; E213-R216 IonicContact OE2-NE 3.95Å; E213-R216 PolarHBondContact OE2-NE 3.49Å; E213-R216 IonicContact OE2-NH2 2.78Å; L214-R216 PolarHBondContact O-N 2.71Å; R216-R219 VanDerWaalsContact CA-NH1 3.34Å; R216-R219 PolarHBondContact O-N 3.08Å; R216-E220 IonicContact CZ-OE1 2.82Å; R216-E220 IonicContact NH1-OE1 3.55Å; R216-E220 PolarHBondContact NH1-OE1 2.94Å; R216-E220 IonicContact NH1-OE2 3.86Å; R216-E220 IonicContact NH2-OE1 3.44Å; R216-E220 PolarHBondContact O-N 2.91Å; R216-E220 VanDerWaalsContact O-N 3.15Å |
| 217 | R | 98.6 | Very high | 98.7 | Very high | 129 Ų | 129 | 97.8 Ų | 97.8 | 49% | 0.487 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64 | -40.1 | 175.5 | -64.3 | -59.7 | -178.5 | 158.8 | 2.6 | 112 | E213 L214 R219 E220 V221 | E213-R217 WeakPolarHBondContact O-CG 3.18Å; E213-R217 PolarHBondContact O-N 2.91Å; E213-R217 IonicContact OE1-CZ 3.94Å; E213-R217 IonicContact OE1-NE 3.22Å; E213-R217 PolarHBondContact OE1-NE 3.42Å; E213-R217 IonicContact OE1-NH2 3.02Å; E213-R217 PolarHBondContact OE1-NH2 3.08Å; L214-R217 CarbonylContact O-C 3.59Å; L214-R217 WeakPolarHBondContact O-CA 3.46Å; L214-R217 WeakPolarHBondContact O-CB 3.09Å; L214-R217 PolarHBondContact O-N 3.4Å; R217-R219 VanDerWaalsContact C-N 3.32Å; R217-R219 PolarHBondContact O-N 2.84Å; R217-E220 WeakPolarHBondContact CD-OE2 3.44Å; R217-E220 IonicContact NH1-OE2 3.17Å; R217-E220 WeakPolarHBondContact O-CB 3.25Å; R217-E220 PolarHBondContact O-N 3.05Å; R217-E220 VanDerWaalsContact O-N 3.15Å; R217-V221 WeakPolarHBondContact O-CG2 3.35Å; R217-V221 PolarHBondContact O-N 3.36Å |
| 218 | E | 98.6 | Very high | 98.7 | Very high | 109 Ų | 109 | 98.2 Ų | 98.2 | 51% | 0.509 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.4 | -43.3 | 175.6 | -72.1 | 178.3 | 167.3 | 0 | 0 | 111.6 | L214 E215 E220 V221 L222 | L214-E218 WeakPolarHBondContact O-CG 3.13Å; L214-E218 PolarHBondContact O-N 2.8Å; E215-E218 PolarHBondContact O-N 3.24Å; E218-E220 VanDerWaalsContact C-N 3.34Å; E218-E220 PolarHBondContact O-N 2.93Å; E218-V221 PolarHBondContact O-N 3.24Å; E218-L222 WeakPolarHBondContact O-CG 3.39Å; E218-L222 PolarHBondContact O-N 3.47Å |
| 219 | R | 98.8 | Very high | 98.7 | Very high | 130 Ų | 130 | 98 Ų | 98 | 49% | 0.491 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62 | -38.6 | 174.8 | -70.6 | 177.5 | -119 | 117.3 | -1.7 | 112.7 | E215 R216 R217 T223 | E215-R219 VanDerWaalsContact CB-NH2 3.29Å; E215-R219 WeakPolarHBondContact O-CG 3.46Å; E215-R219 PolarHBondContact O-N 3.18Å; E215-R219 VanDerWaalsContact O-N 3.11Å; E215-R219 PolarHBondContact O-NE 2.88Å; E215-R219 IonicContact OE2-NH2 3.94Å; E215-R219 PolarHBondContact OE2-NH2 3.46Å; R216-R219 VanDerWaalsContact CA-NH1 3.34Å; R216-R219 PolarHBondContact O-N 3.08Å; R217-R219 VanDerWaalsContact C-N 3.32Å; R217-R219 PolarHBondContact O-N 2.84Å; R219-T223 PolarHBondContact O-N 2.86Å; R219-T223 VanDerWaalsContact O-N 3.1Å; R219-T223 PolarHBondContact O-OG1 3.43Å |
| 220 | E | 98.6 | Very high | 98.7 | Very high | 76 Ų | 76 | 98 Ų | 98 | 36% | 0.355 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.2 | -45.7 | 174.4 | -69.7 | -179.8 | 160.4 | 0 | 0 | 111.7 | R216 R217 E218 L222 T223 I224 | R216-E220 IonicContact CZ-OE1 2.82Å; R216-E220 IonicContact NH1-OE1 3.55Å; R216-E220 PolarHBondContact NH1-OE1 2.94Å; R216-E220 IonicContact NH1-OE2 3.86Å; R216-E220 IonicContact NH2-OE1 3.44Å; R216-E220 PolarHBondContact O-N 2.91Å; R216-E220 VanDerWaalsContact O-N 3.15Å; R217-E220 WeakPolarHBondContact CD-OE2 3.44Å; R217-E220 IonicContact NH1-OE2 3.17Å; R217-E220 WeakPolarHBondContact O-CB 3.25Å; R217-E220 PolarHBondContact O-N 3.05Å; R217-E220 VanDerWaalsContact O-N 3.15Å; E218-E220 VanDerWaalsContact C-N 3.34Å; E218-E220 PolarHBondContact O-N 2.93Å; E220-L222 VanDerWaalsContact C-N 3.35Å; E220-L222 PolarHBondContact O-N 3.34Å; E220-T223 WeakPolarHBondContact O-CB 3.48Å; E220-T223 PolarHBondContact O-N 3.18Å; E220-T223 VanDerWaalsContact O-N 3.1Å; E220-I224 WeakPolarHBondContact O-CG1 3.31Å; E220-I224 PolarHBondContact O-N 2.86Å |
| 221 | V | 98.8 | Very high | 98.7 | Very high | 89 Ų | 89 | 97.1 Ų | 97.1 | 54% | 0.539 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.1 | -45.7 | 178.4 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | R217 E218 T223 I224 Q225 | R217-V221 WeakPolarHBondContact O-CG2 3.35Å; R217-V221 PolarHBondContact O-N 3.36Å; E218-V221 PolarHBondContact O-N 3.24Å; V221-T223 VanDerWaalsContact C-N 3.25Å; V221-T223 PolarHBondContact O-N 2.83Å; V221-I224 PolarHBondContact O-N 3.46Å; V221-Q225 WeakPolarHBondContact O-CB 3.35Å; V221-Q225 PolarHBondContact O-N 3.12Å |
| 222 | L | 98.7 | Very high | 98.7 | Very high | 102 Ų | 102 | 95.9 Ų | 95.9 | 53% | 0.534 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60 | -37.7 | 175.8 | -71.8 | 172.2 | 0 | 0 | 0 | 112.1 | E218 E220 R226 | E218-L222 WeakPolarHBondContact O-CG 3.39Å; E218-L222 PolarHBondContact O-N 3.47Å; E220-L222 VanDerWaalsContact C-N 3.35Å; E220-L222 PolarHBondContact O-N 3.34Å; L222-R226 WeakPolarHBondContact O-CG 3.49Å; L222-R226 PolarHBondContact O-N 2.9Å |
| 223 | T | 98.7 | Very high | 98.7 | Very high | 91 Ų | 91 | 101 Ų | 101 | 56% | 0.558 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.5 | -46.1 | 177.3 | -58 | 0 | 0 | 0 | 0 | 111.2 | R219 E220 V221 R226 F227 | R219-T223 PolarHBondContact O-N 2.86Å; R219-T223 VanDerWaalsContact O-N 3.1Å; R219-T223 PolarHBondContact O-OG1 3.43Å; E220-T223 WeakPolarHBondContact O-CB 3.48Å; E220-T223 PolarHBondContact O-N 3.18Å; E220-T223 VanDerWaalsContact O-N 3.1Å; V221-T223 VanDerWaalsContact C-N 3.25Å; V221-T223 PolarHBondContact O-N 2.83Å; T223-R226 PolarHBondContact O-N 2.84Å; T223-F227 PolarHBondContact O-N 2.84Å; T223-F227 VanDerWaalsContact O-N 3.08Å |
| 224 | I | 98.8 | Very high | 98.7 | Very high | 100 Ų | 100 | 103.4 Ų | 103.4 | 51% | 0.513 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.7 | -44.3 | 176.4 | -66.7 | 166.4 | 0 | 0 | 0 | 110.3 | E220 V221 R226 F227 L228 | E220-I224 WeakPolarHBondContact O-CG1 3.31Å; E220-I224 PolarHBondContact O-N 2.86Å; V221-I224 PolarHBondContact O-N 3.46Å; I224-R226 PolarHBondContact O-N 3.31Å; I224-F227 WeakPolarHBondContact O-CB 3.29Å; I224-F227 PolarHBondContact O-N 3.31Å; I224-F227 VanDerWaalsContact O-N 3.15Å; I224-L228 HydrophobicContact CG2-CD1 3.95Å; I224-L228 HydrophobicContact CG2-CG 4.23Å; I224-L228 WeakPolarHBondContact O-CG 3.41Å; I224-L228 PolarHBondContact O-N 3.34Å |
| 225 | Q | 98.6 | Very high | 98.7 | Very high | 94 Ų | 94 | 103.9 Ų | 103.9 | 44% | 0.439 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -57.9 | -48.5 | 178.1 | -178 | -179.2 | -16.9 | 0 | 0 | 111.1 | V221 F227 L228 E229 | V221-Q225 WeakPolarHBondContact O-CB 3.35Å; V221-Q225 PolarHBondContact O-N 3.12Å; Q225-F227 VanDerWaalsContact C-N 3.28Å; Q225-F227 PolarHBondContact O-N 3.28Å; Q225-L228 PolarHBondContact O-N 3.38Å; Q225-E229 HydrophobicContact CG-CG 4.5Å; Q225-E229 WeakPolarHBondContact CG-OE1 3.39Å; Q225-E229 PolarHBondContact NE2-OE1 2.81Å; Q225-E229 WeakPolarHBondContact O-CG 3.45Å; Q225-E229 PolarHBondContact O-N 3.48Å |
| 226 | R | 98.8 | Very high | 98.7 | Very high | 189 Ų | 189 | 102.9 Ų | 102.9 | 71% | 0.713 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.5 | -39.2 | 176.6 | -74.9 | 177.6 | 71.2 | -152.4 | 2.6 | 112.4 | L222 T223 I224 A230 | L222-R226 WeakPolarHBondContact O-CG 3.49Å; L222-R226 PolarHBondContact O-N 2.9Å; T223-R226 PolarHBondContact O-N 2.84Å; I224-R226 PolarHBondContact O-N 3.31Å; R226-A230 WeakPolarHBondContact O-CB 3.42Å; R226-A230 PolarHBondContact O-N 3.45Å |
| 227 | F | 98.8 | Very high | 98.7 | Very high | 143 Ų | 143 | 101.4 Ų | 101.4 | 63% | 0.627 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.9 | -47 | 175.3 | 172.7 | -96.2 | 0 | 0 | 0 | 111.8 | T223 I224 Q225 E229 A230 A231 | T223-F227 PolarHBondContact O-N 2.84Å; T223-F227 VanDerWaalsContact O-N 3.08Å; I224-F227 WeakPolarHBondContact O-CB 3.29Å; I224-F227 PolarHBondContact O-N 3.31Å; I224-F227 VanDerWaalsContact O-N 3.15Å; Q225-F227 VanDerWaalsContact C-N 3.28Å; Q225-F227 PolarHBondContact O-N 3.28Å; F227-E229 PolarHBondContact O-N 3.03Å; F227-A230 PolarHBondContact O-N 3.48Å; F227-A231 WeakPolarHBondContact O-CB 3.35Å; F227-A231 PolarHBondContact O-N 3.43Å |
| 228 | L | 98.8 | Very high | 98.6 | Very high | 104 Ų | 104 | 96 Ų | 96 | 55% | 0.545 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.3 | -40.8 | 179.2 | -70 | 177.1 | 0 | 0 | 0 | 111.9 | I224 Q225 A231 A232 | I224-L228 HydrophobicContact CG2-CD1 3.95Å; I224-L228 HydrophobicContact CG2-CG 4.23Å; I224-L228 WeakPolarHBondContact O-CG 3.41Å; I224-L228 PolarHBondContact O-N 3.34Å; Q225-L228 PolarHBondContact O-N 3.38Å; L228-A231 PolarHBondContact O-N 2.84Å; L228-A232 WeakPolarHBondContact O-CB 3.48Å; L228-A232 PolarHBondContact O-N 3.16Å |
| 229 | E | 98.8 | Very high | 98.6 | Very high | 83 Ų | 83 | 96.8 Ų | 96.8 | 39% | 0.388 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 174.4 | -73.3 | 175.5 | -165.7 | 0 | 0 | 111.9 | Q225 F227 A232 R233 | Q225-E229 HydrophobicContact CG-CG 4.5Å; Q225-E229 WeakPolarHBondContact CG-OE1 3.39Å; Q225-E229 PolarHBondContact NE2-OE1 2.81Å; Q225-E229 WeakPolarHBondContact O-CG 3.45Å; Q225-E229 PolarHBondContact O-N 3.48Å; F227-E229 PolarHBondContact O-N 3.03Å; E229-A232 PolarHBondContact O-N 2.95Å; E229-R233 VanDerWaalsContact O-CG 3.31Å; E229-R233 WeakPolarHBondContact O-CG 3.36Å; E229-R233 PolarHBondContact O-N 2.65Å |
| 230 | A | 98.8 | Very high | 98.6 | Very high | 57 Ų | 57 | 95 Ų | 95 | 47% | 0.471 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -64.2 | -43.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | R226 F227 R233 Q234 | R226-A230 WeakPolarHBondContact O-CB 3.42Å; R226-A230 PolarHBondContact O-N 3.45Å; F227-A230 PolarHBondContact O-N 3.48Å; A230-R233 PolarHBondContact O-N 2.91Å; A230-Q234 WeakPolarHBondContact O-CB 3.42Å; A230-Q234 PolarHBondContact O-N 3.37Å |
| 231 | A | 98.8 | Very high | 98.6 | Very high | 42 Ų | 42 | 100.2 Ų | 100.2 | 35% | 0.347 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.5 | -43.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | F227 L228 R233 Q234 E235 | F227-A231 WeakPolarHBondContact O-CB 3.35Å; F227-A231 PolarHBondContact O-N 3.43Å; L228-A231 PolarHBondContact O-N 2.84Å; A231-R233 PolarHBondContact O-N 3.03Å; A231-Q234 PolarHBondContact O-N 2.97Å; A231-E235 WeakPolarHBondContact O-CB 3.42Å; A231-E235 PolarHBondContact O-N 3.39Å |
| 232 | A | 98.8 | Very high | 98.6 | Very high | 48 Ų | 48 | 101.1 Ų | 101.1 | 40% | 0.397 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63 | -40.9 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | L228 E229 E235 T236 | L228-A232 WeakPolarHBondContact O-CB 3.48Å; L228-A232 PolarHBondContact O-N 3.16Å; E229-A232 PolarHBondContact O-N 2.95Å; A232-E235 PolarHBondContact O-N 3.47Å; A232-T236 WeakPolarHBondContact O-CG2 3.35Å; A232-T236 PolarHBondContact O-N 3.22Å; A232-T236 PolarHBondContact O-OG1 3.08Å |
| 233 | R | 98.5 | Very high | 98.6 | Very high | 179 Ų | 179 | 101.5 Ų | 101.5 | 68% | 0.675 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.8 | -42.2 | 173.5 | -71.1 | 175.7 | -170 | -160.8 | 5.3 | 111.8 | E229 A230 A231 T236 S237 | E229-R233 VanDerWaalsContact O-CG 3.31Å; E229-R233 WeakPolarHBondContact O-CG 3.36Å; E229-R233 PolarHBondContact O-N 2.65Å; A230-R233 PolarHBondContact O-N 2.91Å; A231-R233 PolarHBondContact O-N 3.03Å; R233-T236 WeakPolarHBondContact CA-OG1 3.45Å; R233-T236 PolarHBondContact O-OG1 3.33Å; R233-S237 WeakPolarHBondContact O-CB 3.37Å; R233-S237 PolarHBondContact O-N 3.47Å; R233-S237 PolarHBondContact O-OG 2.95Å |
| 234 | Q | 98.4 | Very high | 98.6 | Very high | 126 Ų | 126 | 106.3 Ų | 106.3 | 59% | 0.589 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.6 | -44.9 | 176.8 | -177 | 61.5 | 20.8 | 0 | 0 | 111.1 | A230 A231 S237 G238 | A230-Q234 WeakPolarHBondContact O-CB 3.42Å; A230-Q234 PolarHBondContact O-N 3.37Å; A231-Q234 PolarHBondContact O-N 2.97Å; Q234-S237 PolarHBondContact O-N 3.37Å; Q234-S237 PolarHBondContact O-OG 3.3Å; Q234-G238 PolarHBondContact O-N 3.18Å |
| 235 | E | 98.7 | Very high | 98.6 | Very high | 107 Ų | 107 | 108 Ų | 108 | 50% | 0.5 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.9 | -48 | 178.4 | -170.6 | -165.6 | 148.2 | 0 | 0 | 111.8 | A231 A232 S237 G238 K239 | A231-E235 WeakPolarHBondContact O-CB 3.42Å; A231-E235 PolarHBondContact O-N 3.39Å; A232-E235 PolarHBondContact O-N 3.47Å; E235-S237 PolarHBondContact O-N 2.89Å; E235-G238 PolarHBondContact O-N 3Å; E235-K239 HydrophobicContact CG-CD 4.44Å; E235-K239 WeakPolarHBondContact O-CG 3.38Å; E235-K239 PolarHBondContact O-N 3.05Å; E235-K239 WeakPolarHBondContact OE1-CE 3.44Å; E235-K239 IonicContact OE1-NZ 3.56Å; E235-K239 PolarHBondContact OE1-NZ 3.42Å |
| 236 | T | 98.3 | Very high | 98.6 | Very high | 82 Ų | 82 | 107.5 Ų | 107.5 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.2 | -43.1 | 177.5 | 49.2 | 0 | 0 | 0 | 0 | 111.9 | A232 R233 G238 K239 V240 | A232-T236 WeakPolarHBondContact O-CG2 3.35Å; A232-T236 PolarHBondContact O-N 3.22Å; A232-T236 PolarHBondContact O-OG1 3.08Å; R233-T236 WeakPolarHBondContact CA-OG1 3.45Å; R233-T236 PolarHBondContact O-OG1 3.33Å; T236-G238 PolarHBondContact O-N 3.28Å; T236-K239 PolarHBondContact O-N 3.42Å; T236-V240 WeakPolarHBondContact O-CG2 3.22Å; T236-V240 PolarHBondContact O-N 3.08Å; T236-V240 VanDerWaalsContact O-N 3.08Å |
| 237 | S | 98.1 | Very high | 98.6 | Very high | 49 Ų | 49 | 103.5 Ų | 103.5 | 34% | 0.343 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.7 | -39.9 | 175.4 | 79.3 | 0 | 0 | 0 | 0 | 112.5 | R233 Q234 E235 V240 R241 | R233-S237 WeakPolarHBondContact O-CB 3.37Å; R233-S237 PolarHBondContact O-N 3.47Å; R233-S237 PolarHBondContact O-OG 2.95Å; Q234-S237 PolarHBondContact O-N 3.37Å; Q234-S237 PolarHBondContact O-OG 3.3Å; E235-S237 PolarHBondContact O-N 2.89Å; S237-V240 PolarHBondContact O-N 3.34Å; S237-R241 WeakPolarHBondContact O-CG 3.43Å; S237-R241 PolarHBondContact O-N 2.88Å |
| 238 | G | 98.4 | Very high | 98.6 | Very high | 17 Ų | 17 | 101.4 Ų | 101.4 | 18% | 0.175 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -62.5 | -44.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q234 E235 T236 R241 I242 | Q234-G238 PolarHBondContact O-N 3.18Å; E235-G238 PolarHBondContact O-N 3Å; T236-G238 PolarHBondContact O-N 3.28Å; G238-R241 PolarHBondContact O-N 3.48Å; G238-I242 WeakPolarHBondContact O-CG1 3.38Å; G238-I242 PolarHBondContact O-N 3.46Å |
| 239 | K | 98.6 | Very high | 98.6 | Very high | 124 Ų | 124 | 99.7 Ų | 99.7 | 54% | 0.539 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -58.1 | -48.3 | 175.4 | -78.4 | 174.2 | 168.2 | 169.2 | 0 | 111.8 | E235 T236 R241 I242 Q243 | E235-K239 HydrophobicContact CG-CD 4.44Å; E235-K239 WeakPolarHBondContact O-CG 3.38Å; E235-K239 PolarHBondContact O-N 3.05Å; E235-K239 WeakPolarHBondContact OE1-CE 3.44Å; E235-K239 IonicContact OE1-NZ 3.56Å; E235-K239 PolarHBondContact OE1-NZ 3.42Å; T236-K239 PolarHBondContact O-N 3.42Å; K239-R241 VanDerWaalsContact C-N 3.34Å; K239-R241 PolarHBondContact O-N 3.22Å; K239-I242 PolarHBondContact O-N 2.63Å; K239-Q243 WeakPolarHBondContact O-CB 3.45Å; K239-Q243 PolarHBondContact O-N 3.07Å |
| 240 | V | 98.6 | Very high | 98.6 | Very high | 93 Ų | 93 | 100.7 Ų | 100.7 | 56% | 0.564 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.5 | -41.7 | 178.1 | 173.1 | 0 | 0 | 0 | 0 | 111.7 | T236 S237 Q243 R244 | T236-V240 WeakPolarHBondContact O-CG2 3.22Å; T236-V240 PolarHBondContact O-N 3.08Å; T236-V240 VanDerWaalsContact O-N 3.08Å; S237-V240 PolarHBondContact O-N 3.34Å; V240-Q243 PolarHBondContact O-N 3.34Å; V240-R244 WeakPolarHBondContact O-CB 3.45Å; V240-R244 PolarHBondContact O-N 2.99Å |
| 241 | R | 98.4 | Very high | 98.6 | Very high | 186 Ų | 186 | 99.7 Ų | 99.7 | 70% | 0.702 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -61.7 | -45.6 | 177.3 | -75.4 | 177.2 | 59.7 | -148 | -5.2 | 112.2 | S237 G238 K239 F245 | S237-R241 WeakPolarHBondContact O-CG 3.43Å; S237-R241 PolarHBondContact O-N 2.88Å; G238-R241 PolarHBondContact O-N 3.48Å; K239-R241 VanDerWaalsContact C-N 3.34Å; K239-R241 PolarHBondContact O-N 3.22Å; R241-F245 PolarHBondContact O-N 3.45Å |
| 242 | I | 98.6 | Very high | 98.5 | Very high | 107 Ų | 107 | 105.4 Ų | 105.4 | 55% | 0.549 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.1 | -45.3 | 179 | -67.6 | 168.1 | 0 | 0 | 0 | 110.2 | G238 K239 R244 F245 I246 | G238-I242 WeakPolarHBondContact O-CG1 3.38Å; G238-I242 PolarHBondContact O-N 3.46Å; K239-I242 PolarHBondContact O-N 2.63Å; I242-R244 VanDerWaalsContact C-N 3.35Å; I242-R244 PolarHBondContact O-N 3.41Å; I242-F245 WeakPolarHBondContact O-CB 3.38Å; I242-F245 PolarHBondContact O-N 2.89Å; I242-F245 VanDerWaalsContact O-N 3.16Å; I242-I246 HydrophobicContact CG2-CD1 3.72Å; I242-I246 HydrophobicContact CG2-CG1 4.31Å; I242-I246 WeakPolarHBondContact O-CG1 3.43Å; I242-I246 PolarHBondContact O-N 2.93Å |
| 243 | Q | 98.6 | Very high | 98.5 | Very high | 111 Ų | 111 | 106.5 Ų | 106.5 | 52% | 0.519 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -55.4 | -50 | 176.8 | 178.6 | 174.3 | 1.7 | 0 | 0 | 111.3 | K239 V240 F245 I246 E247 | K239-Q243 WeakPolarHBondContact O-CB 3.45Å; K239-Q243 PolarHBondContact O-N 3.07Å; V240-Q243 PolarHBondContact O-N 3.34Å; Q243-F245 VanDerWaalsContact C-N 3.3Å; Q243-F245 PolarHBondContact O-N 2.92Å; Q243-I246 PolarHBondContact O-N 3.16Å; Q243-E247 HydrophobicContact CG-CG 4.45Å; Q243-E247 VanDerWaalsContact CG-OE1 3.24Å; Q243-E247 WeakPolarHBondContact CG-OE1 3.24Å; Q243-E247 PolarHBondContact NE2-OE1 3.05Å; Q243-E247 WeakPolarHBondContact O-CG 3.38Å; Q243-E247 PolarHBondContact O-N 3.14Å |
| 244 | R | 98.6 | Very high | 98.5 | Very high | 192 Ų | 192 | 99.7 Ų | 99.7 | 73% | 0.725 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -61.5 | -37.4 | 178.3 | -172.6 | 175.5 | -177.4 | 171.9 | 1.6 | 112.8 | V240 I242 N248 | V240-R244 WeakPolarHBondContact O-CB 3.45Å; V240-R244 PolarHBondContact O-N 2.99Å; I242-R244 VanDerWaalsContact C-N 3.35Å; I242-R244 PolarHBondContact O-N 3.41Å; R244-N248 WeakPolarHBondContact O-CB 3.45Å; R244-N248 PolarHBondContact O-N 3.35Å |
| 245 | F | 98.6 | Very high | 98.5 | Very high | 135 Ų | 135 | 98.3 Ų | 98.3 | 59% | 0.592 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -64.1 | -46.3 | 175.3 | 173.9 | -99.1 | 0 | 0 | 0 | 111.5 | R241 I242 Q243 N248 L249 | R241-F245 PolarHBondContact O-N 3.45Å; I242-F245 WeakPolarHBondContact O-CB 3.38Å; I242-F245 PolarHBondContact O-N 2.89Å; I242-F245 VanDerWaalsContact O-N 3.16Å; Q243-F245 VanDerWaalsContact C-N 3.3Å; Q243-F245 PolarHBondContact O-N 2.92Å; F245-N248 PolarHBondContact O-N 3.37Å; F245-L249 HydrophobicContact CE1-CD2 4.35Å; F245-L249 WeakPolarHBondContact O-CB 3.36Å; F245-L249 PolarHBondContact O-N 3.18Å |
| 246 | I | 98.7 | Very high | 98.4 | Very high | 83 Ų | 83 | 95.6 Ų | 95.6 | 43% | 0.426 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -61.9 | -47.9 | 177.9 | -67.5 | 169.8 | 0 | 0 | 0 | 110.3 | I242 Q243 N248 L249 L250 | I242-I246 HydrophobicContact CG2-CD1 3.72Å; I242-I246 HydrophobicContact CG2-CG1 4.31Å; I242-I246 WeakPolarHBondContact O-CG1 3.43Å; I242-I246 PolarHBondContact O-N 2.93Å; Q243-I246 PolarHBondContact O-N 3.16Å; I246-N248 VanDerWaalsContact C-N 3.32Å; I246-N248 PolarHBondContact O-N 3.03Å; I246-L249 PolarHBondContact O-N 2.92Å; I246-L249 VanDerWaalsContact O-N 3.14Å; I246-L250 HydrophobicContact CG2-CD1 3.77Å; I246-L250 HydrophobicContact CG2-CG 4.16Å; I246-L250 WeakPolarHBondContact O-CB 3.44Å; I246-L250 VanDerWaalsContact O-CG 3.29Å; I246-L250 WeakPolarHBondContact O-CG 3.39Å; I246-L250 PolarHBondContact O-N 2.84Å |
| 247 | E | 98.6 | Very high | 98.3 | Very high | 106 Ų | 106 | 97 Ų | 97 | 50% | 0.495 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -58.6 | -42.3 | 177.8 | -72.7 | 168.3 | -176.8 | 0 | 0 | 112 | Q243 G251 | Q243-E247 HydrophobicContact CG-CG 4.45Å; Q243-E247 VanDerWaalsContact CG-OE1 3.24Å; Q243-E247 WeakPolarHBondContact CG-OE1 3.24Å; Q243-E247 PolarHBondContact NE2-OE1 3.05Å; Q243-E247 WeakPolarHBondContact O-CG 3.38Å; Q243-E247 PolarHBondContact O-N 3.14Å; E247-G251 PolarHBondContact O-N 3.34Å |
| 248 | N | 98.6 | Very high | 98.2 | Very high | 98 Ų | 98 | 101.8 Ų | 101.8 | 52% | 0.524 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.9 | -43.6 | 175.3 | -175.9 | -95.1 | 0 | 0 | 0 | 112.2 | R244 F245 I246 G251 R252 | R244-N248 WeakPolarHBondContact O-CB 3.45Å; R244-N248 PolarHBondContact O-N 3.35Å; F245-N248 PolarHBondContact O-N 3.37Å; I246-N248 VanDerWaalsContact C-N 3.32Å; I246-N248 PolarHBondContact O-N 3.03Å; N248-G251 PolarHBondContact O-N 2.96Å; N248-R252 WeakPolarHBondContact O-CG 3.41Å; N248-R252 PolarHBondContact O-N 2.9Å |
| 249 | L | 98.7 | Very high | 98 | Very high | 68 Ų | 68 | 105.7 Ų | 105.7 | 36% | 0.356 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.9 | -46.3 | 179.2 | -175.5 | 61.5 | 0 | 0 | 0 | 111.1 | F245 I246 G251 R252 I253 | F245-L249 HydrophobicContact CE1-CD2 4.35Å; F245-L249 WeakPolarHBondContact O-CB 3.36Å; F245-L249 PolarHBondContact O-N 3.18Å; I246-L249 PolarHBondContact O-N 2.92Å; I246-L249 VanDerWaalsContact O-N 3.14Å; L249-G251 VanDerWaalsContact C-N 3.32Å; L249-G251 PolarHBondContact O-N 3.44Å; L249-R252 PolarHBondContact O-N 3.18Å; L249-I253 HydrophobicContact CD1-CD1 4.43Å; L249-I253 HydrophobicContact CG-CD1 4.02Å; L249-I253 WeakPolarHBondContact O-CG1 3.46Å; L249-I253 PolarHBondContact O-N 2.94Å |
| 250 | L | 98.6 | Very high | 97.8 | Very high | 104 Ų | 104 | 103.5 Ų | 103.5 | 55% | 0.545 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.5 | -41.9 | 175.3 | -69.5 | 174.1 | 0 | 0 | 0 | 111.6 | I246 R252 I253 A254 | I246-L250 HydrophobicContact CG2-CD1 3.77Å; I246-L250 HydrophobicContact CG2-CG 4.16Å; I246-L250 WeakPolarHBondContact O-CB 3.44Å; I246-L250 VanDerWaalsContact O-CG 3.29Å; I246-L250 WeakPolarHBondContact O-CG 3.39Å; I246-L250 PolarHBondContact O-N 2.84Å; L250-R252 PolarHBondContact O-N 3.43Å; L250-I253 PolarHBondContact O-N 3.02Å; L250-A254 WeakPolarHBondContact O-CB 3.29Å; L250-A254 PolarHBondContact O-N 3.35Å |
| 251 | G | 98.4 | Very high | 97.6 | Very high | 36 Ų | 36 | 104.5 Ų | 104.5 | 37% | 0.371 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61.6 | -39.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | E247 N248 L249 L255 | E247-G251 PolarHBondContact O-N 3.34Å; N248-G251 PolarHBondContact O-N 2.96Å; L249-G251 VanDerWaalsContact C-N 3.32Å; L249-G251 PolarHBondContact O-N 3.44Å; G251-L255 WeakPolarHBondContact O-CG 3.41Å; G251-L255 PolarHBondContact O-N 3.2Å |
| 252 | R | 98.4 | Very high | 97.3 | Very high | 162 Ų | 162 | 102.2 Ų | 102.2 | 61% | 0.611 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -67.9 | -40.7 | 175.1 | -71.4 | 171.8 | 60.3 | -157.8 | -2.9 | 112.1 | N248 L249 L250 L255 A256 | N248-R252 WeakPolarHBondContact O-CG 3.41Å; N248-R252 PolarHBondContact O-N 2.9Å; L249-R252 PolarHBondContact O-N 3.18Å; L250-R252 PolarHBondContact O-N 3.43Å; R252-L255 PolarHBondContact O-N 3.21Å; R252-A256 PolarHBondContact O-N 3.29Å |
| 253 | I | 98.4 | Very high | 96.9 | Very high | 72 Ų | 72 | 104.6 Ų | 104.6 | 37% | 0.369 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62 | -49.2 | 176.2 | -68.9 | 166.3 | 0 | 0 | 0 | 110.1 | L249 L250 L255 A256 E257 | L249-I253 HydrophobicContact CD1-CD1 4.43Å; L249-I253 HydrophobicContact CG-CD1 4.02Å; L249-I253 WeakPolarHBondContact O-CG1 3.46Å; L249-I253 PolarHBondContact O-N 2.94Å; L250-I253 PolarHBondContact O-N 3.02Å; I253-L255 PolarHBondContact O-N 3.36Å; I253-A256 CarbonylContact O-C 3.58Å; I253-A256 WeakPolarHBondContact O-CA 3.31Å; I253-A256 WeakPolarHBondContact O-CB 3.45Å; I253-A256 PolarHBondContact O-N 3.04Å; I253-E257 HydrophobicContact CG2-CG 4.23Å; I253-E257 WeakPolarHBondContact O-CG 3.33Å; I253-E257 PolarHBondContact O-N 2.97Å |
| 254 | A | 98.2 | Very high | 96.3 | Very high | 36 Ų | 36 | 106.1 Ų | 106.1 | 30% | 0.298 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62 | -28.7 | 179 | 0 | 0 | 0 | 0 | 0 | 113.6 | L250 R258 | L250-A254 WeakPolarHBondContact O-CB 3.29Å; L250-A254 PolarHBondContact O-N 3.35Å; A254-R258 WeakPolarHBondContact O-CG 3.36Å; A254-R258 PolarHBondContact O-N 2.92Å; A254-R258 PolarHBondContact O-NE 3.09Å; A254-R258 VanDerWaalsContact O-NE 3.09Å |
| 255 | L | 97.8 | Very high | 95.4 | Very high | 97 Ų | 97 | 102.8 Ų | 102.8 | 51% | 0.508 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -71 | -44.7 | 170.1 | -73.8 | 169.7 | 0 | 0 | 0 | 111.6 | G251 R252 I253 R258 L259 | G251-L255 WeakPolarHBondContact O-CG 3.41Å; G251-L255 PolarHBondContact O-N 3.2Å; R252-L255 PolarHBondContact O-N 3.21Å; I253-L255 PolarHBondContact O-N 3.36Å; L255-R258 VanDerWaalsContact CD2-NH2 3.27Å; L255-R258 PolarHBondContact O-N 2.9Å; L255-L259 WeakPolarHBondContact O-CG 3.08Å; L255-L259 PolarHBondContact O-N 3.24Å |
| 256 | A | 97.5 | Very high | 94.1 | Very high | 49 Ų | 49 | 101.2 Ų | 101.2 | 41% | 0.405 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.9 | -43.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | R252 I253 L259 V260 | R252-A256 PolarHBondContact O-N 3.29Å; I253-A256 CarbonylContact O-C 3.58Å; I253-A256 WeakPolarHBondContact O-CA 3.31Å; I253-A256 WeakPolarHBondContact O-CB 3.45Å; I253-A256 PolarHBondContact O-N 3.04Å; A256-L259 PolarHBondContact O-N 3.41Å; A256-V260 VanDerWaalsContact O-CG2 3.31Å; A256-V260 WeakPolarHBondContact O-CG2 3.41Å; A256-V260 PolarHBondContact O-N 2.84Å |
| 257 | E | 96.3 | Very high | 92.2 | Very high | 111 Ų | 111 | 100 Ų | 100 | 52% | 0.519 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -58.3 | -49.8 | 175.9 | -72.6 | 172.2 | 164.1 | 0 | 0 | 111.4 | I253 L259 V260 E261 | I253-E257 HydrophobicContact CG2-CG 4.23Å; I253-E257 WeakPolarHBondContact O-CG 3.33Å; I253-E257 PolarHBondContact O-N 2.97Å; E257-L259 VanDerWaalsContact C-N 3.3Å; E257-L259 PolarHBondContact O-N 3.37Å; E257-V260 PolarHBondContact O-N 3.32Å; E257-V260 VanDerWaalsContact O-N 3.15Å; E257-E261 WeakPolarHBondContact O-CG 3.46Å; E257-E261 PolarHBondContact O-N 3.33Å |
| 258 | R | 96.1 | Very high | 89.9 | Confident | 150 Ų | 150 | 98 Ų | 98 | 57% | 0.566 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -59.5 | -38.3 | 176.2 | -77.3 | -177.6 | -72.4 | -163.5 | -1.6 | 113.2 | A254 L255 Y262 | A254-R258 WeakPolarHBondContact O-CG 3.36Å; A254-R258 PolarHBondContact O-N 2.92Å; A254-R258 PolarHBondContact O-NE 3.09Å; A254-R258 VanDerWaalsContact O-NE 3.09Å; L255-R258 VanDerWaalsContact CD2-NH2 3.27Å; L255-R258 PolarHBondContact O-N 2.9Å; R258-Y262 VanDerWaalsContact O-CB 3.31Å; R258-Y262 WeakPolarHBondContact O-CB 3.41Å; R258-Y262 PolarHBondContact O-N 2.94Å |
| 259 | L | 94.5 | Very high | 87.7 | Confident | 99 Ų | 99 | 99.5 Ų | 99.5 | 52% | 0.518 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -66.3 | -45 | 175.8 | -72.9 | 171.4 | 0 | 0 | 0 | 111.1 | L255 A256 E257 Y262 Y263 | L255-L259 WeakPolarHBondContact O-CG 3.08Å; L255-L259 PolarHBondContact O-N 3.24Å; A256-L259 PolarHBondContact O-N 3.41Å; E257-L259 VanDerWaalsContact C-N 3.3Å; E257-L259 PolarHBondContact O-N 3.37Å; L259-Y262 WeakPolarHBondContact O-CB 3.25Å; L259-Y262 PolarHBondContact O-N 3.49Å; L259-Y263 WeakPolarHBondContact O-CD2 3.17Å; L259-Y263 PolarHBondContact O-N 3.32Å |
| 260 | V | 93.8 | Very high | 85.4 | Confident | 78 Ų | 78 | 100.8 Ų | 100.8 | 47% | 0.473 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60.6 | -47.1 | 176.9 | 168.9 | 0 | 0 | 0 | 0 | 110.7 | A256 E257 Y262 Y263 Q264 | A256-V260 VanDerWaalsContact O-CG2 3.31Å; A256-V260 WeakPolarHBondContact O-CG2 3.41Å; A256-V260 PolarHBondContact O-N 2.84Å; E257-V260 PolarHBondContact O-N 3.32Å; E257-V260 VanDerWaalsContact O-N 3.15Å; V260-Y262 PolarHBondContact O-N 3.15Å; V260-Y263 PolarHBondContact O-N 2.85Å; V260-Q264 HydrophobicContact CG1-CG 4.34Å; V260-Q264 WeakPolarHBondContact O-CB 3.5Å; V260-Q264 VanDerWaalsContact O-CG 3.25Å; V260-Q264 WeakPolarHBondContact O-CG 3.26Å; V260-Q264 PolarHBondContact O-N 3.06Å |
| 261 | E | 93.3 | Very high | 83.6 | Confident | 115 Ų | 115 | 102.3 Ų | 102.3 | 54% | 0.537 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -58.8 | -46 | 174.8 | -73.4 | 173.5 | 179.2 | 0 | 0 | 111.9 | E257 Y263 Q264 V265 | E257-E261 WeakPolarHBondContact O-CG 3.46Å; E257-E261 PolarHBondContact O-N 3.33Å; E261-Y263 VanDerWaalsContact C-N 3.33Å; E261-Y263 PolarHBondContact O-N 2.9Å; E261-Q264 PolarHBondContact O-N 3.05Å; E261-V265 WeakPolarHBondContact O-CB 3.44Å; E261-V265 WeakPolarHBondContact O-CG2 3.31Å; E261-V265 PolarHBondContact O-N 3.3Å |
| 262 | Y | 93.3 | Very high | 81.1 | Confident | 138 Ų | 138 | 103.9 Ų | 103.9 | 54% | 0.541 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -56.6 | -45.3 | 177.6 | 174.8 | -90.7 | 0 | 0 | 0 | 112 | R258 L259 V260 N266 | R258-Y262 VanDerWaalsContact O-CB 3.31Å; R258-Y262 WeakPolarHBondContact O-CB 3.41Å; R258-Y262 PolarHBondContact O-N 2.94Å; L259-Y262 WeakPolarHBondContact O-CB 3.25Å; L259-Y262 PolarHBondContact O-N 3.49Å; V260-Y262 PolarHBondContact O-N 3.15Å; Y262-N266 WeakPolarHBondContact CD2-ND2 3.44Å; Y262-N266 WeakPolarHBondContact CE2-ND2 3.04Å; Y262-N266 VanDerWaalsContact O-CB 3.26Å; Y262-N266 WeakPolarHBondContact O-CB 3.33Å; Y262-N266 PolarHBondContact O-N 2.96Å; Y262-N266 PolarHBondContact O-ND2 2.91Å |
| 263 | Y | 89.6 | Confident | 78.4 | Confident | 156 Ų | 156 | 103.7 Ų | 103.7 | 61% | 0.612 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -75.4 | -30.5 | 178.8 | -72.3 | -66 | 0 | 0 | 0 | 113.1 | L259 V260 E261 G267 | L259-Y263 WeakPolarHBondContact O-CD2 3.17Å; L259-Y263 PolarHBondContact O-N 3.32Å; V260-Y263 PolarHBondContact O-N 2.85Å; E261-Y263 VanDerWaalsContact C-N 3.33Å; E261-Y263 PolarHBondContact O-N 2.9Å; Y263-G267 WeakPolarHBondContact O-CA 3.13Å; Y263-G267 PolarHBondContact O-N 3.22Å |
| 264 | Q | 86.6 | Confident | 76 | Confident | 144 Ų | 144 | 110.4 Ų | 110.4 | 67% | 0.673 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -68.3 | -38.2 | 173.8 | -74.5 | 175.1 | 11.7 | 0 | 0 | 112 | V260 E261 | V260-Q264 HydrophobicContact CG1-CG 4.34Å; V260-Q264 WeakPolarHBondContact O-CB 3.5Å; V260-Q264 VanDerWaalsContact O-CG 3.25Å; V260-Q264 WeakPolarHBondContact O-CG 3.26Å; V260-Q264 PolarHBondContact O-N 3.06Å; E261-Q264 PolarHBondContact O-N 3.05Å |
| 265 | V | 80.3 | Confident | 73.4 | Confident | 122 Ų | 122 | 116.1 Ų | 116.1 | 74% | 0.739 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -78.5 | -37.9 | 179.5 | 173.3 | 0 | 0 | 0 | 0 | 112.1 | E261 | E261-V265 WeakPolarHBondContact O-CB 3.44Å; E261-V265 WeakPolarHBondContact O-CG2 3.31Å; E261-V265 PolarHBondContact O-N 3.3Å |
| 266 | N | 71 | Confident | 70.7 | Confident | 102 Ų | 102 | 120.9 Ų | 120.9 | 55% | 0.545 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -95.6 | -1.5 | -178.5 | -63 | -47.7 | 0 | 0 | 0 | 114.4 | Y262 | Y262-N266 WeakPolarHBondContact CD2-ND2 3.44Å; Y262-N266 WeakPolarHBondContact CE2-ND2 3.04Å; Y262-N266 VanDerWaalsContact O-CB 3.26Å; Y262-N266 WeakPolarHBondContact O-CB 3.33Å; Y262-N266 PolarHBondContact O-N 2.96Å; Y262-N266 PolarHBondContact O-ND2 2.91Å |
| 267 | G | 57.3 | Low | 68.4 | Low | 58 Ų | 58 | 124.3 Ų | 124.3 | 60% | 0.598 | 67% | 0.674 | S | S | * | * | trans | -116.4 | 35.5 | -169.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | Y263 | Y263-G267 WeakPolarHBondContact O-CA 3.13Å; Y263-G267 PolarHBondContact O-N 3.22Å | ||
| 268 | G | 50.8 | Low | 65.9 | Low | 64 Ų | 64 | 127 Ų | 127 | 66% | 0.66 | 69% | 0.686 | S | S | * | * | trans | -99 | 122.7 | 156.9 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 269 | P | 52.3 | Low | 63.4 | Low | 129 Ų | 129 | 127.7 Ų | 127.7 | 84% | 0.838 | 70% | 0.696 | S | S | * | * | S | Bend | -137.7 | 160.3 | 54.7 | 37.6 | -20.5 | 0 | 0 | 0 | 118.3 | |||
| 270 | A | 50.6 | Low | 60.8 | Low | 95 Ų | 95 | 131.4 Ų | 131.4 | 79% | 0.785 | 71% | 0.71 | S | S | * | * | trans | 77.6 | 130.9 | 150.9 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 271 | P | 60.2 | Low | 58.9 | Low | 136 Ų | 136 | 132.3 Ų | 132.3 | 88% | 0.883 | 72% | 0.718 | S | S | * | * | trans | -87.7 | 129.9 | 174.4 | 35 | -29 | 0 | 0 | 0 | 110.9 | ||||
| 272 | G | 47 | Very low | 56.5 | Low | 68 Ų | 68 | 134 Ų | 134 | 70% | 0.701 | 73% | 0.73 | S | S | * | * | trans | -176.2 | 125.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 273 | D | 41 | Very low | 54.3 | Low | 159 Ų | 159 | 132.7 Ų | 132.7 | 85% | 0.85 | 74% | 0.736 | S | S | * | * | trans | 71.2 | 91.6 | 169.3 | -65.8 | -19.6 | 0 | 0 | 0 | 116.1 | ||||
| 274 | R | 48.2 | Very low | 52.2 | Low | 212 Ų | 212 | 132.1 Ų | 132.1 | 80% | 0.8 | 74% | 0.739 | S | S | * | * | 50.6 | 109.4 | 56.4 | -116.8 | -177.2 | -163.5 | -159 | 6 | 111.9 | |||||
| 275 | H | 43.5 | Very low | 50.2 | Low | 157 Ų | 157 | 134.4 Ų | 134.4 | 73% | 0.727 | 74% | 0.741 | S | S | * | * | trans | 87.1 | 104.9 | 163 | -39 | 97.7 | 0 | 0 | 0 | 117.4 | ||||
| 276 | K | 41.8 | Very low | 48.5 | Very low | 197 Ų | 197 | 135.4 Ų | 135.4 | 86% | 0.857 | 74% | 0.741 | S | S | * | * | -167.7 | 119.3 | 94.3 | -99.2 | 172.7 | -177.5 | -179.2 | 0 | 111.2 | Q278 | K276-Q278 PolarHBondContact O-N 2.91Š| |||
| 277 | V | 49.2 | Very low | 47.4 | Very low | 120 Ų | 120 | 139.6 Ų | 139.6 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | trans | -54.5 | 118.6 | 157.7 | 170 | 0 | 0 | 0 | 0 | 108 | Q279 | V277-Q279 HydrophobicContact CG1-CG 3.82Š| ||
| 278 | Q | 44.1 | Very low | 46.9 | Very low | 167 Ų | 167 | 143.7 Ų | 143.7 | 78% | 0.78 | 79% | 0.787 | S | S | * | * | trans | -117.6 | 93.3 | 158.5 | -159.7 | 84.1 | 42.8 | 0 | 0 | 106.8 | K276 | K276-Q278 PolarHBondContact O-N 2.91Š| ||
| 279 | Q | 43.6 | Very low | 46.7 | Very low | 166 Ų | 166 | 147.8 Ų | 147.8 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | -63.1 | 130.8 | 162.1 | -66.7 | 176.4 | 12.8 | 0 | 0 | 107.7 | V277 | V277-Q279 HydrophobicContact CG1-CG 3.82Š| ||
| 280 | H | 38.9 | Very low | 46.4 | Very low | 176 Ų | 176 | 148.9 Ų | 148.9 | 82% | 0.815 | 79% | 0.791 | S | S | * | * | trans | -123.8 | 113.2 | 163 | -135.5 | -76.8 | 0 | 0 | 0 | 107.2 | ||||
| 281 | P | 55 | Low | 46.1 | Very low | 97 Ų | 97 | 152.1 Ų | 152.1 | 63% | 0.63 | 79% | 0.792 | S | S | * | * | trans | -95.5 | 173.4 | 170.7 | 36.9 | -29 | 0 | 0 | 0 | 110.8 | ||||
| 282 | L | 42.6 | Very low | 45.2 | Very low | 152 Ų | 152 | 153.1 Ų | 153.1 | 80% | 0.796 | 79% | 0.786 | S | S | * | * | trans | 92.4 | 101.3 | 171 | -65 | 153.9 | 0 | 0 | 0 | 114.3 | ||||
| 283 | V | 47.1 | Very low | 45.1 | Very low | 110 Ų | 110 | 158.7 Ų | 158.7 | 67% | 0.667 | 79% | 0.792 | S | S | * | * | 102.7 | 134.3 | 54.4 | 161.7 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 284 | E | 44.8 | Very low | 45.4 | Very low | 143 Ų | 143 | 158.7 Ų | 158.7 | 67% | 0.668 | 79% | 0.788 | S | S | * | * | trans | 73.2 | 139.6 | 160.9 | -86.2 | 178.5 | 166.7 | 0 | 0 | 116.8 | ||||
| 285 | R | 46 | Very low | 45.2 | Very low | 193 Ų | 193 | 154.6 Ų | 154.6 | 73% | 0.728 | 79% | 0.787 | S | S | * | * | cis | 178.4 | 165.4 | -0.3 | -140.3 | 179.6 | -149.9 | 178 | 10.2 | 106 | ||||
| 286 | I | 44.4 | Very low | 45.3 | Very low | 142 Ų | 142 | 154.4 Ų | 154.4 | 73% | 0.728 | 79% | 0.792 | S | S | * | * | trans | 91.6 | 122.4 | 146.9 | -62.2 | 151.7 | 0 | 0 | 0 | 118.7 | ||||
| 287 | S | 46.6 | Very low | 45.7 | Very low | 190 Ų | 190 | 150.5 Ų | 150.5 | 100% | 1.329 | 79% | 0.786 | S | S | * | * | trans | 81.6 | 0 | 153 | -71.5 | 0 | 0 | 0 | 0 | 119.6 |
Retrieved 287 of 287 residues in 82.6 ms
(Link to these results)