| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 54.5 | Low | 67.6 | Low | 191 Ų | 191 | 95.8 Ų | 95.8 | 94% | 0.941 | 55% | 0.546 | S | S | * | . | 0 | -78 | 0 | -62.3 | -158.4 | -153.6 | 0 | 0 | 111.9 | D4 I5 | M1-D4 PolarHBondContact N-OD2 3.3Å; M1-D4 PolarHBondContact O-N 3.29Å; M1-I5 WeakPolarHBondContact O-CD1 3.47Å; M1-I5 VanDerWaalsContact O-CG1 3.31Å; M1-I5 WeakPolarHBondContact O-CG1 3.48Å; M1-I5 PolarHBondContact O-N 3.11Å | |||
| 2 | A | 59.3 | Low | 68.8 | Low | 73 Ų | 73 | 92.7 Ų | 92.7 | 60% | 0.603 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -68.9 | -37.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | D4 L6 | A2-D4 VanDerWaalsContact C-N 3.35Å; A2-L6 WeakPolarHBondContact O-CD1 3.47Å; A2-L6 WeakPolarHBondContact O-CG 3.49Å; A2-L6 PolarHBondContact O-N 3.06Å |
| 3 | K | 57.7 | Low | 69.7 | Low | 169 Ų | 169 | 92.4 Ų | 92.4 | 74% | 0.735 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.9 | -34.9 | 174.4 | -94 | -173.5 | 171 | -174.1 | 0 | 113.1 | G7 | K3-G7 PolarHBondContact O-N 3.4Å |
| 4 | D | 62.6 | Low | 70.4 | Confident | 104 Ų | 104 | 87.1 Ų | 87.1 | 56% | 0.556 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -71.9 | -42.2 | -179.8 | -57.2 | -55.4 | 0 | 0 | 0 | 111.8 | M1 A2 L6 G7 E8 | M1-D4 PolarHBondContact N-OD2 3.3Å; M1-D4 PolarHBondContact O-N 3.29Å; A2-D4 VanDerWaalsContact C-N 3.35Å; D4-L6 VanDerWaalsContact C-N 3.32Å; D4-L6 PolarHBondContact O-N 3.26Å; D4-G7 PolarHBondContact O-N 2.85Å; D4-E8 WeakPolarHBondContact O-CG 3.5Å; D4-E8 PolarHBondContact O-N 3.02Å |
| 5 | I | 68.5 | Low | 71 | Confident | 111 Ų | 111 | 93.9 Ų | 93.9 | 57% | 0.569 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65.2 | -37.1 | 178.1 | -60.5 | 162.9 | 0 | 0 | 0 | 111.2 | M1 A9 | M1-I5 WeakPolarHBondContact O-CD1 3.47Å; M1-I5 VanDerWaalsContact O-CG1 3.31Å; M1-I5 WeakPolarHBondContact O-CG1 3.48Å; M1-I5 PolarHBondContact O-N 3.11Å; I5-A9 PolarHBondContact O-N 3.18Å |
| 6 | L | 67 | Low | 71.8 | Confident | 47 Ų | 47 | 95.9 Ų | 95.9 | 25% | 0.246 | 52% | 0.519 | C | S | . | . | H | α-helix | trans | -71.5 | -39.1 | 176.5 | -70.5 | 167.7 | 0 | 0 | 0 | 111.5 | A2 D4 A9 G10 L11 F13 L19 | A2-L6 WeakPolarHBondContact O-CD1 3.47Å; A2-L6 WeakPolarHBondContact O-CG 3.49Å; A2-L6 PolarHBondContact O-N 3.06Å; D4-L6 VanDerWaalsContact C-N 3.32Å; D4-L6 PolarHBondContact O-N 3.26Å; L6-A9 CarbonylContact O-C 3.55Å; L6-A9 PolarHBondContact O-N 3.44Å; L6-G10 PolarHBondContact O-N 3.32Å; L6-L11 CarbonylContact C-O 3.58Å; L6-L11 HydrophobicContact CB-CB 4.35Å; L6-L11 HydrophobicContact CD2-CB 4.28Å; L6-L11 HydrophobicContact CD2-CD1 3.91Å; L6-L11 WeakPolarHBondContact O-CA 3.45Å; L6-L11 WeakPolarHBondContact O-CB 3.22Å; L6-L11 PolarHBondContact O-N 3.05Å; L6-L11 VanDerWaalsContact O-O 3.13Å; L6-F13 HydrophobicContact CD1-CE2 3.43Å; L6-F13 VanDerWaalsContact CD1-CE2 3.43Å; L6-F13 HydrophobicContact CD1-CZ 3.78Å; L6-L19 HydrophobicContact CD2-CD1 4.42Å |
| 7 | G | 68.1 | Low | 72.3 | Confident | 42 Ų | 42 | 98.2 Ų | 98.2 | 43% | 0.433 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -61.9 | -41.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113 | K3 D4 A9 G10 | K3-G7 PolarHBondContact O-N 3.4Å; D4-G7 PolarHBondContact O-N 2.85Å; G7-A9 PolarHBondContact O-N 3.1Å; G7-G10 PolarHBondContact O-N 2.83Å; G7-G10 VanDerWaalsContact O-N 3.09Å |
| 8 | E | 71.5 | Confident | 72.8 | Confident | 170 Ų | 170 | 99.4 Ų | 99.4 | 79% | 0.794 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.4 | -27 | 174.3 | -75.5 | 177.4 | 178.2 | 0 | 0 | 113.1 | D4 G10 | D4-E8 WeakPolarHBondContact O-CG 3.5Å; D4-E8 PolarHBondContact O-N 3.02Å; E8-G10 VanDerWaalsContact C-N 3.33Å |
| 9 | A | 77.1 | Confident | 73.5 | Confident | 67 Ų | 67 | 99.1 Ų | 99.1 | 55% | 0.554 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.5 | 2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | I5 L6 G7 L11 | I5-A9 PolarHBondContact O-N 3.18Å; L6-A9 CarbonylContact O-C 3.55Å; L6-A9 PolarHBondContact O-N 3.44Å; G7-A9 PolarHBondContact O-N 3.1Å; A9-L11 VanDerWaalsContact C-N 3.33Å; A9-L11 HydrophobicContact CB-CD1 4.24Å; A9-L11 HydrophobicContact CB-CG 4.44Å |
| 10 | G | 76.1 | Confident | 73.8 | Confident | 31 Ų | 31 | 100.4 Ų | 100.4 | 32% | 0.32 | 53% | 0.526 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.6 | 23.2 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | L6 G7 E8 H12 | L6-G10 PolarHBondContact O-N 3.32Å; G7-G10 PolarHBondContact O-N 2.83Å; G7-G10 VanDerWaalsContact O-N 3.09Å; E8-G10 VanDerWaalsContact C-N 3.33Å; G10-H12 PolarHBondContact O-CD2 3.08Å |
| 11 | L | 81.8 | Confident | 74.3 | Confident | 49 Ų | 49 | 101.5 Ų | 101.5 | 26% | 0.257 | 54% | 0.536 | S | S | . | . | trans | -106.6 | 123.4 | -179.9 | -64.2 | 168.7 | 0 | 0 | 0 | 110.3 | L6 A9 L19 R20 V21 | L6-L11 CarbonylContact C-O 3.58Å; L6-L11 HydrophobicContact CB-CB 4.35Å; L6-L11 HydrophobicContact CD2-CB 4.28Å; L6-L11 HydrophobicContact CD2-CD1 3.91Å; L6-L11 WeakPolarHBondContact O-CA 3.45Å; L6-L11 WeakPolarHBondContact O-CB 3.22Å; L6-L11 PolarHBondContact O-N 3.05Å; L6-L11 VanDerWaalsContact O-O 3.13Å; A9-L11 VanDerWaalsContact C-N 3.33Å; A9-L11 HydrophobicContact CB-CD1 4.24Å; A9-L11 HydrophobicContact CB-CG 4.44Å; L11-L19 HydrophobicContact CB-CD1 4.22Å; L11-L19 HydrophobicContact CB-CG 4.38Å; L11-L19 HydrophobicContact CD1-CD2 4.16Å; L11-L19 HydrophobicContact CD2-CD2 4.03Å; L11-L19 HydrophobicContact CD2-CG 4.29Å; L11-R20 CarbonylContact C-O 3.56Å; L11-R20 WeakPolarHBondContact CA-O 3.45Å; L11-V21 HydrophobicContact CD2-CG1 4.08Å | ||
| 12 | H | 81.3 | Confident | 75.5 | Confident | 58 Ų | 58 | 97.1 Ų | 97.1 | 27% | 0.269 | 52% | 0.516 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 151.7 | -177 | -57.4 | -100.3 | 0 | 0 | 0 | 110 | G10 L19 R20 D23 | G10-H12 PolarHBondContact O-CD2 3.08Å; H12-L19 CarbonylContact O-C 3.35Å; H12-R20 HydrophobicContact CB-CB 4.43Å; H12-R20 PolarHBondContact N-O 2.96Å; H12-R20 PolarHBondContact O-N 3.24Å; H12-D23 IonicContact CE1-OD2 2.85Å; H12-D23 IonicContact ND1-OD2 3.76Å |
| 13 | F | 80.7 | Confident | 76.6 | Confident | 89 Ų | 89 | 96.3 Ų | 96.3 | 39% | 0.39 | 50% | 0.502 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102 | 134.8 | 168.5 | -74 | -77.5 | 0 | 0 | 0 | 109.5 | L6 K18 L19 | L6-F13 HydrophobicContact CD1-CE2 3.43Å; L6-F13 VanDerWaalsContact CD1-CE2 3.43Å; L6-F13 HydrophobicContact CD1-CZ 3.78Å; F13-K18 WeakPolarHBondContact CA-O 3.42Å; F13-L19 HydrophobicContact CD1-CD1 4.25Å; F13-L19 HydrophobicContact CE1-CD1 3.67Å; F13-L19 HydrophobicContact CE2-CD1 4.25Å; F13-L19 HydrophobicContact CZ-CD1 3.67Å |
| 14 | D | 79.8 | Confident | 77.9 | Confident | 18 Ų | 18 | 90.1 Ų | 90.1 | 10% | 0.096 | 48% | 0.479 | C | S | . | . | trans | -82.1 | 175.3 | 169.3 | 69.8 | 16.1 | 0 | 0 | 0 | 112.5 | L16 N17 K18 R20 P24 | D14-L16 PolarHBondContact O-N 2.94Å; D14-L16 WeakPolarHBondContact OD1-CA 3.44Å; D14-L16 WeakPolarHBondContact OD1-CB 3.44Å; D14-L16 PolarHBondContact OD1-N 3.45Å; D14-N17 PolarHBondContact O-N 3.38Å; D14-N17 PolarHBondContact OD1-N 3.34Å; D14-K18 PolarHBondContact N-O 3.35Å; D14-K18 WeakPolarHBondContact OD1-CB 3.29Å; D14-K18 PolarHBondContact OD1-N 2.91Å; D14-R20 HydrophobicContact CB-CG 4.05Å; D14-R20 IonicContact OD2-CZ 3.26Å; D14-R20 VanDerWaalsContact OD2-CZ 3.26Å; D14-R20 IonicContact OD2-NE 2.84Å; D14-R20 PolarHBondContact OD2-NE 2.97Å; D14-R20 IonicContact OD2-NH2 2.79Å; D14-R20 PolarHBondContact OD2-NH2 2.94Å; D14-P24 HydrophobicContact CB-CB 4.36Å; D14-P24 HydrophobicContact CB-CG 3.87Å | ||
| 15 | E | 79.5 | Confident | 78.9 | Confident | 190 Ų | 190 | 91 Ų | 91 | 89% | 0.888 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.5 | -14.8 | 179.9 | -59.7 | -175.4 | 161.2 | 0 | 0 | 113.8 | ||
| 16 | L | 83.2 | Confident | 79.8 | Confident | 125 Ų | 125 | 88.9 Ų | 88.9 | 65% | 0.654 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -102.4 | 14.6 | 177 | -59.4 | 176.6 | 0 | 0 | 0 | 112.5 | D14 K18 | D14-L16 PolarHBondContact O-N 2.94Å; D14-L16 WeakPolarHBondContact OD1-CA 3.44Å; D14-L16 WeakPolarHBondContact OD1-CB 3.44Å; D14-L16 PolarHBondContact OD1-N 3.45Å; L16-K18 HydrophobicContact CB-CG 4.3Å; L16-K18 PolarHBondContact O-N 2.98Å |
| 17 | N | 79.9 | Confident | 80.7 | Confident | 136 Ų | 136 | 89.3 Ų | 89.3 | 73% | 0.727 | 48% | 0.476 | S | S | * | . | S | Bend | trans | 57.7 | 25.9 | -175.6 | -60.1 | -57.9 | 0 | 0 | 0 | 114.2 | D14 | D14-N17 PolarHBondContact O-N 3.38Å; D14-N17 PolarHBondContact OD1-N 3.34Å |
| 18 | K | 82.6 | Confident | 81.8 | Confident | 119 Ų | 119 | 92.6 Ų | 92.6 | 52% | 0.517 | 48% | 0.48 | S | S | . | . | trans | -87.3 | 139.8 | 173.2 | -56.6 | 179.1 | 179.7 | 178.1 | 0 | 109.7 | F13 D14 L16 | F13-K18 WeakPolarHBondContact CA-O 3.42Å; D14-K18 PolarHBondContact N-O 3.35Å; D14-K18 WeakPolarHBondContact OD1-CB 3.29Å; D14-K18 PolarHBondContact OD1-N 2.91Å; L16-K18 HydrophobicContact CB-CG 4.3Å; L16-K18 PolarHBondContact O-N 2.98Å | ||
| 19 | L | 84.8 | Confident | 82.7 | Confident | 94 Ų | 94 | 89.5 Ų | 89.5 | 49% | 0.492 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.4 | 129.7 | 175.4 | -156.5 | 81.9 | 0 | 0 | 0 | 109.8 | L6 L11 H12 F13 | L6-L19 HydrophobicContact CD2-CD1 4.42Å; L11-L19 HydrophobicContact CB-CD1 4.22Å; L11-L19 HydrophobicContact CB-CG 4.38Å; L11-L19 HydrophobicContact CD1-CD2 4.16Å; L11-L19 HydrophobicContact CD2-CD2 4.03Å; L11-L19 HydrophobicContact CD2-CG 4.29Å; H12-L19 CarbonylContact O-C 3.35Å; F13-L19 HydrophobicContact CD1-CD1 4.25Å; F13-L19 HydrophobicContact CE1-CD1 3.67Å; F13-L19 HydrophobicContact CE2-CD1 4.25Å; F13-L19 HydrophobicContact CZ-CD1 3.67Å |
| 20 | R | 79.4 | Confident | 83.5 | Confident | 125 Ų | 125 | 90.3 Ų | 90.3 | 47% | 0.472 | 46% | 0.464 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.5 | 148.6 | -178.7 | -63.3 | -74.7 | -178 | 164.3 | 3.3 | 109.2 | L11 H12 D14 L22 P24 | L11-R20 CarbonylContact C-O 3.56Å; L11-R20 WeakPolarHBondContact CA-O 3.45Å; H12-R20 HydrophobicContact CB-CB 4.43Å; H12-R20 PolarHBondContact N-O 2.96Å; H12-R20 PolarHBondContact O-N 3.24Å; D14-R20 HydrophobicContact CB-CG 4.05Å; D14-R20 IonicContact OD2-CZ 3.26Å; D14-R20 VanDerWaalsContact OD2-CZ 3.26Å; D14-R20 IonicContact OD2-NE 2.84Å; D14-R20 PolarHBondContact OD2-NE 2.97Å; D14-R20 IonicContact OD2-NH2 2.79Å; D14-R20 PolarHBondContact OD2-NH2 2.94Å; R20-L22 WeakPolarHBondContact CB-O 3.5Å; R20-P24 HydrophobicContact CG-CG 4.45Å |
| 21 | V | 84.9 | Confident | 84.3 | Confident | 124 Ų | 124 | 92.8 Ų | 92.8 | 75% | 0.752 | 47% | 0.473 | S | S | * | . | S | Bend | trans | -95.9 | -6.3 | 177.9 | -127.3 | 0 | 0 | 0 | 0 | 112.5 | L11 | L11-V21 HydrophobicContact CD2-CG1 4.08Š|
| 22 | L | 79.3 | Confident | 85 | Confident | 99 Ų | 99 | 95 Ų | 95 | 52% | 0.518 | 48% | 0.482 | S | S | . | . | S | Bend | trans | -130.2 | 142.5 | 176.6 | -168.5 | 68.7 | 0 | 0 | 0 | 107.4 | R20 P24 T27 | R20-L22 WeakPolarHBondContact CB-O 3.5Å; L22-P24 WeakPolarHBondContact O-CD 3.26Å; L22-T27 WeakPolarHBondContact CD2-OG1 3.49Å |
| 23 | D | 83.6 | Confident | 85.7 | Confident | 55 Ų | 55 | 97.2 Ų | 97.2 | 29% | 0.294 | 50% | 0.495 | S | S | . | . | trans | -56.4 | 123.6 | 176.2 | -164.2 | -43 | 0 | 0 | 0 | 109.8 | H12 E25 V26 T27 | H12-D23 IonicContact CE1-OD2 2.85Å; H12-D23 IonicContact ND1-OD2 3.76Å; D23-E25 PolarHBondContact O-N 3.5Å; D23-E25 PolarHBondContact OD1-N 3.33Å; D23-V26 HydrophobicContact CB-CB 4.04Å; D23-V26 HydrophobicContact CB-CG2 3.8Å; D23-V26 PolarHBondContact O-N 3.49Å; D23-T27 PolarHBondContact O-N 2.97Å; D23-T27 PolarHBondContact O-OG1 3.33Å | ||
| 24 | P | 83.6 | Confident | 86.4 | Confident | 39 Ų | 39 | 99.7 Ų | 99.7 | 25% | 0.253 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -54 | -36.5 | 177.7 | -26 | 33.6 | 0 | 0 | 0 | 113.4 | D14 R20 L22 T27 Q28 | D14-P24 HydrophobicContact CB-CB 4.36Å; D14-P24 HydrophobicContact CB-CG 3.87Å; R20-P24 HydrophobicContact CG-CG 4.45Å; L22-P24 WeakPolarHBondContact O-CD 3.26Å; P24-T27 WeakPolarHBondContact O-CB 3.4Å; P24-T27 PolarHBondContact O-N 2.96Å; P24-Q28 WeakPolarHBondContact O-CB 3.37Å; P24-Q28 PolarHBondContact O-N 3.01Å |
| 25 | E | 84.9 | Confident | 87.3 | Confident | 124 Ų | 124 | 102.9 Ų | 102.9 | 58% | 0.579 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -68.8 | -45.3 | -180 | -170.7 | 175.1 | 176.1 | 0 | 0 | 110.9 | D23 T27 Q28 Q29 | D23-E25 PolarHBondContact O-N 3.5Å; D23-E25 PolarHBondContact OD1-N 3.33Å; E25-T27 VanDerWaalsContact C-N 3.29Å; E25-T27 PolarHBondContact O-N 3.39Å; E25-Q28 PolarHBondContact O-N 3.48Å; E25-Q29 WeakPolarHBondContact O-CB 3.35Å; E25-Q29 WeakPolarHBondContact O-CG 3.5Å; E25-Q29 PolarHBondContact O-N 2.93Å |
| 26 | V | 86.1 | Confident | 88.1 | Confident | 65 Ų | 65 | 100.2 Ų | 100.2 | 39% | 0.394 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.9 | -38.4 | 175.1 | 177.8 | 0 | 0 | 0 | 0 | 110.9 | D23 T30 | D23-V26 HydrophobicContact CB-CB 4.04Å; D23-V26 HydrophobicContact CB-CG2 3.8Å; D23-V26 PolarHBondContact O-N 3.49Å; V26-T30 VanDerWaalsContact O-CB 3.3Å; V26-T30 WeakPolarHBondContact O-CB 3.5Å; V26-T30 PolarHBondContact O-N 3.23Å; V26-T30 PolarHBondContact O-OG1 3.36Å |
| 27 | T | 87.8 | Confident | 88.8 | Confident | 57 Ų | 57 | 97.4 Ų | 97.4 | 35% | 0.35 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.8 | -47.9 | 176.1 | -53.9 | 0 | 0 | 0 | 0 | 110.7 | L22 D23 P24 E25 T30 V31 | L22-T27 WeakPolarHBondContact CD2-OG1 3.49Å; D23-T27 PolarHBondContact O-N 2.97Å; D23-T27 PolarHBondContact O-OG1 3.33Å; P24-T27 WeakPolarHBondContact O-CB 3.4Å; P24-T27 PolarHBondContact O-N 2.96Å; E25-T27 VanDerWaalsContact C-N 3.29Å; E25-T27 PolarHBondContact O-N 3.39Å; T27-T30 PolarHBondContact O-N 2.95Å; T27-V31 WeakPolarHBondContact O-CG2 3.47Å; T27-V31 PolarHBondContact O-N 3.48Å |
| 28 | Q | 89.3 | Confident | 89.6 | Confident | 111 Ų | 111 | 96.5 Ų | 96.5 | 52% | 0.519 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -63.4 | -50.3 | 179.9 | 179 | 166.3 | -1.2 | 0 | 0 | 111.7 | P24 E25 T30 V31 E32 | P24-Q28 WeakPolarHBondContact O-CB 3.37Å; P24-Q28 PolarHBondContact O-N 3.01Å; E25-Q28 PolarHBondContact O-N 3.48Å; Q28-T30 VanDerWaalsContact C-N 3.26Å; Q28-T30 PolarHBondContact O-N 2.92Å; Q28-V31 PolarHBondContact O-N 2.98Å; Q28-V31 VanDerWaalsContact O-N 3.08Å; Q28-E32 HydrophobicContact CG-CG 4.44Å; Q28-E32 VanDerWaalsContact CG-OE1 3.3Å; Q28-E32 WeakPolarHBondContact CG-OE1 3.41Å; Q28-E32 PolarHBondContact NE2-OE1 3.46Å; Q28-E32 WeakPolarHBondContact O-CG 3.43Å; Q28-E32 PolarHBondContact O-N 3.35Å |
| 29 | Q | 92.3 | Very high | 90.3 | Very high | 104 Ų | 104 | 94.7 Ų | 94.7 | 49% | 0.486 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -58.2 | -38.5 | 177.4 | -71.4 | 175.5 | -4.1 | 0 | 0 | 112 | E25 E32 L33 | E25-Q29 WeakPolarHBondContact O-CB 3.35Å; E25-Q29 WeakPolarHBondContact O-CG 3.5Å; E25-Q29 PolarHBondContact O-N 2.93Å; Q29-E32 PolarHBondContact O-N 3.39Å; Q29-L33 VanDerWaalsContact O-CB 3.28Å; Q29-L33 WeakPolarHBondContact O-CB 3.33Å; Q29-L33 PolarHBondContact O-N 3.47Å |
| 30 | T | 92.8 | Very high | 91 | Very high | 84 Ų | 84 | 96.5 Ų | 96.5 | 52% | 0.515 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -67.2 | -37.7 | 177.5 | -57.7 | 0 | 0 | 0 | 0 | 112 | V26 T27 Q28 K34 | V26-T30 VanDerWaalsContact O-CB 3.3Å; V26-T30 WeakPolarHBondContact O-CB 3.5Å; V26-T30 PolarHBondContact O-N 3.23Å; V26-T30 PolarHBondContact O-OG1 3.36Å; T27-T30 PolarHBondContact O-N 2.95Å; Q28-T30 VanDerWaalsContact C-N 3.26Å; Q28-T30 PolarHBondContact O-N 2.92Å; T30-K34 WeakPolarHBondContact O-CB 3.47Å; T30-K34 PolarHBondContact O-N 3.35Å; T30-K34 VanDerWaalsContact O-N 3.08Å |
| 31 | V | 93.7 | Very high | 91.8 | Very high | 83 Ų | 83 | 95.1 Ų | 95.1 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -69.2 | -45.2 | 176.2 | 171 | 0 | 0 | 0 | 0 | 110.8 | T27 Q28 K34 E35 | T27-V31 WeakPolarHBondContact O-CG2 3.47Å; T27-V31 PolarHBondContact O-N 3.48Å; Q28-V31 PolarHBondContact O-N 2.98Å; Q28-V31 VanDerWaalsContact O-N 3.08Å; V31-K34 WeakPolarHBondContact O-CB 3.42Å; V31-K34 PolarHBondContact O-N 3Å; V31-E35 PolarHBondContact O-N 3.35Å |
| 32 | E | 95.7 | Very high | 92.5 | Very high | 97 Ų | 97 | 93.2 Ų | 93.2 | 45% | 0.453 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -58.5 | -49.5 | 176.3 | -72.5 | 173 | -173.3 | 0 | 0 | 110.9 | Q28 Q29 K34 E35 E36 | Q28-E32 HydrophobicContact CG-CG 4.44Å; Q28-E32 VanDerWaalsContact CG-OE1 3.3Å; Q28-E32 WeakPolarHBondContact CG-OE1 3.41Å; Q28-E32 PolarHBondContact NE2-OE1 3.46Å; Q28-E32 WeakPolarHBondContact O-CG 3.43Å; Q28-E32 PolarHBondContact O-N 3.35Å; Q29-E32 PolarHBondContact O-N 3.39Å; E32-K34 VanDerWaalsContact C-N 3.28Å; E32-K34 PolarHBondContact O-N 2.89Å; E32-E35 PolarHBondContact O-N 3.39Å; E32-E36 WeakPolarHBondContact O-CG 3.36Å; E32-E36 PolarHBondContact O-N 3.02Å |
| 33 | L | 95.8 | Very high | 93.4 | Very high | 103 Ų | 103 | 95 Ų | 95 | 54% | 0.539 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -57.8 | -40.3 | 176.7 | 179.6 | 62.6 | 0 | 0 | 0 | 112.4 | Q29 C37 | Q29-L33 VanDerWaalsContact O-CB 3.28Å; Q29-L33 WeakPolarHBondContact O-CB 3.33Å; Q29-L33 PolarHBondContact O-N 3.47Å; L33-C37 VanDerWaalsContact O-CB 3.27Å; L33-C37 WeakPolarHBondContact O-CB 3.46Å; L33-C37 PolarHBondContact O-N 3Å; L33-C37 PolarHBondContact O-SG 3.25Å |
| 34 | K | 96.4 | Very high | 94.1 | Very high | 142 Ų | 142 | 95.5 Ų | 95.5 | 62% | 0.617 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.6 | -45.2 | 178.2 | -180 | -169.3 | 171.5 | -164.2 | 0 | 111.6 | T30 V31 E32 C37 K38 | T30-K34 WeakPolarHBondContact O-CB 3.47Å; T30-K34 PolarHBondContact O-N 3.35Å; T30-K34 VanDerWaalsContact O-N 3.08Å; V31-K34 WeakPolarHBondContact O-CB 3.42Å; V31-K34 PolarHBondContact O-N 3Å; E32-K34 VanDerWaalsContact C-N 3.28Å; E32-K34 PolarHBondContact O-N 2.89Å; K34-C37 PolarHBondContact O-N 3.48Å; K34-K38 PolarHBondContact O-N 3.32Å |
| 35 | E | 97.3 | Very high | 94.7 | Very high | 85 Ų | 85 | 94.8 Ų | 94.8 | 40% | 0.397 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -68.1 | -42 | 178.7 | -65.7 | -55.1 | 136 | 0 | 0 | 111.2 | V31 E32 C37 K38 D39 | V31-E35 PolarHBondContact O-N 3.35Å; E32-E35 PolarHBondContact O-N 3.39Å; E35-C37 VanDerWaalsContact C-N 3.33Å; E35-C37 PolarHBondContact O-N 3.28Å; E35-K38 WeakPolarHBondContact O-CB 3.37Å; E35-K38 PolarHBondContact O-N 3.49Å; E35-K38 VanDerWaalsContact O-N 3.15Å; E35-D39 PolarHBondContact O-N 3.47Å |
| 36 | E | 96.9 | Very high | 95.4 | Very high | 133 Ų | 133 | 94.8 Ų | 94.8 | 62% | 0.621 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.6 | -41.9 | 175 | -74 | -172.3 | 171.7 | 0 | 0 | 112.4 | E32 K38 D39 F40 | E32-E36 WeakPolarHBondContact O-CG 3.36Å; E32-E36 PolarHBondContact O-N 3.02Å; E36-K38 VanDerWaalsContact C-N 3.32Å; E36-K38 PolarHBondContact O-N 2.96Å; E36-D39 PolarHBondContact O-N 2.94Å; E36-F40 WeakPolarHBondContact O-CB 2.9Å; E36-F40 PolarHBondContact O-N 2.89Å |
| 37 | C | 97.3 | Very high | 95.9 | Very high | 66 Ų | 66 | 97.8 Ų | 97.8 | 45% | 0.446 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.1 | -39.6 | 176.3 | -77 | 0 | 0 | 0 | 0 | 111.6 | L33 K34 E35 F40 V41 | L33-C37 VanDerWaalsContact O-CB 3.27Å; L33-C37 WeakPolarHBondContact O-CB 3.46Å; L33-C37 PolarHBondContact O-N 3Å; L33-C37 PolarHBondContact O-SG 3.25Å; K34-C37 PolarHBondContact O-N 3.48Å; E35-C37 VanDerWaalsContact C-N 3.33Å; E35-C37 PolarHBondContact O-N 3.28Å; C37-F40 PolarHBondContact O-N 3.43Å; C37-V41 WeakPolarHBondContact O-CG2 3.48Å; C37-V41 PolarHBondContact O-N 2.93Å |
| 38 | K | 97.4 | Very high | 96.4 | Very high | 117 Ų | 117 | 101.2 Ų | 101.2 | 51% | 0.509 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.6 | -48.4 | 175.7 | -176.7 | -174.5 | 171 | -163.4 | 0 | 111.1 | K34 E35 E36 F40 V41 D42 | K34-K38 PolarHBondContact O-N 3.32Å; E35-K38 WeakPolarHBondContact O-CB 3.37Å; E35-K38 PolarHBondContact O-N 3.49Å; E35-K38 VanDerWaalsContact O-N 3.15Å; E36-K38 VanDerWaalsContact C-N 3.32Å; E36-K38 PolarHBondContact O-N 2.96Å; K38-F40 VanDerWaalsContact C-N 3.26Å; K38-F40 PolarHBondContact O-N 3.31Å; K38-V41 PolarHBondContact O-N 3.31Å; K38-D42 PolarHBondContact O-N 2.89Å |
| 39 | D | 97.8 | Very high | 96.9 | Very high | 81 Ų | 81 | 103.8 Ų | 103.8 | 43% | 0.433 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.1 | -39.1 | 176.4 | -83.5 | 2.1 | 0 | 0 | 0 | 112 | E35 E36 D42 K43 | E35-D39 PolarHBondContact O-N 3.47Å; E36-D39 PolarHBondContact O-N 2.94Å; D39-D42 PolarHBondContact O-N 3.46Å; D39-K43 WeakPolarHBondContact O-CB 3.29Å; D39-K43 VanDerWaalsContact O-CG 3.23Å; D39-K43 WeakPolarHBondContact O-CG 3.35Å; D39-K43 PolarHBondContact O-N 3.13Å |
| 40 | F | 98.1 | Very high | 97.1 | Very high | 133 Ų | 133 | 104.6 Ų | 104.6 | 58% | 0.583 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.1 | -48.5 | 176 | 179.6 | -96.1 | 0 | 0 | 0 | 111.5 | E36 C37 K38 D42 K43 I44 | E36-F40 WeakPolarHBondContact O-CB 2.9Å; E36-F40 PolarHBondContact O-N 2.89Å; C37-F40 PolarHBondContact O-N 3.43Å; K38-F40 VanDerWaalsContact C-N 3.26Å; K38-F40 PolarHBondContact O-N 3.31Å; F40-D42 VanDerWaalsContact C-N 3.31Å; F40-D42 PolarHBondContact O-N 3.29Å; F40-K43 PolarHBondContact O-N 3.45Å; F40-I44 HydrophobicContact CD1-CG1 4.17Å; F40-I44 HydrophobicContact CE1-CD1 4.48Å; F40-I44 HydrophobicContact CE1-CG1 3.74Å; F40-I44 HydrophobicContact CE2-CD1 4.31Å; F40-I44 HydrophobicContact CE2-CG1 4.12Å; F40-I44 HydrophobicContact CZ-CD1 3.99Å; F40-I44 HydrophobicContact CZ-CG1 3.71Å; F40-I44 WeakPolarHBondContact O-CG1 3.46Å; F40-I44 PolarHBondContact O-N 3.46Å |
| 41 | V | 97.9 | Very high | 97.4 | Very high | 95 Ų | 95 | 103.1 Ų | 103.1 | 58% | 0.576 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.4 | -43.1 | 177.6 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | C37 K38 I44 G45 | C37-V41 WeakPolarHBondContact O-CG2 3.48Å; C37-V41 PolarHBondContact O-N 2.93Å; K38-V41 PolarHBondContact O-N 3.31Å; V41-I44 PolarHBondContact O-N 3.24Å; V41-G45 PolarHBondContact O-N 3.43Å |
| 42 | D | 98.3 | Very high | 97.6 | Very high | 84 Ų | 84 | 100.6 Ų | 100.6 | 45% | 0.449 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.7 | -44.3 | 178.5 | -75.5 | -17.4 | 0 | 0 | 0 | 111.7 | K38 D39 F40 G45 Q46 | K38-D42 PolarHBondContact O-N 2.89Å; D39-D42 PolarHBondContact O-N 3.46Å; F40-D42 VanDerWaalsContact C-N 3.31Å; F40-D42 PolarHBondContact O-N 3.29Å; D42-G45 PolarHBondContact O-N 3.33Å; D42-Q46 WeakPolarHBondContact O-CG 3.33Å; D42-Q46 PolarHBondContact O-N 2.95Å |
| 43 | K | 98.1 | Very high | 97.7 | Very high | 137 Ų | 137 | 97.3 Ų | 97.3 | 60% | 0.596 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.5 | -43.3 | 175.9 | -75.6 | 169.1 | -175.7 | 165.7 | 0 | 112 | D39 F40 G45 Q46 F47 | D39-K43 WeakPolarHBondContact O-CB 3.29Å; D39-K43 VanDerWaalsContact O-CG 3.23Å; D39-K43 WeakPolarHBondContact O-CG 3.35Å; D39-K43 PolarHBondContact O-N 3.13Å; F40-K43 PolarHBondContact O-N 3.45Å; K43-G45 VanDerWaalsContact C-N 3.34Å; K43-Q46 PolarHBondContact O-N 3.31Å; K43-F47 WeakPolarHBondContact O-CB 3.45Å; K43-F47 PolarHBondContact O-N 2.98Å |
| 44 | I | 97.9 | Very high | 97.8 | Very high | 65 Ų | 65 | 97.4 Ų | 97.4 | 33% | 0.333 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.3 | -40.7 | 176 | -69.3 | -65.8 | 0 | 0 | 0 | 110.8 | F40 V41 Q46 F47 Q48 | F40-I44 HydrophobicContact CD1-CG1 4.17Å; F40-I44 HydrophobicContact CE1-CD1 4.48Å; F40-I44 HydrophobicContact CE1-CG1 3.74Å; F40-I44 HydrophobicContact CE2-CD1 4.31Å; F40-I44 HydrophobicContact CE2-CG1 4.12Å; F40-I44 HydrophobicContact CZ-CD1 3.99Å; F40-I44 HydrophobicContact CZ-CG1 3.71Å; F40-I44 WeakPolarHBondContact O-CG1 3.46Å; F40-I44 PolarHBondContact O-N 3.46Å; V41-I44 PolarHBondContact O-N 3.24Å; I44-Q46 VanDerWaalsContact C-N 3.34Å; I44-Q46 PolarHBondContact O-N 2.93Å; I44-F47 PolarHBondContact O-N 3.04Å; I44-Q48 HydrophobicContact CG2-CG 4.41Å; I44-Q48 WeakPolarHBondContact O-CG 3.49Å; I44-Q48 PolarHBondContact O-N 3.44Å |
| 45 | G | 98.1 | Very high | 97.9 | Very high | 24 Ų | 24 | 95.3 Ų | 95.3 | 25% | 0.247 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -61.4 | -40.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | V41 D42 K43 K49 | V41-G45 PolarHBondContact O-N 3.43Å; D42-G45 PolarHBondContact O-N 3.33Å; K43-G45 VanDerWaalsContact C-N 3.34Å; G45-K49 WeakPolarHBondContact O-CG 3.43Å; G45-K49 PolarHBondContact O-N 3.12Å |
| 46 | Q | 98.1 | Very high | 98 | Very high | 124 Ų | 124 | 97.2 Ų | 97.2 | 58% | 0.579 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.7 | -44.2 | 173.6 | -69.5 | 176 | 17.5 | 0 | 0 | 111.9 | D42 K43 I44 Q48 K49 I50 | D42-Q46 WeakPolarHBondContact O-CG 3.33Å; D42-Q46 PolarHBondContact O-N 2.95Å; K43-Q46 PolarHBondContact O-N 3.31Å; I44-Q46 VanDerWaalsContact C-N 3.34Å; I44-Q46 PolarHBondContact O-N 2.93Å; Q46-Q48 PolarHBondContact O-N 3.01Å; Q46-K49 WeakPolarHBondContact O-CB 3.34Å; Q46-K49 PolarHBondContact O-N 2.94Å; Q46-I50 WeakPolarHBondContact O-CG1 3.37Å; Q46-I50 PolarHBondContact O-N 3.34Å |
| 47 | F | 98.1 | Very high | 98 | Very high | 128 Ų | 128 | 96.2 Ų | 96.2 | 56% | 0.561 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -58.6 | -46.3 | 177.1 | 177.6 | -100.2 | 0 | 0 | 0 | 111.8 | K43 I44 K49 I50 V51 | K43-F47 WeakPolarHBondContact O-CB 3.45Å; K43-F47 PolarHBondContact O-N 2.98Å; I44-F47 PolarHBondContact O-N 3.04Å; F47-K49 VanDerWaalsContact C-N 3.31Å; F47-K49 PolarHBondContact O-N 3.38Å; F47-I50 PolarHBondContact O-N 2.98Å; F47-V51 HydrophobicContact CD1-CG2 4.19Å; F47-V51 HydrophobicContact CD2-CG2 4.32Å; F47-V51 HydrophobicContact CE1-CG2 3.73Å; F47-V51 HydrophobicContact CE2-CG2 3.88Å; F47-V51 HydrophobicContact CG-CG2 4.47Å; F47-V51 HydrophobicContact CZ-CG2 3.56Å; F47-V51 WeakPolarHBondContact O-CG2 3.47Å; F47-V51 PolarHBondContact O-N 2.94Å |
| 48 | Q | 98 | Very high | 98.1 | Very high | 129 Ų | 129 | 96.9 Ų | 96.9 | 60% | 0.603 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.2 | -40.6 | 176.7 | -74.8 | 176.5 | -21.4 | 0 | 0 | 112.3 | I44 Q46 G52 | I44-Q48 HydrophobicContact CG2-CG 4.41Å; I44-Q48 WeakPolarHBondContact O-CG 3.49Å; I44-Q48 PolarHBondContact O-N 3.44Å; Q46-Q48 PolarHBondContact O-N 3.01Å; Q48-G52 PolarHBondContact O-N 2.9Å |
| 49 | K | 98.1 | Very high | 98.1 | Very high | 166 Ų | 166 | 95.6 Ų | 95.6 | 72% | 0.722 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.1 | -43.6 | 175.4 | -72.2 | 173.4 | -177.1 | 178.6 | 0 | 112.1 | G45 Q46 F47 G52 G53 | G45-K49 WeakPolarHBondContact O-CG 3.43Å; G45-K49 PolarHBondContact O-N 3.12Å; Q46-K49 WeakPolarHBondContact O-CB 3.34Å; Q46-K49 PolarHBondContact O-N 2.94Å; F47-K49 VanDerWaalsContact C-N 3.31Å; F47-K49 PolarHBondContact O-N 3.38Å; K49-G52 PolarHBondContact O-N 2.93Å; K49-G53 PolarHBondContact O-N 3.48Å |
| 50 | I | 98 | Very high | 98.1 | Very high | 121 Ų | 121 | 96.9 Ų | 96.9 | 62% | 0.621 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -63.8 | -47.8 | 178.9 | -67 | 165.7 | 0 | 0 | 0 | 110.4 | Q46 F47 G52 G53 L54 | Q46-I50 WeakPolarHBondContact O-CG1 3.37Å; Q46-I50 PolarHBondContact O-N 3.34Å; F47-I50 PolarHBondContact O-N 2.98Å; I50-G52 VanDerWaalsContact C-N 3.33Å; I50-G52 PolarHBondContact O-N 2.77Å; I50-G53 PolarHBondContact O-N 3.31Å; I50-L54 PolarHBondContact O-N 3.37Å |
| 51 | V | 98.2 | Very high | 98.1 | Very high | 53 Ų | 53 | 95.9 Ų | 95.9 | 32% | 0.321 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.5 | -41.1 | 178.6 | 173.5 | 0 | 0 | 0 | 0 | 111 | F47 L54 I55 | F47-V51 HydrophobicContact CD1-CG2 4.19Å; F47-V51 HydrophobicContact CD2-CG2 4.32Å; F47-V51 HydrophobicContact CE1-CG2 3.73Å; F47-V51 HydrophobicContact CE2-CG2 3.88Å; F47-V51 HydrophobicContact CG-CG2 4.47Å; F47-V51 HydrophobicContact CZ-CG2 3.56Å; F47-V51 WeakPolarHBondContact O-CG2 3.47Å; F47-V51 PolarHBondContact O-N 2.94Å; V51-L54 PolarHBondContact O-N 3.46Å; V51-I55 HydrophobicContact CG1-CD1 3.95Å; V51-I55 HydrophobicContact CG1-CG1 4.45Å; V51-I55 WeakPolarHBondContact O-CG1 3.31Å; V51-I55 PolarHBondContact O-N 3.19Å |
| 52 | G | 98.3 | Very high | 98.2 | Very high | 29 Ų | 29 | 93.9 Ų | 93.9 | 30% | 0.299 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -57.2 | -49.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q48 K49 I50 L54 I55 E56 | Q48-G52 PolarHBondContact O-N 2.9Å; K49-G52 PolarHBondContact O-N 2.93Å; I50-G52 VanDerWaalsContact C-N 3.33Å; I50-G52 PolarHBondContact O-N 2.77Å; G52-L54 VanDerWaalsContact C-N 3.32Å; G52-L54 PolarHBondContact O-N 2.89Å; G52-I55 PolarHBondContact O-N 2.9Å; G52-E56 WeakPolarHBondContact O-CG 3.49Å; G52-E56 PolarHBondContact O-N 3.43Å; G52-E56 VanDerWaalsContact O-N 3.1Å |
| 53 | G | 98.2 | Very high | 98.2 | Very high | 29 Ų | 29 | 97.1 Ų | 97.1 | 30% | 0.299 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.9 | -35.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | K49 I50 E56 L57 | K49-G53 PolarHBondContact O-N 3.48Å; I50-G53 PolarHBondContact O-N 3.31Å; G53-E56 PolarHBondContact O-N 3.45Å; G53-L57 WeakPolarHBondContact O-CG 3.45Å; G53-L57 PolarHBondContact O-N 3.48Å |
| 54 | L | 98.1 | Very high | 98.2 | Very high | 105 Ų | 105 | 96.5 Ų | 96.5 | 55% | 0.55 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.5 | -43.1 | 175.1 | 179.2 | 62 | 0 | 0 | 0 | 111.9 | I50 V51 G52 E56 L57 V58 | I50-L54 PolarHBondContact O-N 3.37Å; V51-L54 PolarHBondContact O-N 3.46Å; G52-L54 VanDerWaalsContact C-N 3.32Å; G52-L54 PolarHBondContact O-N 2.89Å; L54-E56 VanDerWaalsContact C-N 3.32Å; L54-E56 PolarHBondContact O-N 2.94Å; L54-L57 PolarHBondContact O-N 3.23Å; L54-V58 HydrophobicContact CD1-CG2 4.24Å; L54-V58 HydrophobicContact CG-CG2 4.5Å; L54-V58 VanDerWaalsContact O-CG2 3.31Å; L54-V58 WeakPolarHBondContact O-CG2 3.45Å; L54-V58 PolarHBondContact O-N 3.42Å |
| 55 | I | 98.1 | Very high | 98.2 | Very high | 97 Ų | 97 | 96.1 Ų | 96.1 | 50% | 0.497 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -59.5 | -46.3 | 176.7 | -69.4 | 165.9 | 0 | 0 | 0 | 109.9 | V51 G52 L57 V58 D59 | V51-I55 HydrophobicContact CG1-CD1 3.95Å; V51-I55 HydrophobicContact CG1-CG1 4.45Å; V51-I55 WeakPolarHBondContact O-CG1 3.31Å; V51-I55 PolarHBondContact O-N 3.19Å; G52-I55 PolarHBondContact O-N 2.9Å; I55-L57 PolarHBondContact O-N 3.06Å; I55-V58 PolarHBondContact O-N 3.46Å; I55-D59 PolarHBondContact O-N 3.49Å |
| 56 | E | 98.3 | Very high | 98.2 | Very high | 125 Ų | 125 | 99.6 Ų | 99.6 | 58% | 0.584 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.5 | -43.1 | 177.9 | -70.9 | 177.4 | -177.7 | 0 | 0 | 112.6 | G52 G53 L54 D59 Q60 | G52-E56 WeakPolarHBondContact O-CG 3.49Å; G52-E56 PolarHBondContact O-N 3.43Å; G52-E56 VanDerWaalsContact O-N 3.1Å; G53-E56 PolarHBondContact O-N 3.45Å; L54-E56 VanDerWaalsContact C-N 3.32Å; L54-E56 PolarHBondContact O-N 2.94Å; E56-D59 PolarHBondContact O-N 3.44Å; E56-Q60 WeakPolarHBondContact O-CG 3.42Å; E56-Q60 PolarHBondContact O-N 3.2Å |
| 57 | L | 98.3 | Very high | 98.2 | Very high | 112 Ų | 112 | 97.8 Ų | 97.8 | 59% | 0.586 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.2 | -42.8 | 176.4 | -81.5 | 166.9 | 0 | 0 | 0 | 112.1 | G53 L54 I55 D59 Q60 L61 | G53-L57 WeakPolarHBondContact O-CG 3.45Å; G53-L57 PolarHBondContact O-N 3.48Å; L54-L57 PolarHBondContact O-N 3.23Å; I55-L57 PolarHBondContact O-N 3.06Å; L57-D59 VanDerWaalsContact C-N 3.34Å; L57-Q60 PolarHBondContact O-N 2.95Å; L57-L61 WeakPolarHBondContact O-CB 3.48Å; L57-L61 PolarHBondContact O-N 3.01Å |
| 58 | V | 98.3 | Very high | 98.2 | Very high | 81 Ų | 81 | 96.7 Ų | 96.7 | 49% | 0.491 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.1 | -41.2 | 177.6 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | L54 I55 L61 A62 | L54-V58 HydrophobicContact CD1-CG2 4.24Å; L54-V58 HydrophobicContact CG-CG2 4.5Å; L54-V58 VanDerWaalsContact O-CG2 3.31Å; L54-V58 WeakPolarHBondContact O-CG2 3.45Å; L54-V58 PolarHBondContact O-N 3.42Å; I55-V58 PolarHBondContact O-N 3.46Å; V58-L61 PolarHBondContact O-N 3.26Å; V58-A62 WeakPolarHBondContact O-CB 3.5Å; V58-A62 PolarHBondContact O-N 2.91Å |
| 59 | D | 98.4 | Very high | 98.2 | Very high | 90 Ų | 90 | 95.7 Ų | 95.7 | 48% | 0.481 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.2 | -39.6 | 176.4 | -84 | -8.4 | 0 | 0 | 0 | 112.5 | I55 E56 L57 K63 | I55-D59 PolarHBondContact O-N 3.49Å; E56-D59 PolarHBondContact O-N 3.44Å; L57-D59 VanDerWaalsContact C-N 3.34Å; D59-K63 WeakPolarHBondContact O-CG 3.32Å; D59-K63 PolarHBondContact O-N 3Å; D59-K63 VanDerWaalsContact O-N 3.16Å |
| 60 | Q | 98.4 | Very high | 98.2 | Very high | 107 Ų | 107 | 93.5 Ų | 93.5 | 50% | 0.5 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.1 | -47.5 | 174.6 | -73.2 | 175.3 | 12 | 0 | 0 | 111.1 | E56 L57 A62 K63 E64 | E56-Q60 WeakPolarHBondContact O-CG 3.42Å; E56-Q60 PolarHBondContact O-N 3.2Å; L57-Q60 PolarHBondContact O-N 2.95Å; Q60-A62 VanDerWaalsContact C-N 3.31Å; Q60-A62 PolarHBondContact O-N 2.69Å; Q60-K63 WeakPolarHBondContact O-CB 3.34Å; Q60-K63 PolarHBondContact O-N 3.16Å; Q60-K63 VanDerWaalsContact O-N 3.16Å; Q60-E64 PolarHBondContact O-N 2.94Å |
| 61 | L | 98.3 | Very high | 98.2 | Very high | 113 Ų | 113 | 93 Ų | 93 | 59% | 0.592 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -60.2 | -40.9 | 178.2 | -178.1 | 61.9 | 0 | 0 | 0 | 111.9 | L57 V58 K63 E64 A65 | L57-L61 WeakPolarHBondContact O-CB 3.48Å; L57-L61 PolarHBondContact O-N 3.01Å; V58-L61 PolarHBondContact O-N 3.26Å; L61-K63 VanDerWaalsContact C-N 3.35Å; L61-K63 PolarHBondContact O-N 3.38Å; L61-E64 PolarHBondContact O-N 3.47Å; L61-A65 WeakPolarHBondContact O-CB 3.33Å; L61-A65 PolarHBondContact O-N 3.16Å |
| 62 | A | 98.3 | Very high | 98.2 | Very high | 52 Ų | 52 | 93.5 Ų | 93.5 | 43% | 0.43 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.6 | -42.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | V58 Q60 A65 E66 | V58-A62 WeakPolarHBondContact O-CB 3.5Å; V58-A62 PolarHBondContact O-N 2.91Å; Q60-A62 VanDerWaalsContact C-N 3.31Å; Q60-A62 PolarHBondContact O-N 2.69Å; A62-A65 PolarHBondContact O-N 2.96Å; A62-E66 PolarHBondContact O-N 3.37Å |
| 63 | K | 98.3 | Very high | 98.2 | Very high | 153 Ų | 153 | 95.1 Ų | 95.1 | 67% | 0.665 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.5 | -43.3 | 176.3 | -72.9 | 170 | -176.8 | 169.4 | 0 | 112 | D59 Q60 L61 E66 N67 | D59-K63 WeakPolarHBondContact O-CG 3.32Å; D59-K63 PolarHBondContact O-N 3Å; D59-K63 VanDerWaalsContact O-N 3.16Å; Q60-K63 WeakPolarHBondContact O-CB 3.34Å; Q60-K63 PolarHBondContact O-N 3.16Å; Q60-K63 VanDerWaalsContact O-N 3.16Å; L61-K63 VanDerWaalsContact C-N 3.35Å; L61-K63 PolarHBondContact O-N 3.38Å; K63-E66 PolarHBondContact O-N 3.35Å; K63-N67 WeakPolarHBondContact O-CB 3.34Å; K63-N67 PolarHBondContact O-N 3.35Å |
| 64 | E | 98.3 | Very high | 98.2 | Very high | 123 Ų | 123 | 95.6 Ų | 95.6 | 58% | 0.575 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -64.2 | -44.3 | 177.3 | -72 | -177 | -178.4 | 0 | 0 | 111.7 | Q60 L61 E66 N67 E68 | Q60-E64 PolarHBondContact O-N 2.94Å; L61-E64 PolarHBondContact O-N 3.47Å; E64-E66 VanDerWaalsContact C-N 3.35Å; E64-E66 PolarHBondContact O-N 2.95Å; E64-N67 WeakPolarHBondContact O-CB 3.49Å; E64-N67 PolarHBondContact O-N 3.36Å; E64-E68 PolarHBondContact O-N 3.43Å |
| 65 | A | 98.3 | Very high | 98.2 | Very high | 57 Ų | 57 | 93.1 Ų | 93.1 | 47% | 0.471 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.8 | -43.7 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112 | L61 A62 E68 K69 | L61-A65 WeakPolarHBondContact O-CB 3.33Å; L61-A65 PolarHBondContact O-N 3.16Å; A62-A65 PolarHBondContact O-N 2.96Å; A65-E68 PolarHBondContact O-N 2.95Å; A65-K69 WeakPolarHBondContact O-CB 3.39Å; A65-K69 PolarHBondContact O-N 2.92Å |
| 66 | E | 98.1 | Very high | 98.2 | Very high | 97 Ų | 97 | 96.8 Ų | 96.8 | 45% | 0.453 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.6 | -35.5 | 176.6 | -78.9 | -58.5 | 165.8 | 0 | 0 | 112.9 | A62 K63 E64 K69 M70 | A62-E66 PolarHBondContact O-N 3.37Å; K63-E66 PolarHBondContact O-N 3.35Å; E64-E66 VanDerWaalsContact C-N 3.35Å; E64-E66 PolarHBondContact O-N 2.95Å; E66-K69 VanDerWaalsContact CD-NZ 3.31Å; E66-K69 PolarHBondContact O-N 2.91Å; E66-K69 IonicContact OE1-NZ 3.84Å; E66-K69 PolarHBondContact OE1-NZ 3.3Å; E66-K69 WeakPolarHBondContact OE2-CD 3.28Å; E66-K69 IonicContact OE2-NZ 3.98Å; E66-K69 PolarHBondContact OE2-NZ 3.48Å; E66-M70 WeakPolarHBondContact O-CB 3.46Å; E66-M70 WeakPolarHBondContact O-CG 3.34Å; E66-M70 PolarHBondContact O-N 3.31Å |
| 67 | N | 98.3 | Very high | 98.2 | Very high | 87 Ų | 87 | 94.9 Ų | 94.9 | 47% | 0.465 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61 | -48.5 | 173.2 | -173.4 | 24.5 | 0 | 0 | 0 | 111.6 | K63 E64 K69 M70 K71 | K63-N67 WeakPolarHBondContact O-CB 3.34Å; K63-N67 PolarHBondContact O-N 3.35Å; E64-N67 WeakPolarHBondContact O-CB 3.49Å; E64-N67 PolarHBondContact O-N 3.36Å; N67-K69 PolarHBondContact O-N 3.4Å; N67-M70 PolarHBondContact O-N 3.04Å; N67-K71 WeakPolarHBondContact O-CG 3.23Å; N67-K71 PolarHBondContact O-N 2.99Å |
| 68 | E | 98.3 | Very high | 98.1 | Very high | 104 Ų | 104 | 94.7 Ų | 94.7 | 49% | 0.486 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.4 | -38.9 | 178.3 | -71.6 | -53.6 | 135 | 0 | 0 | 112.4 | E64 A65 M70 K71 A72 | E64-E68 PolarHBondContact O-N 3.43Å; A65-E68 PolarHBondContact O-N 2.95Å; E68-M70 VanDerWaalsContact C-N 3.32Å; E68-M70 PolarHBondContact O-N 3.47Å; E68-K71 PolarHBondContact O-N 3.46Å; E68-K71 IonicContact OE1-NZ 3.62Å; E68-K71 PolarHBondContact OE1-NZ 3.23Å; E68-A72 WeakPolarHBondContact O-CB 3.37Å; E68-A72 PolarHBondContact O-N 3.26Å |
| 69 | K | 98.4 | Very high | 98 | Very high | 108 Ų | 108 | 96.5 Ų | 96.5 | 47% | 0.47 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.1 | -43.7 | 172.8 | -175.5 | -154.9 | -171.2 | 177.1 | 0 | 111.5 | A65 E66 N67 A72 I73 | A65-K69 WeakPolarHBondContact O-CB 3.39Å; A65-K69 PolarHBondContact O-N 2.92Å; E66-K69 VanDerWaalsContact CD-NZ 3.31Å; E66-K69 PolarHBondContact O-N 2.91Å; E66-K69 IonicContact OE1-NZ 3.84Å; E66-K69 PolarHBondContact OE1-NZ 3.3Å; E66-K69 WeakPolarHBondContact OE2-CD 3.28Å; E66-K69 IonicContact OE2-NZ 3.98Å; E66-K69 PolarHBondContact OE2-NZ 3.48Å; N67-K69 PolarHBondContact O-N 3.4Å; K69-A72 PolarHBondContact O-N 2.94Å; K69-I73 HydrophobicContact CG-CD1 4.13Å; K69-I73 VanDerWaalsContact O-CG1 3.29Å; K69-I73 WeakPolarHBondContact O-CG1 3.27Å; K69-I73 PolarHBondContact O-N 2.93Å |
| 70 | M | 98.1 | Very high | 98 | Very high | 120 Ų | 120 | 100 Ų | 100 | 59% | 0.591 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -63.5 | -42 | 176.8 | -75 | -59.7 | -65.7 | 0 | 0 | 112.2 | E66 N67 E68 I73 G74 | E66-M70 WeakPolarHBondContact O-CB 3.46Å; E66-M70 WeakPolarHBondContact O-CG 3.34Å; E66-M70 PolarHBondContact O-N 3.31Å; N67-M70 PolarHBondContact O-N 3.04Å; E68-M70 VanDerWaalsContact C-N 3.32Å; E68-M70 PolarHBondContact O-N 3.47Å; M70-I73 PolarHBondContact O-N 2.99Å; M70-I73 HydrophobicContact SD-CD1 4.39Å; M70-G74 PolarHBondContact O-N 3.26Å |
| 71 | K | 98.1 | Very high | 97.9 | Very high | 112 Ų | 112 | 98.2 Ų | 98.2 | 49% | 0.487 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.4 | -45.2 | 173.6 | -69.2 | 175.4 | -171 | 170 | 0 | 111.8 | N67 E68 I73 G74 A75 | N67-K71 WeakPolarHBondContact O-CG 3.23Å; N67-K71 PolarHBondContact O-N 2.99Å; E68-K71 PolarHBondContact O-N 3.46Å; E68-K71 IonicContact OE1-NZ 3.62Å; E68-K71 PolarHBondContact OE1-NZ 3.23Å; K71-I73 PolarHBondContact O-N 3.45Å; K71-G74 PolarHBondContact O-N 2.89Å; K71-A75 PolarHBondContact O-N 3.1Å |
| 72 | A | 98.3 | Very high | 97.9 | Very high | 62 Ų | 62 | 95.8 Ų | 95.8 | 51% | 0.512 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | E68 K69 G74 A75 R76 | E68-A72 WeakPolarHBondContact O-CB 3.37Å; E68-A72 PolarHBondContact O-N 3.26Å; K69-A72 PolarHBondContact O-N 2.94Å; A72-G74 VanDerWaalsContact C-N 3.35Å; A72-A75 PolarHBondContact O-N 3.25Å; A72-R76 WeakPolarHBondContact O-CB 3.37Å; A72-R76 PolarHBondContact O-N 2.91Å |
| 73 | I | 97.9 | Very high | 97.8 | Very high | 63 Ų | 63 | 96.1 Ų | 96.1 | 32% | 0.323 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.7 | -45.6 | 173.5 | -68.8 | 165.7 | 0 | 0 | 0 | 110.4 | K69 M70 K71 R76 N77 | K69-I73 HydrophobicContact CG-CD1 4.13Å; K69-I73 VanDerWaalsContact O-CG1 3.29Å; K69-I73 WeakPolarHBondContact O-CG1 3.27Å; K69-I73 PolarHBondContact O-N 2.93Å; M70-I73 PolarHBondContact O-N 2.99Å; M70-I73 HydrophobicContact SD-CD1 4.39Å; K71-I73 PolarHBondContact O-N 3.45Å; I73-R76 PolarHBondContact O-N 3.18Å; I73-N77 WeakPolarHBondContact O-CB 3.34Å; I73-N77 VanDerWaalsContact O-CG 3.25Å; I73-N77 PolarHBondContact O-N 3.21Å |
| 74 | G | 98 | Very high | 97.7 | Very high | 39 Ų | 39 | 96.3 Ų | 96.3 | 40% | 0.402 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -58.2 | -50.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | M70 K71 A72 R76 N77 L78 | M70-G74 PolarHBondContact O-N 3.26Å; K71-G74 PolarHBondContact O-N 2.89Å; A72-G74 VanDerWaalsContact C-N 3.35Å; G74-R76 VanDerWaalsContact C-N 3.34Å; G74-R76 PolarHBondContact O-N 3.03Å; G74-N77 PolarHBondContact O-N 2.88Å; G74-L78 PolarHBondContact O-N 2.98Å |
| 75 | A | 97.7 | Very high | 97.6 | Very high | 54 Ų | 54 | 95.7 Ų | 95.7 | 45% | 0.446 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.4 | -42.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | K71 A72 N77 L78 L79 | K71-A75 PolarHBondContact O-N 3.1Å; A72-A75 PolarHBondContact O-N 3.25Å; A75-N77 VanDerWaalsContact C-N 3.35Å; A75-N77 PolarHBondContact O-N 3.45Å; A75-L78 PolarHBondContact O-N 3.42Å; A75-L79 WeakPolarHBondContact O-CG 3.32Å; A75-L79 PolarHBondContact O-N 3.37Å |
| 76 | R | 97.8 | Very high | 97.6 | Very high | 173 Ų | 173 | 101.5 Ų | 101.5 | 65% | 0.653 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.7 | -42.8 | 176.5 | -168.9 | -179.6 | 77.7 | 168.6 | 2.7 | 112 | A72 I73 G74 L79 K80 | A72-R76 WeakPolarHBondContact O-CB 3.37Å; A72-R76 PolarHBondContact O-N 2.91Å; I73-R76 PolarHBondContact O-N 3.18Å; G74-R76 VanDerWaalsContact C-N 3.34Å; G74-R76 PolarHBondContact O-N 3.03Å; R76-L79 PolarHBondContact O-N 3.37Å; R76-K80 PolarHBondContact O-N 3.2Å |
| 77 | N | 97.8 | Very high | 97.5 | Very high | 85 Ų | 85 | 102.3 Ų | 102.3 | 46% | 0.455 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.6 | -40.5 | 178.4 | -72.5 | -12.6 | 0 | 0 | 0 | 111.5 | I73 G74 A75 K80 S81 | I73-N77 WeakPolarHBondContact O-CB 3.34Å; I73-N77 VanDerWaalsContact O-CG 3.25Å; I73-N77 PolarHBondContact O-N 3.21Å; G74-N77 PolarHBondContact O-N 2.88Å; A75-N77 VanDerWaalsContact C-N 3.35Å; A75-N77 PolarHBondContact O-N 3.45Å; N77-K80 PolarHBondContact O-N 3.15Å; N77-S81 PolarHBondContact O-N 3.03Å |
| 78 | L | 97.3 | Very high | 97.5 | Very high | 109 Ų | 109 | 100.3 Ų | 100.3 | 57% | 0.571 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.5 | -48.6 | 175.3 | -178.2 | 64.6 | 0 | 0 | 0 | 111.4 | G74 A75 K80 S81 I82 | G74-L78 PolarHBondContact O-N 2.98Å; A75-L78 PolarHBondContact O-N 3.42Å; L78-K80 VanDerWaalsContact C-N 3.31Å; L78-K80 PolarHBondContact O-N 2.93Å; L78-S81 WeakPolarHBondContact O-CB 3.39Å; L78-S81 PolarHBondContact O-N 3.39Å; L78-S81 VanDerWaalsContact O-N 3.12Å; L78-I82 HydrophobicContact CD1-CD1 4.29Å; L78-I82 HydrophobicContact CD1-CG1 4.5Å; L78-I82 HydrophobicContact CG-CD1 3.96Å; L78-I82 WeakPolarHBondContact O-CG1 3.47Å; L78-I82 PolarHBondContact O-N 3.49Å |
| 79 | L | 97 | Very high | 97.4 | Very high | 119 Ų | 119 | 99.9 Ų | 99.9 | 62% | 0.623 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -58.3 | -43.6 | 177.1 | -74.4 | 173.6 | 0 | 0 | 0 | 112.1 | A75 R76 S81 I82 A83 | A75-L79 WeakPolarHBondContact O-CG 3.32Å; A75-L79 PolarHBondContact O-N 3.37Å; R76-L79 PolarHBondContact O-N 3.37Å; L79-S81 VanDerWaalsContact C-N 3.32Å; L79-S81 PolarHBondContact O-N 3.31Å; L79-I82 PolarHBondContact O-N 2.91Å; L79-A83 PolarHBondContact O-N 3.43Å |
| 80 | K | 97.3 | Very high | 97.4 | Very high | 162 Ų | 162 | 100.3 Ų | 100.3 | 70% | 0.704 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -61.9 | -40.5 | 176.2 | -170.6 | 176.4 | -178.8 | 179.4 | 0 | 111.8 | R76 N77 L78 A83 K84 | R76-K80 PolarHBondContact O-N 3.2Å; N77-K80 PolarHBondContact O-N 3.15Å; L78-K80 VanDerWaalsContact C-N 3.31Å; L78-K80 PolarHBondContact O-N 2.93Å; K80-A83 PolarHBondContact O-N 3.48Å; K80-K84 PolarHBondContact O-N 3.44Å; K80-K84 VanDerWaalsContact O-N 3.13Å |
| 81 | S | 97 | Very high | 97.3 | Very high | 70 Ų | 70 | 100.1 Ų | 100.1 | 49% | 0.49 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.4 | -44.6 | 176.1 | -171.5 | 0 | 0 | 0 | 0 | 111.8 | N77 L78 L79 A83 K84 Q85 | N77-S81 PolarHBondContact O-N 3.03Å; L78-S81 WeakPolarHBondContact O-CB 3.39Å; L78-S81 PolarHBondContact O-N 3.39Å; L78-S81 VanDerWaalsContact O-N 3.12Å; L79-S81 VanDerWaalsContact C-N 3.32Å; L79-S81 PolarHBondContact O-N 3.31Å; S81-A83 VanDerWaalsContact C-N 3.35Å; S81-A83 PolarHBondContact O-N 2.93Å; S81-K84 PolarHBondContact O-N 3.19Å; S81-Q85 WeakPolarHBondContact O-CB 3.45Å; S81-Q85 PolarHBondContact O-N 3.28Å |
| 82 | I | 96.8 | Very high | 97.3 | Very high | 63 Ų | 63 | 101.4 Ų | 101.4 | 32% | 0.323 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.7 | -43.8 | 177.9 | -68.5 | 167.7 | 0 | 0 | 0 | 110.7 | L78 L79 K84 Q85 R86 | L78-I82 HydrophobicContact CD1-CD1 4.29Å; L78-I82 HydrophobicContact CD1-CG1 4.5Å; L78-I82 HydrophobicContact CG-CD1 3.96Å; L78-I82 WeakPolarHBondContact O-CG1 3.47Å; L78-I82 PolarHBondContact O-N 3.49Å; L79-I82 PolarHBondContact O-N 2.91Å; I82-K84 VanDerWaalsContact C-N 3.35Å; I82-K84 PolarHBondContact O-N 3.31Å; I82-Q85 PolarHBondContact O-N 3.17Å; I82-R86 HydrophobicContact CG2-CG 4.46Å; I82-R86 WeakPolarHBondContact O-CB 3.5Å; I82-R86 WeakPolarHBondContact O-CG 3.3Å; I82-R86 PolarHBondContact O-N 2.87Å |
| 83 | A | 96.1 | Very high | 97.3 | Very high | 58 Ų | 58 | 103.7 Ų | 103.7 | 48% | 0.479 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.2 | -46.1 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | L79 K80 S81 Q85 R86 E87 | L79-A83 PolarHBondContact O-N 3.43Å; K80-A83 PolarHBondContact O-N 3.48Å; S81-A83 VanDerWaalsContact C-N 3.35Å; S81-A83 PolarHBondContact O-N 2.93Å; A83-Q85 PolarHBondContact O-N 2.91Å; A83-R86 PolarHBondContact O-N 3.38Å; A83-E87 PolarHBondContact O-N 3.34Å |
| 84 | K | 96.9 | Very high | 97.3 | Very high | 158 Ų | 158 | 106.2 Ų | 106.2 | 69% | 0.687 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.6 | -40.6 | 176.8 | -170.8 | 178.1 | -179.3 | -178.1 | 0 | 112.3 | K80 S81 I82 E87 A88 | K80-K84 PolarHBondContact O-N 3.44Å; K80-K84 VanDerWaalsContact O-N 3.13Å; S81-K84 PolarHBondContact O-N 3.19Å; I82-K84 VanDerWaalsContact C-N 3.35Å; I82-K84 PolarHBondContact O-N 3.31Å; K84-E87 PolarHBondContact O-N 2.87Å; K84-A88 WeakPolarHBondContact O-CB 3.38Å; K84-A88 PolarHBondContact O-N 2.7Å |
| 85 | Q | 96.9 | Very high | 97.3 | Very high | 110 Ų | 110 | 107.3 Ų | 107.3 | 51% | 0.514 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.3 | -42.7 | 176.5 | -174.5 | 179.1 | 7.3 | 0 | 0 | 111.5 | S81 I82 A83 A88 Q89 | S81-Q85 WeakPolarHBondContact O-CB 3.45Å; S81-Q85 PolarHBondContact O-N 3.28Å; I82-Q85 PolarHBondContact O-N 3.17Å; A83-Q85 PolarHBondContact O-N 2.91Å; Q85-A88 PolarHBondContact O-N 3.08Å; Q85-Q89 WeakPolarHBondContact O-CB 3.42Å; Q85-Q89 WeakPolarHBondContact O-CG 3.3Å; Q85-Q89 PolarHBondContact O-N 3.07Å |
| 86 | R | 97.1 | Very high | 97.3 | Very high | 178 Ų | 178 | 108.9 Ų | 108.9 | 67% | 0.672 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -60.9 | -44.8 | 175.6 | -77.7 | -177.9 | 178 | -169 | -0.1 | 111.8 | I82 A83 Q89 Q90 | I82-R86 HydrophobicContact CG2-CG 4.46Å; I82-R86 WeakPolarHBondContact O-CB 3.5Å; I82-R86 WeakPolarHBondContact O-CG 3.3Å; I82-R86 PolarHBondContact O-N 2.87Å; A83-R86 PolarHBondContact O-N 3.38Å; R86-Q89 PolarHBondContact O-N 3.47Å; R86-Q90 WeakPolarHBondContact O-CB 3.41Å; R86-Q90 PolarHBondContact O-N 3.25Å |
| 87 | E | 97.1 | Very high | 97.3 | Very high | 114 Ų | 114 | 105.2 Ų | 105.2 | 53% | 0.533 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -60.9 | -46.3 | 177.6 | -171.8 | -178.8 | -179.9 | 0 | 0 | 111.5 | A83 K84 Q89 Q90 Q91 | A83-E87 PolarHBondContact O-N 3.34Å; K84-E87 PolarHBondContact O-N 2.87Å; E87-Q89 PolarHBondContact O-N 2.94Å; E87-Q90 PolarHBondContact O-N 2.91Å; E87-Q91 WeakPolarHBondContact O-CG 3.35Å; E87-Q91 PolarHBondContact O-N 2.95Å |
| 88 | A | 97.1 | Very high | 97.3 | Very high | 45 Ų | 45 | 103.7 Ų | 103.7 | 37% | 0.372 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.3 | -43.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | K84 Q85 Q90 Q91 Q92 | K84-A88 WeakPolarHBondContact O-CB 3.38Å; K84-A88 PolarHBondContact O-N 2.7Å; Q85-A88 PolarHBondContact O-N 3.08Å; A88-Q90 VanDerWaalsContact C-N 3.34Å; A88-Q90 PolarHBondContact O-N 3.21Å; A88-Q91 PolarHBondContact O-N 3.28Å; A88-Q92 WeakPolarHBondContact O-CG 3.46Å; A88-Q92 PolarHBondContact O-N 3.15Å |
| 89 | Q | 97.2 | Very high | 97.3 | Very high | 95 Ų | 95 | 103.2 Ų | 103.2 | 44% | 0.444 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.1 | -41.4 | 175.8 | -76.8 | 177.7 | -20.1 | 0 | 0 | 111.9 | Q85 R86 E87 Q92 L93 | Q85-Q89 WeakPolarHBondContact O-CB 3.42Å; Q85-Q89 WeakPolarHBondContact O-CG 3.3Å; Q85-Q89 PolarHBondContact O-N 3.07Å; R86-Q89 PolarHBondContact O-N 3.47Å; E87-Q89 PolarHBondContact O-N 2.94Å; Q89-Q92 PolarHBondContact O-N 3.25Å; Q89-L93 WeakPolarHBondContact O-CG 3.41Å; Q89-L93 PolarHBondContact O-N 3.4Å |
| 90 | Q | 97.5 | Very high | 97.3 | Very high | 118 Ų | 118 | 103 Ų | 103 | 55% | 0.551 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63 | -44.2 | 177.5 | -176.1 | 177.4 | -9 | 0 | 0 | 111.6 | R86 E87 A88 L93 Q94 | R86-Q90 WeakPolarHBondContact O-CB 3.41Å; R86-Q90 PolarHBondContact O-N 3.25Å; E87-Q90 PolarHBondContact O-N 2.91Å; A88-Q90 VanDerWaalsContact C-N 3.34Å; A88-Q90 PolarHBondContact O-N 3.21Å; Q90-L93 PolarHBondContact O-N 2.93Å; Q90-Q94 WeakPolarHBondContact O-CG 3.45Å; Q90-Q94 PolarHBondContact O-N 3.27Å |
| 91 | Q | 97.5 | Very high | 97.3 | Very high | 115 Ų | 115 | 102 Ų | 102 | 54% | 0.537 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.2 | -43.1 | 175.9 | -71.2 | 176.8 | 2.8 | 0 | 0 | 111.7 | E87 A88 L93 Q94 A95 | E87-Q91 WeakPolarHBondContact O-CG 3.35Å; E87-Q91 PolarHBondContact O-N 2.95Å; A88-Q91 PolarHBondContact O-N 3.28Å; Q91-L93 PolarHBondContact O-N 2.94Å; Q91-Q94 PolarHBondContact O-N 2.98Å; Q91-A95 PolarHBondContact O-N 3.08Å |
| 92 | Q | 97.5 | Very high | 97.2 | Very high | 140 Ų | 140 | 102.8 Ų | 102.8 | 65% | 0.654 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -60.5 | -45 | 175.4 | -76.2 | -179.6 | -23.2 | 0 | 0 | 112.2 | A88 Q89 A95 L96 | A88-Q92 WeakPolarHBondContact O-CG 3.46Å; A88-Q92 PolarHBondContact O-N 3.15Å; Q89-Q92 PolarHBondContact O-N 3.25Å; Q92-A95 PolarHBondContact O-N 3.07Å; Q92-L96 PolarHBondContact O-N 3.39Å |
| 93 | L | 97.8 | Very high | 97.2 | Very high | 110 Ų | 110 | 102.7 Ų | 102.7 | 58% | 0.576 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64 | -40.6 | 177.4 | -73.3 | 170.6 | 0 | 0 | 0 | 111.9 | Q89 Q90 Q91 L96 I97 | Q89-L93 WeakPolarHBondContact O-CG 3.41Å; Q89-L93 PolarHBondContact O-N 3.4Å; Q90-L93 PolarHBondContact O-N 2.93Å; Q91-L93 PolarHBondContact O-N 2.94Å; L93-L96 PolarHBondContact O-N 2.92Å; L93-I97 VanDerWaalsContact O-CG1 3.26Å; L93-I97 WeakPolarHBondContact O-CG1 3.36Å; L93-I97 PolarHBondContact O-N 2.9Å |
| 94 | Q | 97.8 | Very high | 97.2 | Very high | 115 Ų | 115 | 104.1 Ų | 104.1 | 54% | 0.537 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63 | -42.6 | 175.9 | -76.3 | 178.9 | -10.6 | 0 | 0 | 112.1 | Q90 Q91 I97 A98 | Q90-Q94 WeakPolarHBondContact O-CG 3.45Å; Q90-Q94 PolarHBondContact O-N 3.27Å; Q91-Q94 PolarHBondContact O-N 2.98Å; Q94-I97 PolarHBondContact O-N 2.98Å; Q94-A98 WeakPolarHBondContact O-CB 3.46Å; Q94-A98 PolarHBondContact O-N 3.04Å |
| 95 | A | 97.6 | Very high | 97 | Very high | 63 Ų | 63 | 101.3 Ų | 101.3 | 52% | 0.521 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -60.9 | -44.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q91 Q92 I97 A98 E99 | Q91-A95 PolarHBondContact O-N 3.08Å; Q92-A95 PolarHBondContact O-N 3.07Å; A95-I97 PolarHBondContact O-N 3.28Å; A95-A98 PolarHBondContact O-N 2.95Å; A95-E99 PolarHBondContact O-N 3.49Å |
| 96 | L | 98.1 | Very high | 96.9 | Very high | 86 Ų | 86 | 104.2 Ų | 104.2 | 45% | 0.45 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.1 | -41.8 | 177.3 | -174.1 | 67.2 | 0 | 0 | 0 | 112.1 | Q92 L93 A98 E99 K100 | Q92-L96 PolarHBondContact O-N 3.39Å; L93-L96 PolarHBondContact O-N 2.92Å; L96-A98 VanDerWaalsContact C-N 3.33Å; L96-A98 PolarHBondContact O-N 3.09Å; L96-E99 PolarHBondContact O-N 2.8Å; L96-K100 WeakPolarHBondContact O-CB 3.45Å; L96-K100 VanDerWaalsContact O-CG 3.29Å; L96-K100 WeakPolarHBondContact O-CG 3.47Å; L96-K100 PolarHBondContact O-N 3.49Å |
| 97 | I | 97.8 | Very high | 96.8 | Very high | 97 Ų | 97 | 102.7 Ų | 102.7 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.3 | -43.7 | 175.3 | -70.7 | 165.2 | 0 | 0 | 0 | 110.5 | L93 Q94 A95 K100 K101 | L93-I97 VanDerWaalsContact O-CG1 3.26Å; L93-I97 WeakPolarHBondContact O-CG1 3.36Å; L93-I97 PolarHBondContact O-N 2.9Å; Q94-I97 PolarHBondContact O-N 2.98Å; A95-I97 PolarHBondContact O-N 3.28Å; I97-K100 PolarHBondContact O-N 3.38Å; I97-K101 HydrophobicContact CG2-CD 4.34Å; I97-K101 WeakPolarHBondContact O-CG 3.49Å; I97-K101 PolarHBondContact O-N 2.91Å |
| 98 | A | 97.6 | Very high | 96.6 | Very high | 52 Ų | 52 | 104.8 Ų | 104.8 | 43% | 0.43 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.8 | -42.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q94 A95 L96 K101 T102 | Q94-A98 WeakPolarHBondContact O-CB 3.46Å; Q94-A98 PolarHBondContact O-N 3.04Å; A95-A98 PolarHBondContact O-N 2.95Å; L96-A98 VanDerWaalsContact C-N 3.33Å; L96-A98 PolarHBondContact O-N 3.09Å; A98-K101 PolarHBondContact O-N 3.35Å; A98-T102 PolarHBondContact O-N 3.18Å; A98-T102 PolarHBondContact O-OG1 3.28Å |
| 99 | E | 97.4 | Very high | 96.3 | Very high | 100 Ų | 100 | 108.6 Ų | 108.6 | 47% | 0.467 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.1 | -49 | 174.6 | -168.5 | -163.4 | 149.3 | 0 | 0 | 111.2 | A95 L96 K101 T102 Q103 | A95-E99 PolarHBondContact O-N 3.49Å; L96-E99 PolarHBondContact O-N 2.8Å; E99-K101 PolarHBondContact O-N 3.4Å; E99-T102 WeakPolarHBondContact O-CB 3.48Å; E99-T102 PolarHBondContact O-N 3.2Å; E99-Q103 WeakPolarHBondContact O-CG 3.31Å; E99-Q103 PolarHBondContact O-N 3.02Å; E99-Q103 PolarHBondContact OE1-NE2 2.83Å |
| 100 | K | 97.6 | Very high | 95.6 | Very high | 115 Ų | 115 | 110.4 Ų | 110.4 | 50% | 0.5 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -64.5 | -39.3 | -179.8 | -68.8 | -70.7 | 163.8 | -156.3 | 0 | 112.8 | L96 I97 T102 Q103 L104 | L96-K100 WeakPolarHBondContact O-CB 3.45Å; L96-K100 VanDerWaalsContact O-CG 3.29Å; L96-K100 WeakPolarHBondContact O-CG 3.47Å; L96-K100 PolarHBondContact O-N 3.49Å; I97-K100 PolarHBondContact O-N 3.38Å; K100-T102 VanDerWaalsContact C-N 3.33Å; K100-Q103 PolarHBondContact O-N 3.43Å; K100-L104 WeakPolarHBondContact O-CB 3.44Å; K100-L104 PolarHBondContact O-N 2.86Å |
| 101 | K | 96.6 | Very high | 93.9 | Very high | 140 Ų | 140 | 117 Ų | 117 | 61% | 0.609 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -61.1 | -43.3 | 172.9 | -78.2 | -176.9 | 177.7 | -176.2 | 0 | 111.5 | I97 A98 E99 L104 E105 | I97-K101 HydrophobicContact CG2-CD 4.34Å; I97-K101 WeakPolarHBondContact O-CG 3.49Å; I97-K101 PolarHBondContact O-N 2.91Å; A98-K101 PolarHBondContact O-N 3.35Å; E99-K101 PolarHBondContact O-N 3.4Å; K101-L104 PolarHBondContact O-N 3.28Å; K101-E105 WeakPolarHBondContact O-CG 3.38Å; K101-E105 PolarHBondContact O-N 3.28Å |
| 102 | T | 96.4 | Very high | 93.7 | Very high | 86 Ų | 86 | 117.1 Ų | 117.1 | 53% | 0.528 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.6 | -42.3 | 178.1 | -53.9 | 0 | 0 | 0 | 0 | 111.6 | A98 E99 K100 L104 E105 R106 | A98-T102 PolarHBondContact O-N 3.18Å; A98-T102 PolarHBondContact O-OG1 3.28Å; E99-T102 WeakPolarHBondContact O-CB 3.48Å; E99-T102 PolarHBondContact O-N 3.2Å; K100-T102 VanDerWaalsContact C-N 3.33Å; T102-L104 VanDerWaalsContact C-N 3.34Å; T102-E105 PolarHBondContact O-N 2.9Å; T102-R106 PolarHBondContact O-N 2.86Å |
| 103 | Q | 95.3 | Very high | 93.5 | Very high | 62 Ų | 62 | 115.8 Ų | 115.8 | 29% | 0.29 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60.6 | -42.8 | 173.8 | -73.8 | 170.1 | 2.9 | 0 | 0 | 111.6 | E99 K100 R106 Y107 | E99-Q103 WeakPolarHBondContact O-CG 3.31Å; E99-Q103 PolarHBondContact O-N 3.02Å; E99-Q103 PolarHBondContact OE1-NE2 2.83Å; K100-Q103 PolarHBondContact O-N 3.43Å; Q103-R106 WeakPolarHBondContact O-CB 3.37Å; Q103-R106 PolarHBondContact O-N 3.26Å; Q103-Y107 VanDerWaalsContact O-CD2 3.22Å; Q103-Y107 WeakPolarHBondContact O-CD2 3.39Å; Q103-Y107 PolarHBondContact O-N 3.26Å; Q103-Y107 VanDerWaalsContact O-N 3.08Å |
| 104 | L | 95.7 | Very high | 93.2 | Very high | 88 Ų | 88 | 116.2 Ų | 116.2 | 46% | 0.461 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.4 | -42 | 179.3 | -173.6 | 138.5 | 0 | 0 | 0 | 112.5 | K100 K101 T102 R106 Y107 R108 | K100-L104 WeakPolarHBondContact O-CB 3.44Å; K100-L104 PolarHBondContact O-N 2.86Å; K101-L104 PolarHBondContact O-N 3.28Å; T102-L104 VanDerWaalsContact C-N 3.34Å; L104-R106 VanDerWaalsContact C-N 3.34Å; L104-Y107 PolarHBondContact O-N 2.84Å; L104-R108 WeakPolarHBondContact O-CG 3.5Å; L104-R108 PolarHBondContact O-N 3.33Å; L104-R108 VanDerWaalsContact O-N 3.1Å |
| 105 | E | 94.6 | Very high | 93 | Very high | 98 Ų | 98 | 116.2 Ų | 116.2 | 46% | 0.458 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.3 | -36.8 | 175 | -69.7 | -55.9 | 141.1 | 0 | 0 | 112.1 | K101 T102 R108 V109 | K101-E105 WeakPolarHBondContact O-CG 3.38Å; K101-E105 PolarHBondContact O-N 3.28Å; T102-E105 PolarHBondContact O-N 2.9Å; E105-R108 PolarHBondContact O-N 2.71Å; E105-R108 IonicContact OE1-CZ 2.77Å; E105-R108 IonicContact OE1-NH1 2.69Å; E105-R108 PolarHBondContact OE1-NH1 3Å; E105-R108 IonicContact OE2-NH1 2.98Å; E105-V109 WeakPolarHBondContact O-CG2 3.33Å; E105-V109 PolarHBondContact O-N 2.78Å |
| 106 | R | 94.3 | Very high | 92.7 | Very high | 171 Ų | 171 | 119.6 Ų | 119.6 | 65% | 0.645 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -58.4 | -50 | 171.6 | -81 | -178.2 | 154.4 | -161.3 | -6.8 | 112 | T102 Q103 L104 R108 V109 E110 | T102-R106 PolarHBondContact O-N 2.86Å; Q103-R106 WeakPolarHBondContact O-CB 3.37Å; Q103-R106 PolarHBondContact O-N 3.26Å; L104-R106 VanDerWaalsContact C-N 3.34Å; R106-R108 PolarHBondContact O-N 2.79Å; R106-V109 PolarHBondContact O-N 3.03Å; R106-E110 WeakPolarHBondContact O-CG 3.43Å; R106-E110 PolarHBondContact O-N 2.91Å; R106-E110 VanDerWaalsContact O-N 3.11Å |
| 107 | Y | 94.1 | Very high | 92.3 | Very high | 146 Ų | 146 | 121.8 Ų | 121.8 | 57% | 0.573 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -62.4 | -29.7 | 179.3 | -68.2 | -45.3 | 0 | 0 | 0 | 113.4 | Q103 L104 V109 Y111 | Q103-Y107 VanDerWaalsContact O-CD2 3.22Å; Q103-Y107 WeakPolarHBondContact O-CD2 3.39Å; Q103-Y107 PolarHBondContact O-N 3.26Å; Q103-Y107 VanDerWaalsContact O-N 3.08Å; L104-Y107 PolarHBondContact O-N 2.84Å; Y107-V109 VanDerWaalsContact C-N 3.32Å; Y107-Y111 PolarHBondContact O-N 3.01Å |
| 108 | R | 92.4 | Very high | 91.9 | Very high | 158 Ų | 158 | 123.6 Ų | 123.6 | 60% | 0.596 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -71 | -23.5 | 174.7 | -77.8 | 177.7 | 169.3 | 177.7 | -6.7 | 114.4 | L104 E105 R106 | L104-R108 WeakPolarHBondContact O-CG 3.5Å; L104-R108 PolarHBondContact O-N 3.33Å; L104-R108 VanDerWaalsContact O-N 3.1Å; E105-R108 PolarHBondContact O-N 2.71Å; E105-R108 IonicContact OE1-CZ 2.77Å; E105-R108 IonicContact OE1-NH1 2.69Å; E105-R108 PolarHBondContact OE1-NH1 3Å; E105-R108 IonicContact OE2-NH1 2.98Å; R106-R108 PolarHBondContact O-N 2.79Å |
| 109 | V | 92 | Very high | 91.5 | Very high | 125 Ų | 125 | 129.1 Ų | 129.1 | 76% | 0.758 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -89.7 | -29.1 | 177.8 | 175.2 | 0 | 0 | 0 | 0 | 110.7 | E105 R106 Y107 | E105-V109 WeakPolarHBondContact O-CG2 3.33Å; E105-V109 PolarHBondContact O-N 2.78Å; R106-V109 PolarHBondContact O-N 3.03Å; Y107-V109 VanDerWaalsContact C-N 3.32Å |
| 110 | E | 82.9 | Confident | 91 | Very high | 133 Ų | 133 | 131.5 Ų | 131.5 | 62% | 0.621 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -80.6 | -12.7 | -179.6 | -70.3 | 176.2 | -179.4 | 0 | 0 | 114.2 | R106 | R106-E110 WeakPolarHBondContact O-CG 3.43Å; R106-E110 PolarHBondContact O-N 2.91Å; R106-E110 VanDerWaalsContact O-N 3.11Å |
| 111 | Y | 60.4 | Low | 90.4 | Very high | 256 Ų | 256 | 133 Ų | 133 | 100% | 1.004 | 60% | 0.595 | S | S | * | * | trans | -125.9 | 0 | 176.8 | -80.2 | -82.2 | 0 | 0 | 0 | 111.6 | Y107 | Y107-Y111 PolarHBondContact O-N 3.01Š|
Retrieved 111 of 111 residues in 32.3 ms
(Link to these results)