| 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 | 91.2 | Very high | 97.1 | Very high | 200 Ų | 200 | 102.3 Ų | 102.3 | 99% | 0.985 | 57% | 0.574 | S | S | * | * | 0 | -52.1 | 0 | -65.1 | 179.5 | 76.1 | 0 | 0 | 112.5 | S3 A4 L5 | M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 3.28Å; M1-A4 PolarHBondContact O-N 3.44Å; M1-A4 VanDerWaalsContact O-N 3.09Å; M1-L5 PolarHBondContact O-N 3.36Å; M1-L5 VanDerWaalsContact O-N 3.14Å | |||
| 2 | Q | 96.9 | Very high | 96.8 | Very high | 156 Ų | 156 | 109.4 Ų | 109.4 | 73% | 0.729 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -52.5 | -43.2 | -177 | -66.9 | -62.7 | -14 | 0 | 0 | 114.8 | A4 L5 K6 | Q2-A4 PolarHBondContact O-N 2.96Å; Q2-L5 PolarHBondContact O-N 3.01Å; Q2-K6 PolarHBondContact O-N 2.83Å |
| 3 | S | 97.7 | Very high | 96.8 | Very high | 94 Ų | 94 | 110.4 Ų | 110.4 | 66% | 0.657 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -58.6 | -47.9 | 176.9 | -171.2 | 0 | 0 | 0 | 0 | 112.4 | M1 L5 K6 T7 | M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 3.28Å; S3-L5 PolarHBondContact O-N 3.47Å; S3-K6 WeakPolarHBondContact O-CB 3.34Å; S3-K6 PolarHBondContact O-N 3.46Å; S3-T7 PolarHBondContact O-N 3.14Å; S3-T7 PolarHBondContact O-OG1 2.99Å |
| 4 | A | 97.9 | Very high | 96.9 | Very high | 67 Ų | 67 | 105.7 Ų | 105.7 | 55% | 0.554 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -64.8 | -38 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | M1 Q2 T7 F8 | M1-A4 PolarHBondContact O-N 3.44Å; M1-A4 VanDerWaalsContact O-N 3.09Å; Q2-A4 PolarHBondContact O-N 2.96Å; A4-T7 PolarHBondContact O-N 3.21Å; A4-F8 WeakPolarHBondContact O-CB 3.48Å; A4-F8 PolarHBondContact O-N 3.27Å |
| 5 | L | 98.2 | Very high | 96.9 | Very high | 100 Ų | 100 | 101.6 Ų | 101.6 | 52% | 0.524 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -65.6 | -41.2 | 174.8 | -68 | 176.1 | 0 | 0 | 0 | 111.6 | M1 Q2 S3 F8 A9 | M1-L5 PolarHBondContact O-N 3.36Å; M1-L5 VanDerWaalsContact O-N 3.14Å; Q2-L5 PolarHBondContact O-N 3.01Å; S3-L5 PolarHBondContact O-N 3.47Å; L5-F8 PolarHBondContact O-N 3.02Å; L5-A9 WeakPolarHBondContact O-CB 3.45Å; L5-A9 PolarHBondContact O-N 3.46Å |
| 6 | K | 98.1 | Very high | 96.9 | Very high | 147 Ų | 147 | 99.1 Ų | 99.1 | 64% | 0.639 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -60.8 | -49.7 | 174.2 | -173.6 | -179.9 | 179 | -177.9 | 0 | 110.4 | Q2 S3 F8 A9 V10 | Q2-K6 PolarHBondContact O-N 2.83Å; S3-K6 WeakPolarHBondContact O-CB 3.34Å; S3-K6 PolarHBondContact O-N 3.46Å; K6-F8 PolarHBondContact O-N 3.42Å; K6-A9 PolarHBondContact O-N 2.91Å; K6-A9 VanDerWaalsContact O-N 3.12Å; K6-V10 HydrophobicContact CG-CG1 4.27Å; K6-V10 HydrophobicContact CG-CG2 4.4Å; K6-V10 WeakPolarHBondContact O-CG1 3.34Å; K6-V10 WeakPolarHBondContact O-CG2 3.46Å; K6-V10 PolarHBondContact O-N 3.28Å |
| 7 | T | 98.3 | Very high | 96.9 | Very high | 60 Ų | 60 | 96 Ų | 96 | 37% | 0.368 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -56.2 | -49.1 | 176.7 | -59.8 | 0 | 0 | 0 | 0 | 111.5 | S3 A4 A9 V10 D11 | S3-T7 PolarHBondContact O-N 3.14Å; S3-T7 PolarHBondContact O-OG1 2.99Å; A4-T7 PolarHBondContact O-N 3.21Å; T7-A9 PolarHBondContact O-N 3.35Å; T7-V10 PolarHBondContact O-N 3.41Å; T7-D11 HydrophobicContact CG2-CB 4.21Å; T7-D11 WeakPolarHBondContact O-CB 3.07Å; T7-D11 PolarHBondContact O-N 3.02Å |
| 8 | F | 98.1 | Very high | 97 | Very high | 56 Ų | 56 | 93 Ų | 93 | 25% | 0.246 | 53% | 0.533 | C | S | . | . | H | α-helix | trans | -60.2 | -31.3 | 177.8 | -178.6 | -111.5 | 0 | 0 | 0 | 113.4 | A4 L5 K6 V15 Y20 L23 L24 | A4-F8 WeakPolarHBondContact O-CB 3.48Å; A4-F8 PolarHBondContact O-N 3.27Å; L5-F8 PolarHBondContact O-N 3.02Å; K6-F8 PolarHBondContact O-N 3.42Å; F8-V15 HydrophobicContact CD2-CG2 4.22Å; F8-V15 HydrophobicContact CE2-CG2 3.88Å; F8-Y20 HydrophobicContact CE1-CE2 4.45Å; F8-Y20 AromaticContact CE2-CD2 3.72Å; F8-Y20 HydrophobicContact CE2-CD2 3.72Å; F8-Y20 HydrophobicContact CE2-CE2 4.35Å; F8-Y20 AromaticContact CZ-CD2 3.73Å; F8-Y20 HydrophobicContact CZ-CD2 3.73Å; F8-Y20 HydrophobicContact CZ-CE2 4.08Å; F8-L23 HydrophobicContact CE2-CD1 4.12Å; F8-L23 HydrophobicContact CZ-CB 4.32Å; F8-L23 HydrophobicContact CZ-CD1 4.27Å; F8-L24 HydrophobicContact CE1-CD2 4.19Å |
| 9 | A | 96.8 | Very high | 97 | Very high | 79 Ų | 79 | 90.4 Ų | 90.4 | 65% | 0.653 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -83.9 | -29.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | L5 K6 T7 | L5-A9 WeakPolarHBondContact O-CB 3.45Å; L5-A9 PolarHBondContact O-N 3.46Å; K6-A9 PolarHBondContact O-N 2.91Å; K6-A9 VanDerWaalsContact O-N 3.12Å; T7-A9 PolarHBondContact O-N 3.35Å |
| 10 | V | 96.8 | Very high | 97.1 | Very high | 104 Ų | 104 | 90.3 Ų | 90.3 | 63% | 0.63 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -111.8 | -21.6 | -170.9 | -52.4 | 0 | 0 | 0 | 0 | 114.3 | K6 T7 | K6-V10 HydrophobicContact CG-CG1 4.27Å; K6-V10 HydrophobicContact CG-CG2 4.4Å; K6-V10 WeakPolarHBondContact O-CG1 3.34Å; K6-V10 WeakPolarHBondContact O-CG2 3.46Å; K6-V10 PolarHBondContact O-N 3.28Å; T7-V10 PolarHBondContact O-N 3.41Å |
| 11 | D | 97.7 | Very high | 97.1 | Very high | 62 Ų | 62 | 89.6 Ų | 89.6 | 33% | 0.332 | 50% | 0.501 | S | S | . | . | trans | -110.7 | 99.8 | -179.3 | 178 | 7.4 | 0 | 0 | 0 | 109.8 | T7 T13 S14 | T7-D11 HydrophobicContact CG2-CB 4.21Å; T7-D11 WeakPolarHBondContact O-CB 3.07Å; T7-D11 PolarHBondContact O-N 3.02Å; D11-T13 PolarHBondContact O-N 3.3Å; D11-T13 VanDerWaalsContact O-N 3.16Å; D11-T13 WeakPolarHBondContact OD1-CA 3.48Å; D11-T13 WeakPolarHBondContact OD1-CB 3.5Å; D11-T13 PolarHBondContact OD1-N 3.15Å; D11-T13 PolarHBondContact OD1-OG1 3.26Å; D11-S14 VanDerWaalsContact O-CB 3.27Å; D11-S14 WeakPolarHBondContact O-CB 3.5Å; D11-S14 PolarHBondContact O-N 3.37Å; D11-S14 VanDerWaalsContact O-N 3.12Å; D11-S14 PolarHBondContact O-OG 3.26Å | ||
| 12 | E | 94.1 | Very high | 97.5 | Very high | 188 Ų | 188 | 83.2 Ų | 83.2 | 88% | 0.879 | 47% | 0.467 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.8 | -14.1 | 178.9 | -61.1 | -176.3 | -179.7 | 0 | 0 | 113.1 | ||
| 13 | T | 96.8 | Very high | 97.5 | Very high | 122 Ų | 122 | 80.8 Ų | 80.8 | 75% | 0.748 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.1 | -5.5 | 177.7 | 71.6 | 0 | 0 | 0 | 0 | 113.4 | D11 V15 | D11-T13 PolarHBondContact O-N 3.3Å; D11-T13 VanDerWaalsContact O-N 3.16Å; D11-T13 WeakPolarHBondContact OD1-CA 3.48Å; D11-T13 WeakPolarHBondContact OD1-CB 3.5Å; D11-T13 PolarHBondContact OD1-N 3.15Å; D11-T13 PolarHBondContact OD1-OG1 3.26Å; T13-V15 PolarHBondContact O-N 3.09Å |
| 14 | S | 97.6 | Very high | 97.5 | Very high | 45 Ų | 45 | 80 Ų | 80 | 32% | 0.315 | 45% | 0.447 | S | S | . | . | S | Bend | trans | -64.7 | -25.2 | -178.1 | 64.6 | 0 | 0 | 0 | 0 | 114 | D11 | D11-S14 VanDerWaalsContact O-CB 3.27Å; D11-S14 WeakPolarHBondContact O-CB 3.5Å; D11-S14 PolarHBondContact O-N 3.37Å; D11-S14 VanDerWaalsContact O-N 3.12Å; D11-S14 PolarHBondContact O-OG 3.26Å |
| 15 | V | 97.6 | Very high | 97.5 | Very high | 44 Ų | 44 | 80 Ų | 80 | 27% | 0.267 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -144.3 | 161.6 | 171.7 | -64.5 | 0 | 0 | 0 | 0 | 110.2 | F8 T13 I19 | F8-V15 HydrophobicContact CD2-CG2 4.22Å; F8-V15 HydrophobicContact CE2-CG2 3.88Å; T13-V15 PolarHBondContact O-N 3.09Å; V15-I19 HydrophobicContact CB-CB 4.35Å; V15-I19 HydrophobicContact CB-CG2 4.14Å; V15-I19 HydrophobicContact CG1-CG2 4.3Å; V15-I19 HydrophobicContact CG2-CG2 4.45Å |
| 16 | S | 96.9 | Very high | 97.6 | Very high | 62 Ų | 62 | 79.4 Ų | 79.4 | 43% | 0.434 | 45% | 0.448 | S | S | . | . | trans | -63.8 | 149.8 | 170 | 70.9 | 0 | 0 | 0 | 0 | 111.7 | Y18 I19 Y20 | S16-Y18 PolarHBondContact O-N 2.97Å; S16-I19 PolarHBondContact O-N 3.01Å; S16-I19 WeakPolarHBondContact OG-CG1 3.34Å; S16-I19 PolarHBondContact OG-N 3.43Å; S16-Y20 PolarHBondContact O-N 3.3Å | ||
| 17 | G | 97 | Very high | 97.5 | Very high | 46 Ų | 46 | 82 Ų | 82 | 47% | 0.474 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -54.7 | -38.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | I19 Y20 H21 | G17-I19 PolarHBondContact O-N 3.22Å; G17-Y20 WeakPolarHBondContact O-CB 3.45Å; G17-Y20 PolarHBondContact O-N 3.33Å; G17-H21 PolarHBondContact O-CD2 3.12Å; G17-H21 PolarHBondContact O-N 3.47Å |
| 18 | Y | 97.9 | Very high | 97.5 | Very high | 42 Ų | 42 | 81 Ų | 81 | 17% | 0.165 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -58 | -47.2 | 175.1 | -179.8 | -84.7 | 0 | 0 | 0 | 112.3 | S16 K22 V28 E29 V31 P64 L65 | S16-Y18 PolarHBondContact O-N 2.97Å; Y18-K22 HydrophobicContact CD1-CG 4.15Å; Y18-K22 HydrophobicContact CE1-CG 3.6Å; Y18-K22 HydrophobicContact CE2-CG 4.41Å; Y18-K22 WeakPolarHBondContact O-CB 3.27Å; Y18-K22 PolarHBondContact O-N 3.16Å; Y18-K22 WeakPolarHBondContact OH-CE 3.38Å; Y18-V28 HydrophobicContact CD2-CG2 4.11Å; Y18-V28 HydrophobicContact CE2-CG2 3.87Å; Y18-E29 WeakPolarHBondContact CE2-O 3.48Å; Y18-V31 HydrophobicContact CD2-CB 4.08Å; Y18-V31 HydrophobicContact CD2-CG2 3.49Å; Y18-V31 VanDerWaalsContact CD2-CG2 3.49Å; Y18-V31 HydrophobicContact CE2-CB 3.99Å; Y18-V31 HydrophobicContact CE2-CG2 3.67Å; Y18-V31 HydrophobicContact CG-CG2 4.42Å; Y18-P64 HydrophobicContact CD1-CB 3.86Å; Y18-P64 HydrophobicContact CD1-CG 3.38Å; Y18-P64 HydrophobicContact CD2-CG 4.49Å; Y18-P64 HydrophobicContact CE1-CB 4.12Å; Y18-P64 HydrophobicContact CE1-CG 3.26Å; Y18-P64 HydrophobicContact CE2-CG 4.36Å; Y18-P64 HydrophobicContact CG-CG 4.02Å; Y18-L65 HydrophobicContact CE1-CB 4.36Å |
| 19 | I | 98.1 | Very high | 97.4 | Very high | 44 Ų | 44 | 86.8 Ų | 86.8 | 23% | 0.226 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -66.4 | -42.3 | 179 | -69.4 | 178.5 | 0 | 0 | 0 | 110.2 | V15 S16 G17 H21 K22 L23 | V15-I19 HydrophobicContact CB-CB 4.35Å; V15-I19 HydrophobicContact CB-CG2 4.14Å; V15-I19 HydrophobicContact CG1-CG2 4.3Å; V15-I19 HydrophobicContact CG2-CG2 4.45Å; S16-I19 PolarHBondContact O-N 3.01Å; S16-I19 WeakPolarHBondContact OG-CG1 3.34Å; S16-I19 PolarHBondContact OG-N 3.43Å; G17-I19 PolarHBondContact O-N 3.22Å; I19-H21 PolarHBondContact O-N 3.18Å; I19-K22 PolarHBondContact O-N 2.91Å; I19-L23 HydrophobicContact CG2-CD1 3.66Å; I19-L23 HydrophobicContact CG2-CG 4.04Å; I19-L23 WeakPolarHBondContact O-CB 3.2Å; I19-L23 VanDerWaalsContact O-CG 3.25Å; I19-L23 WeakPolarHBondContact O-CG 3.25Å; I19-L23 PolarHBondContact O-N 2.89Å |
| 20 | Y | 98.3 | Very high | 97.3 | Very high | 88 Ų | 88 | 88.8 Ų | 88.8 | 35% | 0.345 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -54.1 | -53.8 | 176.2 | 180 | -95.3 | 0 | 0 | 0 | 111.8 | F8 S16 G17 L23 L24 | F8-Y20 HydrophobicContact CE1-CE2 4.45Å; F8-Y20 AromaticContact CE2-CD2 3.72Å; F8-Y20 HydrophobicContact CE2-CD2 3.72Å; F8-Y20 HydrophobicContact CE2-CE2 4.35Å; F8-Y20 AromaticContact CZ-CD2 3.73Å; F8-Y20 HydrophobicContact CZ-CD2 3.73Å; F8-Y20 HydrophobicContact CZ-CE2 4.08Å; S16-Y20 PolarHBondContact O-N 3.3Å; G17-Y20 WeakPolarHBondContact O-CB 3.45Å; G17-Y20 PolarHBondContact O-N 3.33Å; Y20-L23 PolarHBondContact O-N 3.32Å; Y20-L24 HydrophobicContact CD1-CD1 4.05Å; Y20-L24 HydrophobicContact CE1-CD1 3.43Å; Y20-L24 VanDerWaalsContact CE1-CD1 3.43Å; Y20-L24 HydrophobicContact CE2-CD1 4.01Å; Y20-L24 VanDerWaalsContact CZ-CD1 3.4Å; Y20-L24 WeakPolarHBondContact O-CG 3.46Å; Y20-L24 PolarHBondContact O-N 2.64Å; Y20-L24 VanDerWaalsContact O-N 3.15Å |
| 21 | H | 98.2 | Very high | 97.2 | Very high | 76 Ų | 76 | 87.2 Ų | 87.2 | 35% | 0.352 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.6 | -42.5 | -179.3 | -75.6 | -77 | 0 | 0 | 0 | 112.9 | G17 I19 L23 L24 G25 H26 V28 | G17-H21 PolarHBondContact O-CD2 3.12Å; G17-H21 PolarHBondContact O-N 3.47Å; I19-H21 PolarHBondContact O-N 3.18Å; H21-L23 VanDerWaalsContact C-N 3.35Å; H21-L23 PolarHBondContact O-N 2.96Å; H21-L24 PolarHBondContact O-N 3.39Å; H21-G25 PolarHBondContact O-N 3.26Å; H21-H26 HydrophobicContact CB-CB 4.04Å; H21-H26 AromaticContact CE1-ND1 3.92Å; H21-H26 AromaticContact CG-ND1 3.91Å; H21-H26 AromaticContact ND1-CG 3.79Å; H21-H26 AromaticContact ND1-ND1 3.02Å; H21-H26 PolarHBondContact ND1-ND1 3.49Å; H21-H26 WeakPolarHBondContact O-CB 3.45Å; H21-H26 PolarHBondContact O-N 2.77Å; H21-V28 HydrophobicContact CB-CG1 3.43Å; H21-V28 VanDerWaalsContact CB-CG1 3.43Å |
| 22 | K | 97.9 | Very high | 97.1 | Very high | 65 Ų | 65 | 90.3 Ų | 90.3 | 28% | 0.283 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.1 | -38.6 | 176.2 | -78.5 | -62.2 | -164.6 | -161.2 | 0 | 112.2 | Y18 I19 L24 G25 V28 D30 L65 | Y18-K22 HydrophobicContact CD1-CG 4.15Å; Y18-K22 HydrophobicContact CE1-CG 3.6Å; Y18-K22 HydrophobicContact CE2-CG 4.41Å; Y18-K22 WeakPolarHBondContact O-CB 3.27Å; Y18-K22 PolarHBondContact O-N 3.16Å; Y18-K22 WeakPolarHBondContact OH-CE 3.38Å; I19-K22 PolarHBondContact O-N 2.91Å; K22-L24 VanDerWaalsContact C-N 3.33Å; K22-G25 PolarHBondContact O-N 2.71Å; K22-V28 HydrophobicContact CD-CG2 3.45Å; K22-V28 VanDerWaalsContact CD-CG2 3.45Å; K22-V28 HydrophobicContact CG-CG2 3.64Å; K22-V28 PolarHBondContact NZ-O 3.4Å; K22-D30 IonicContact NZ-OD1 3.28Å; K22-D30 PolarHBondContact NZ-OD1 3.47Å; K22-L65 HydrophobicContact CB-CD2 4.09Å |
| 23 | L | 97.9 | Very high | 97.1 | Very high | 105 Ų | 105 | 84.7 Ų | 84.7 | 55% | 0.55 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -68.3 | -31 | 178.4 | -72.5 | 178.2 | 0 | 0 | 0 | 112.8 | F8 I19 Y20 H21 G25 | F8-L23 HydrophobicContact CE2-CD1 4.12Å; F8-L23 HydrophobicContact CZ-CB 4.32Å; F8-L23 HydrophobicContact CZ-CD1 4.27Å; I19-L23 HydrophobicContact CG2-CD1 3.66Å; I19-L23 HydrophobicContact CG2-CG 4.04Å; I19-L23 WeakPolarHBondContact O-CB 3.2Å; I19-L23 VanDerWaalsContact O-CG 3.25Å; I19-L23 WeakPolarHBondContact O-CG 3.25Å; I19-L23 PolarHBondContact O-N 2.89Å; Y20-L23 PolarHBondContact O-N 3.32Å; H21-L23 VanDerWaalsContact C-N 3.35Å; H21-L23 PolarHBondContact O-N 2.96Å; L23-G25 VanDerWaalsContact C-N 3.29Å |
| 24 | L | 98.1 | Very high | 96.9 | Very high | 79 Ų | 79 | 88.6 Ų | 88.6 | 41% | 0.414 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.8 | -0.5 | 175.7 | -65.9 | -177.1 | 0 | 0 | 0 | 114 | F8 Y20 H21 K22 H26 | F8-L24 HydrophobicContact CE1-CD2 4.19Å; Y20-L24 HydrophobicContact CD1-CD1 4.05Å; Y20-L24 HydrophobicContact CE1-CD1 3.43Å; Y20-L24 VanDerWaalsContact CE1-CD1 3.43Å; Y20-L24 HydrophobicContact CE2-CD1 4.01Å; Y20-L24 VanDerWaalsContact CZ-CD1 3.4Å; Y20-L24 WeakPolarHBondContact O-CG 3.46Å; Y20-L24 PolarHBondContact O-N 2.64Å; Y20-L24 VanDerWaalsContact O-N 3.15Å; H21-L24 PolarHBondContact O-N 3.39Å; K22-L24 VanDerWaalsContact C-N 3.33Å; L24-H26 VanDerWaalsContact C-N 3.29Å; L24-H26 PolarHBondContact O-N 2.95Å |
| 25 | G | 98.1 | Very high | 96.5 | Very high | 66 Ų | 66 | 87.8 Ų | 87.8 | 68% | 0.68 | 47% | 0.465 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 75 | 16.3 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | H21 K22 L23 | H21-G25 PolarHBondContact O-N 3.26Å; K22-G25 PolarHBondContact O-N 2.71Å; L23-G25 VanDerWaalsContact C-N 3.29Å |
| 26 | H | 98.4 | Very high | 96 | Very high | 88 Ų | 88 | 94.4 Ų | 94.4 | 41% | 0.407 | 49% | 0.493 | S | S | . | . | trans | -70.4 | 144.8 | 172.3 | -59.2 | 152.8 | 0 | 0 | 0 | 110.6 | H21 L24 V28 | H21-H26 HydrophobicContact CB-CB 4.04Å; H21-H26 AromaticContact CE1-ND1 3.92Å; H21-H26 AromaticContact CG-ND1 3.91Å; H21-H26 AromaticContact ND1-CG 3.79Å; H21-H26 AromaticContact ND1-ND1 3.02Å; H21-H26 PolarHBondContact ND1-ND1 3.49Å; H21-H26 WeakPolarHBondContact O-CB 3.45Å; H21-H26 PolarHBondContact O-N 2.77Å; L24-H26 VanDerWaalsContact C-N 3.29Å; L24-H26 PolarHBondContact O-N 2.95Å; H26-V28 PolarHBondContact O-N 3.32Å | ||
| 27 | E | 97.5 | Very high | 95.6 | Very high | 200 Ų | 200 | 94.1 Ų | 94.1 | 94% | 0.935 | 49% | 0.486 | S | S | * | . | trans | -70.9 | 121.8 | 171.3 | -66.2 | -169.2 | 167.3 | 0 | 0 | 109.9 | ||||
| 28 | V | 97.4 | Very high | 94.9 | Very high | 40 Ų | 40 | 93.9 Ų | 93.9 | 24% | 0.242 | 48% | 0.477 | C | S | . | . | trans | -138.2 | 142.5 | 173.1 | -61.7 | 0 | 0 | 0 | 0 | 109.6 | Y18 H21 K22 H26 | Y18-V28 HydrophobicContact CD2-CG2 4.11Å; Y18-V28 HydrophobicContact CE2-CG2 3.87Å; H21-V28 HydrophobicContact CB-CG1 3.43Å; H21-V28 VanDerWaalsContact CB-CG1 3.43Å; K22-V28 HydrophobicContact CD-CG2 3.45Å; K22-V28 VanDerWaalsContact CD-CG2 3.45Å; K22-V28 HydrophobicContact CG-CG2 3.64Å; K22-V28 PolarHBondContact NZ-O 3.4Å; H26-V28 PolarHBondContact O-N 3.32Å | ||
| 29 | E | 96.9 | Very high | 94.1 | Very high | 177 Ų | 177 | 102.6 Ų | 102.6 | 83% | 0.827 | 52% | 0.516 | S | S | * | . | P | Polyproline II helix | trans | -60.9 | 142.8 | 175.1 | -64 | -174.4 | 176.5 | 0 | 0 | 111.1 | Y18 V31 | Y18-E29 WeakPolarHBondContact CE2-O 3.48Å; E29-V31 PolarHBondContact O-N 2.95Å |
| 30 | D | 94.1 | Very high | 93.7 | Very high | 121 Ų | 121 | 108.4 Ų | 108.4 | 65% | 0.647 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -69.7 | 129.6 | -179.3 | -76.9 | -13.9 | 0 | 0 | 0 | 111.4 | K22 | K22-D30 IonicContact NZ-OD1 3.28Å; K22-D30 PolarHBondContact NZ-OD1 3.47Å |
| 31 | V | 95.4 | Very high | 93.4 | Very high | 71 Ų | 71 | 105.4 Ų | 105.4 | 43% | 0.43 | 52% | 0.524 | S | S | . | . | P | Polyproline II helix | trans | -100.7 | 134.8 | 179.9 | 176.5 | 0 | 0 | 0 | 0 | 110.4 | Y18 E29 P64 | Y18-V31 HydrophobicContact CD2-CB 4.08Å; Y18-V31 HydrophobicContact CD2-CG2 3.49Å; Y18-V31 VanDerWaalsContact CD2-CG2 3.49Å; Y18-V31 HydrophobicContact CE2-CB 3.99Å; Y18-V31 HydrophobicContact CE2-CG2 3.67Å; Y18-V31 HydrophobicContact CG-CG2 4.42Å; E29-V31 PolarHBondContact O-N 2.95Å; V31-P64 HydrophobicContact CB-CG 4.28Å; V31-P64 WeakPolarHBondContact O-CD 3.33Å |
| 32 | I | 95.3 | Very high | 93.1 | Very high | 128 Ų | 128 | 103.3 Ų | 103.3 | 66% | 0.656 | 52% | 0.517 | S | S | * | . | P | Polyproline II helix | trans | -103.5 | 119.8 | 172.7 | -59.9 | 175.5 | 0 | 0 | 0 | 109.4 | K34 Q62 | I32-K34 PolarHBondContact O-N 3.49Å; I32-Q62 WeakPolarHBondContact CA-O 3.37Å; I32-Q62 HydrophobicContact CG2-CB 4.48Å |
| 33 | I | 94.3 | Very high | 92.9 | Very high | 70 Ų | 70 | 100.4 Ų | 100.4 | 36% | 0.359 | 50% | 0.504 | S | S | . | . | P | Polyproline II helix | trans | -75.9 | 121.8 | 171 | -60.6 | 176.5 | 0 | 0 | 0 | 108.3 | C35 Q62 P64 | I33-C35 PolarHBondContact O-N 3.37Å; I33-Q62 PolarHBondContact N-O 3.11Å; I33-P64 HydrophobicContact CD1-CB 4.11Å |
| 34 | K | 92.1 | Very high | 92.7 | Very high | 204 Ų | 204 | 103.8 Ų | 103.8 | 89% | 0.887 | 52% | 0.517 | S | S | * | . | trans | -76.8 | 115.5 | 171.7 | -65.9 | -177.4 | -178.4 | 177.2 | 0 | 108.8 | I32 | I32-K34 PolarHBondContact O-N 3.49Š| ||
| 35 | C | 88.9 | Confident | 92.6 | Very high | 27 Ų | 27 | 103.8 Ų | 103.8 | 18% | 0.182 | 54% | 0.537 | C | S | . | . | trans | -139.6 | 154.9 | 175.1 | 65.3 | 0 | 0 | 0 | 0 | 110.4 | I33 L37 L61 | I33-C35 PolarHBondContact O-N 3.37Å; C35-L37 PolarHBondContact O-N 3Å; C35-L61 PolarHBondContact SG-O 2.95Å | ||
| 36 | Q | 88 | Confident | 92.6 | Very high | 184 Ų | 184 | 103.4 Ų | 103.4 | 86% | 0.86 | 52% | 0.519 | S | S | * | . | trans | -78.6 | 108.3 | 172.5 | -66.6 | -63.2 | -33.7 | 0 | 0 | 108.6 | ||||
| 37 | L | 87 | Confident | 92.5 | Very high | 56 Ų | 56 | 103 Ų | 103 | 29% | 0.293 | 52% | 0.524 | S | S | . | . | trans | -80.2 | 134.3 | 177.4 | -65.1 | 177.5 | 0 | 0 | 0 | 110.4 | C35 F41 K58 L61 Q62 | C35-L37 PolarHBondContact O-N 3Å; L37-F41 HydrophobicContact CB-CZ 4.28Å; L37-F41 HydrophobicContact CD2-CE1 4.23Å; L37-F41 HydrophobicContact CD2-CZ 4.3Å; L37-K58 HydrophobicContact CD1-CG 4.05Å; L37-L61 HydrophobicContact CD2-CB 4.03Å; L37-L61 HydrophobicContact CD2-CD1 4.08Å; L37-Q62 HydrophobicContact CD1-CG 4.39Å; L37-Q62 HydrophobicContact CD2-CG 4.31Å | ||
| 38 | S | 82.6 | Confident | 92.5 | Very high | 41 Ų | 41 | 98.6 Ų | 98.6 | 29% | 0.287 | 51% | 0.507 | S | S | . | . | trans | -69 | 149 | 174.1 | 60.3 | 0 | 0 | 0 | 0 | 110.9 | R40 H86 | S38-R40 PolarHBondContact O-N 3.24Å; S38-R40 PolarHBondContact OG-O 3.43Å; S38-H86 PolarHBondContact OG-CE1 3.12Å | ||
| 39 | K | 81.8 | Confident | 92.5 | Very high | 225 Ų | 225 | 97.7 Ų | 97.7 | 98% | 0.978 | 50% | 0.501 | S | S | * | . | S | Bend | trans | -68 | -23.2 | 172.4 | -68.2 | -178.2 | 179.9 | 179.6 | 0 | 112.4 | ||
| 40 | R | 88.7 | Confident | 92.5 | Very high | 166 Ų | 166 | 93 Ų | 93 | 63% | 0.626 | 48% | 0.482 | S | S | * | . | trans | -130.2 | 120.8 | 179 | -168.8 | 175.5 | -176.5 | 175.2 | 1 | 109.5 | S38 D48 | S38-R40 PolarHBondContact O-N 3.24Å; S38-R40 PolarHBondContact OG-O 3.43Å; R40-D48 IonicContact CZ-OD1 3.9Å; R40-D48 IonicContact NE-OD1 3.98Å; R40-D48 IonicContact NH2-OD1 2.96Å; R40-D48 PolarHBondContact NH2-OD1 2.92Å; R40-D48 IonicContact NH2-OD2 3.64Å | ||
| 41 | F | 92.5 | Very high | 92.7 | Very high | 25 Ų | 25 | 95.1 Ų | 95.1 | 11% | 0.11 | 49% | 0.487 | C | S | . | . | trans | -86.2 | -19.7 | -177.9 | -72 | -76.6 | 0 | 0 | 0 | 113.7 | L37 A43 L49 V54 V57 K58 L61 T82 H86 | L37-F41 HydrophobicContact CB-CZ 4.28Å; L37-F41 HydrophobicContact CD2-CE1 4.23Å; L37-F41 HydrophobicContact CD2-CZ 4.3Å; F41-A43 PolarHBondContact O-N 3.4Å; F41-L49 HydrophobicContact CB-CD1 4.29Å; F41-V54 HydrophobicContact CD2-CG1 3.73Å; F41-V54 HydrophobicContact CE2-CG1 4.31Å; F41-V54 HydrophobicContact CG-CG1 4.43Å; F41-V57 HydrophobicContact CB-CG1 4.46Å; F41-V57 HydrophobicContact CD1-CB 4.32Å; F41-V57 HydrophobicContact CD1-CG1 3.6Å; F41-V57 HydrophobicContact CE1-CG1 4.26Å; F41-V57 HydrophobicContact CG-CG1 4.35Å; F41-K58 HydrophobicContact CE1-CB 4.34Å; F41-K58 HydrophobicContact CE2-CB 4.29Å; F41-K58 HydrophobicContact CZ-CB 3.89Å; F41-K58 HydrophobicContact CZ-CG 4.13Å; F41-L61 HydrophobicContact CD1-CD1 4.46Å; F41-L61 HydrophobicContact CE1-CD1 4.03Å; F41-T82 WeakPolarHBondContact O-CG2 3.42Å; F41-H86 PolarHBondContact O-NE2 3.45Å | ||
| 42 | T | 91.5 | Very high | 92.8 | Very high | 32 Ų | 32 | 95.4 Ų | 95.4 | 20% | 0.196 | 49% | 0.492 | C | S | . | . | P | Polyproline II helix | trans | -58.1 | 126.7 | 174.7 | -51.1 | 0 | 0 | 0 | 0 | 110.7 | D48 | T42-D48 WeakPolarHBondContact CB-OD1 3.43Å; T42-D48 WeakPolarHBondContact CG2-OD1 3.31Å; T42-D48 PolarHBondContact OG1-OD1 3.22Å |
| 43 | A | 95 | Very high | 92.9 | Very high | 3 Ų | 3 | 90.4 Ų | 90.4 | 3% | 0.025 | 47% | 0.466 | C | S | . | . | P | Polyproline II helix | trans | -81.2 | 147 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | F41 G45 L46 T82 Y85 | F41-A43 PolarHBondContact O-N 3.4Å; A43-G45 PolarHBondContact O-N 2.9Å; A43-L46 HydrophobicContact CB-CB 4.47Å; A43-L46 HydrophobicContact CB-CD1 4Å; A43-L46 HydrophobicContact CB-CG 4.32Å; A43-L46 PolarHBondContact O-N 3.18Å; A43-L46 VanDerWaalsContact O-N 3.14Å; A43-T82 HydrophobicContact CB-CG2 4.1Å; A43-Y85 HydrophobicContact CB-CD1 3.54Å; A43-Y85 HydrophobicContact CB-CD2 4.05Å; A43-Y85 HydrophobicContact CB-CE1 4.05Å; A43-Y85 HydrophobicContact CB-CE2 4.49Å; A43-Y85 HydrophobicContact CB-CG 3.54Å |
| 44 | Q | 94.3 | Very high | 93.1 | Very high | 176 Ų | 176 | 89.2 Ų | 89.2 | 82% | 0.822 | 46% | 0.462 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | 130.8 | 177.6 | -174 | 178.2 | 12.7 | 0 | 0 | 110.8 | L46 | Q44-L46 VanDerWaalsContact C-N 3.3Å; Q44-L46 PolarHBondContact O-N 3.42Å |
| 45 | G | 95.6 | Very high | 93.3 | Very high | 80 Ų | 80 | 86.5 Ų | 86.5 | 83% | 0.825 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.7 | 1.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 115 | A43 | A43-G45 PolarHBondContact O-N 2.9Š|
| 46 | L | 97 | Very high | 93.7 | Very high | 57 Ų | 57 | 86.1 Ų | 86.1 | 30% | 0.298 | 45% | 0.446 | S | S | . | . | S | Bend | trans | -108.6 | 155.7 | 172.7 | -64 | -172.8 | 0 | 0 | 0 | 111.6 | A43 Q44 V78 A81 T82 | A43-L46 HydrophobicContact CB-CB 4.47Å; A43-L46 HydrophobicContact CB-CD1 4Å; A43-L46 HydrophobicContact CB-CG 4.32Å; A43-L46 PolarHBondContact O-N 3.18Å; A43-L46 VanDerWaalsContact O-N 3.14Å; Q44-L46 VanDerWaalsContact C-N 3.3Å; Q44-L46 PolarHBondContact O-N 3.42Å; L46-V78 HydrophobicContact CB-CG1 4.43Å; L46-A81 HydrophobicContact CD1-CB 3.67Å; L46-T82 WeakPolarHBondContact CD1-OG1 3.47Å |
| 47 | P | 97.2 | Very high | 94.2 | Very high | 81 Ų | 81 | 77.4 Ų | 77.4 | 53% | 0.526 | 41% | 0.405 | S | S | . | . | P | Polyproline II helix | trans | -56.9 | 150 | 172.9 | -23.8 | 33.9 | 0 | 0 | 0 | 112.3 | L49 | P47-L49 PolarHBondContact O-N 2.97Š|
| 48 | D | 97.3 | Very high | 94.6 | Very high | 107 Ų | 107 | 79.3 Ų | 79.3 | 57% | 0.572 | 41% | 0.411 | S | S | * | . | P | Polyproline II helix | trans | -59.3 | 138 | 171.6 | -82.3 | -45.3 | 0 | 0 | 0 | 110.9 | R40 T42 | R40-D48 IonicContact CZ-OD1 3.9Å; R40-D48 IonicContact NE-OD1 3.98Å; R40-D48 IonicContact NH2-OD1 2.96Å; R40-D48 PolarHBondContact NH2-OD1 2.92Å; R40-D48 IonicContact NH2-OD2 3.64Å; T42-D48 WeakPolarHBondContact CB-OD1 3.43Å; T42-D48 WeakPolarHBondContact CG2-OD1 3.31Å; T42-D48 PolarHBondContact OG1-OD1 3.22Å |
| 49 | L | 97.5 | Very high | 95.3 | Very high | 20 Ų | 20 | 78.5 Ų | 78.5 | 11% | 0.105 | 40% | 0.404 | C | S | . | . | P | Polyproline II helix | trans | -80.2 | 140 | -179.4 | -58.9 | -170.5 | 0 | 0 | 0 | 110.7 | F41 P47 Q53 V54 V57 V78 T82 | F41-L49 HydrophobicContact CB-CD1 4.29Å; P47-L49 PolarHBondContact O-N 2.97Å; L49-Q53 HydrophobicContact CB-CB 3.95Å; L49-Q53 HydrophobicContact CD1-CB 4.38Å; L49-Q53 HydrophobicContact CD2-CB 4.25Å; L49-Q53 HydrophobicContact CG-CB 4.42Å; L49-V54 HydrophobicContact CB-CG2 3.65Å; L49-V54 HydrophobicContact CD1-CG2 4.36Å; L49-V57 HydrophobicContact CD1-CG2 3.73Å; L49-V78 HydrophobicContact CD2-CG1 3.92Å; L49-T82 HydrophobicContact CD1-CG2 3.87Å |
| 50 | N | 96.9 | Very high | 96.1 | Very high | 80 Ų | 80 | 69.1 Ų | 69.1 | 43% | 0.428 | 37% | 0.366 | S | S | . | . | trans | -77.2 | 175.4 | 167.6 | 71.9 | 32.8 | 0 | 0 | 0 | 111.5 | S52 Q53 V54 | N50-S52 PolarHBondContact O-N 3.32Å; N50-S52 PolarHBondContact OD1-N 2.96Å; N50-S52 VanDerWaalsContact OD1-N 3.13Å; N50-S52 PolarHBondContact OD1-OG 3.44Å; N50-Q53 PolarHBondContact O-N 3.32Å; N50-Q53 VanDerWaalsContact OD1-CG 3.28Å; N50-Q53 WeakPolarHBondContact OD1-CG 3.5Å; N50-Q53 PolarHBondContact OD1-N 3.08Å; N50-V54 WeakPolarHBondContact O-CG2 3.38Å; N50-V54 PolarHBondContact O-N 2.93Å | ||
| 51 | H | 97 | Very high | 96.4 | Very high | 164 Ų | 164 | 61.5 Ų | 61.5 | 76% | 0.759 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -56.6 | -43.9 | -176 | -175.8 | 74.3 | 0 | 0 | 0 | 114 | V54 Y55 | H51-V54 PolarHBondContact O-N 3.28Å; H51-Y55 WeakPolarHBondContact O-CB 3.49Å; H51-Y55 PolarHBondContact O-N 3.13Å |
| 52 | S | 97.8 | Very high | 96.6 | Very high | 77 Ų | 77 | 63 Ų | 63 | 54% | 0.538 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -71.2 | -34 | -178.1 | 61.1 | 0 | 0 | 0 | 0 | 112.2 | N50 Y55 A56 | N50-S52 PolarHBondContact O-N 3.32Å; N50-S52 PolarHBondContact OD1-N 2.96Å; N50-S52 VanDerWaalsContact OD1-N 3.13Å; N50-S52 PolarHBondContact OD1-OG 3.44Å; S52-Y55 PolarHBondContact O-N 3.47Å; S52-A56 WeakPolarHBondContact O-CB 3.43Å; S52-A56 PolarHBondContact O-N 2.92Å |
| 53 | Q | 98.1 | Very high | 96.9 | Very high | 23 Ų | 23 | 67.6 Ų | 67.6 | 11% | 0.107 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -69.6 | -42.8 | 174.6 | -65.3 | 168.3 | -17.7 | 0 | 0 | 111.5 | L49 N50 Y55 A56 V57 T74 T79 | L49-Q53 HydrophobicContact CB-CB 3.95Å; L49-Q53 HydrophobicContact CD1-CB 4.38Å; L49-Q53 HydrophobicContact CD2-CB 4.25Å; L49-Q53 HydrophobicContact CG-CB 4.42Å; N50-Q53 PolarHBondContact O-N 3.32Å; N50-Q53 VanDerWaalsContact OD1-CG 3.28Å; N50-Q53 WeakPolarHBondContact OD1-CG 3.5Å; N50-Q53 PolarHBondContact OD1-N 3.08Å; Q53-Y55 VanDerWaalsContact C-N 3.31Å; Q53-Y55 PolarHBondContact O-N 3.45Å; Q53-A56 WeakPolarHBondContact O-CB 3.31Å; Q53-A56 PolarHBondContact O-N 3.36Å; Q53-V57 VanDerWaalsContact O-CG2 3.31Å; Q53-V57 WeakPolarHBondContact O-CG2 3.49Å; Q53-V57 PolarHBondContact O-N 3.22Å; Q53-T74 PolarHBondContact NE2-O 3.21Å; Q53-T79 HydrophobicContact CB-CG2 4.44Å; Q53-T79 WeakPolarHBondContact CG-OG1 3.43Å |
| 54 | V | 97.6 | Very high | 96.9 | Very high | 46 Ų | 46 | 69.1 Ų | 69.1 | 28% | 0.279 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -58.3 | -45.9 | 172.8 | 170.6 | 0 | 0 | 0 | 0 | 110.7 | F41 L49 N50 H51 A56 V57 K58 | F41-V54 HydrophobicContact CD2-CG1 3.73Å; F41-V54 HydrophobicContact CE2-CG1 4.31Å; F41-V54 HydrophobicContact CG-CG1 4.43Å; L49-V54 HydrophobicContact CB-CG2 3.65Å; L49-V54 HydrophobicContact CD1-CG2 4.36Å; N50-V54 WeakPolarHBondContact O-CG2 3.38Å; N50-V54 PolarHBondContact O-N 2.93Å; H51-V54 PolarHBondContact O-N 3.28Å; V54-A56 VanDerWaalsContact C-N 3.34Å; V54-A56 PolarHBondContact O-N 3.14Å; V54-V57 PolarHBondContact O-N 3.43Å; V54-K58 WeakPolarHBondContact O-CB 3.1Å; V54-K58 PolarHBondContact O-N 3.36Å |
| 55 | Y | 97.1 | Very high | 97.1 | Very high | 147 Ų | 147 | 64.4 Ų | 64.4 | 58% | 0.576 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -60.4 | -43.3 | 176.6 | 179 | -99.3 | 0 | 0 | 0 | 111.9 | H51 S52 Q53 K58 T59 | H51-Y55 WeakPolarHBondContact O-CB 3.49Å; H51-Y55 PolarHBondContact O-N 3.13Å; S52-Y55 PolarHBondContact O-N 3.47Å; Q53-Y55 VanDerWaalsContact C-N 3.31Å; Q53-Y55 PolarHBondContact O-N 3.45Å; Y55-K58 PolarHBondContact O-N 3.48Å; Y55-T59 WeakPolarHBondContact O-CB 3.38Å; Y55-T59 PolarHBondContact O-N 2.92Å; Y55-T59 PolarHBondContact O-OG1 2.77Å |
| 56 | A | 98.1 | Very high | 97.2 | Very high | 19 Ų | 19 | 62.5 Ų | 62.5 | 16% | 0.157 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.7 | -49.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | S52 Q53 V54 K58 T59 V60 T79 | S52-A56 WeakPolarHBondContact O-CB 3.43Å; S52-A56 PolarHBondContact O-N 2.92Å; Q53-A56 WeakPolarHBondContact O-CB 3.31Å; Q53-A56 PolarHBondContact O-N 3.36Å; V54-A56 VanDerWaalsContact C-N 3.34Å; V54-A56 PolarHBondContact O-N 3.14Å; A56-K58 PolarHBondContact O-N 3.09Å; A56-T59 PolarHBondContact O-N 3.23Å; A56-V60 WeakPolarHBondContact O-CB 2.9Å; A56-V60 WeakPolarHBondContact O-CG2 3.47Å; A56-V60 PolarHBondContact O-N 2.95Å; A56-T79 HydrophobicContact CB-CG2 4.06Å |
| 57 | V | 97.2 | Very high | 97.3 | Very high | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -59.8 | -48.7 | 178.7 | 177 | 0 | 0 | 0 | 0 | 111.1 | F41 L49 Q53 V54 T59 V60 L61 T79 T82 I83 | F41-V57 HydrophobicContact CB-CG1 4.46Å; F41-V57 HydrophobicContact CD1-CB 4.32Å; F41-V57 HydrophobicContact CD1-CG1 3.6Å; F41-V57 HydrophobicContact CE1-CG1 4.26Å; F41-V57 HydrophobicContact CG-CG1 4.35Å; L49-V57 HydrophobicContact CD1-CG2 3.73Å; Q53-V57 VanDerWaalsContact O-CG2 3.31Å; Q53-V57 WeakPolarHBondContact O-CG2 3.49Å; Q53-V57 PolarHBondContact O-N 3.22Å; V54-V57 PolarHBondContact O-N 3.43Å; V57-T59 VanDerWaalsContact C-N 3.34Å; V57-T59 PolarHBondContact O-N 3.26Å; V57-V60 PolarHBondContact O-N 3.41Å; V57-L61 HydrophobicContact CG1-CD1 3.98Å; V57-L61 HydrophobicContact CG1-CG 4.44Å; V57-L61 VanDerWaalsContact O-CG 3.31Å; V57-L61 WeakPolarHBondContact O-CG 3.47Å; V57-L61 PolarHBondContact O-N 3.09Å; V57-L61 VanDerWaalsContact O-N 3.11Å; V57-T79 HydrophobicContact CG2-CG2 3.89Å; V57-T82 HydrophobicContact CG1-CG2 4.46Å; V57-T82 HydrophobicContact CG2-CG2 4.21Å; V57-I83 HydrophobicContact CB-CG1 4.19Å; V57-I83 HydrophobicContact CG1-CG1 4.15Å; V57-I83 HydrophobicContact CG2-CD1 4.41Å; V57-I83 HydrophobicContact CG2-CG1 3.82Å |
| 58 | K | 96.4 | Very high | 97.3 | Very high | 96 Ų | 96 | 67.7 Ų | 67.7 | 42% | 0.417 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -57.7 | -46.9 | 178.4 | -179.9 | 179.1 | 176.2 | -174.9 | 0 | 111.8 | L37 F41 V54 Y55 A56 Q62 | L37-K58 HydrophobicContact CD1-CG 4.05Å; F41-K58 HydrophobicContact CE1-CB 4.34Å; F41-K58 HydrophobicContact CE2-CB 4.29Å; F41-K58 HydrophobicContact CZ-CB 3.89Å; F41-K58 HydrophobicContact CZ-CG 4.13Å; V54-K58 WeakPolarHBondContact O-CB 3.1Å; V54-K58 PolarHBondContact O-N 3.36Å; Y55-K58 PolarHBondContact O-N 3.48Å; A56-K58 PolarHBondContact O-N 3.09Å; K58-Q62 WeakPolarHBondContact O-CG 3.45Å |
| 59 | T | 97.1 | Very high | 97.3 | Very high | 24 Ų | 24 | 71.8 Ų | 71.8 | 15% | 0.147 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -65.1 | -43.1 | -177.8 | -57.5 | 0 | 0 | 0 | 0 | 111.6 | Y55 A56 V57 L61 Q62 R63 | Y55-T59 WeakPolarHBondContact O-CB 3.38Å; Y55-T59 PolarHBondContact O-N 2.92Å; Y55-T59 PolarHBondContact O-OG1 2.77Å; A56-T59 PolarHBondContact O-N 3.23Å; V57-T59 VanDerWaalsContact C-N 3.34Å; V57-T59 PolarHBondContact O-N 3.26Å; T59-L61 PolarHBondContact O-N 3.4Å; T59-Q62 PolarHBondContact O-N 3.13Å; T59-R63 PolarHBondContact O-N 2.96Å |
| 60 | V | 97.6 | Very high | 97.3 | Very high | 29 Ų | 29 | 71.6 Ų | 71.6 | 18% | 0.176 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -64.8 | -41.4 | -178.6 | 172.1 | 0 | 0 | 0 | 0 | 111.5 | A56 V57 Q62 R63 I68 I83 | A56-V60 WeakPolarHBondContact O-CB 2.9Å; A56-V60 WeakPolarHBondContact O-CG2 3.47Å; A56-V60 PolarHBondContact O-N 2.95Å; V57-V60 PolarHBondContact O-N 3.41Å; V60-Q62 PolarHBondContact O-N 3.31Å; V60-Q62 VanDerWaalsContact O-N 3.09Å; V60-R63 PolarHBondContact O-N 3.39Å; V60-I68 HydrophobicContact CG2-CD1 3.73Å; V60-I68 HydrophobicContact CG2-CG1 4.03Å; V60-I83 HydrophobicContact CB-CD1 4.1Å; V60-I83 HydrophobicContact CB-CG1 4.42Å; V60-I83 HydrophobicContact CG1-CD1 4.07Å; V60-I83 HydrophobicContact CG1-CG1 4.34Å; V60-I83 HydrophobicContact CG1-CG2 3.72Å; V60-I83 HydrophobicContact CG2-CD1 3.97Å |
| 61 | L | 96 | Very high | 97.2 | Very high | 6 Ų | 6 | 72 Ų | 72 | 3% | 0.031 | 37% | 0.37 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -64.8 | -14.8 | 179.5 | -68 | 174.6 | 0 | 0 | 0 | 113.6 | C35 L37 F41 V57 T59 H86 L87 | C35-L61 PolarHBondContact SG-O 2.95Å; L37-L61 HydrophobicContact CD2-CB 4.03Å; L37-L61 HydrophobicContact CD2-CD1 4.08Å; F41-L61 HydrophobicContact CD1-CD1 4.46Å; F41-L61 HydrophobicContact CE1-CD1 4.03Å; V57-L61 HydrophobicContact CG1-CD1 3.98Å; V57-L61 HydrophobicContact CG1-CG 4.44Å; V57-L61 VanDerWaalsContact O-CG 3.31Å; V57-L61 WeakPolarHBondContact O-CG 3.47Å; V57-L61 PolarHBondContact O-N 3.09Å; V57-L61 VanDerWaalsContact O-N 3.11Å; T59-L61 PolarHBondContact O-N 3.4Å; L61-H86 HydrophobicContact CD1-CB 3.9Å; L61-H86 HydrophobicContact CD2-CB 4.02Å; L61-L87 HydrophobicContact CD2-CD2 3.69Å; L61-L87 HydrophobicContact CD2-CG 3.83Å |
| 62 | Q | 96.4 | Very high | 97.3 | Very high | 57 Ų | 57 | 70.3 Ų | 70.3 | 27% | 0.266 | 37% | 0.374 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -110.2 | 1.1 | -177.6 | -61.3 | -171.3 | -79.8 | 0 | 0 | 113.5 | I32 I33 L37 K58 T59 V60 | I32-Q62 WeakPolarHBondContact CA-O 3.37Å; I32-Q62 HydrophobicContact CG2-CB 4.48Å; I33-Q62 PolarHBondContact N-O 3.11Å; L37-Q62 HydrophobicContact CD1-CG 4.39Å; L37-Q62 HydrophobicContact CD2-CG 4.31Å; K58-Q62 WeakPolarHBondContact O-CG 3.45Å; T59-Q62 PolarHBondContact O-N 3.13Å; V60-Q62 PolarHBondContact O-N 3.31Å; V60-Q62 VanDerWaalsContact O-N 3.09Å |
| 63 | R | 96.9 | Very high | 97.2 | Very high | 128 Ų | 128 | 70.7 Ų | 70.7 | 48% | 0.483 | 39% | 0.39 | S | S | . | . | trans | -126.2 | 136.3 | -176.5 | -70.3 | -174.8 | 177.5 | -173.8 | -4.6 | 111.4 | T59 V60 L65 | T59-R63 PolarHBondContact O-N 2.96Å; V60-R63 PolarHBondContact O-N 3.39Å; R63-L65 PolarHBondContact O-N 3.19Å | ||
| 64 | P | 96.5 | Very high | 97.1 | Very high | 34 Ų | 34 | 72.4 Ų | 72.4 | 22% | 0.221 | 40% | 0.402 | C | S | . | . | S | Bend | trans | -68 | -21.9 | 176.8 | 28.4 | -36.9 | 0 | 0 | 0 | 113.7 | Y18 V31 I33 | Y18-P64 HydrophobicContact CD1-CB 3.86Å; Y18-P64 HydrophobicContact CD1-CG 3.38Å; Y18-P64 HydrophobicContact CD2-CG 4.49Å; Y18-P64 HydrophobicContact CE1-CB 4.12Å; Y18-P64 HydrophobicContact CE1-CG 3.26Å; Y18-P64 HydrophobicContact CE2-CG 4.36Å; Y18-P64 HydrophobicContact CG-CG 4.02Å; V31-P64 HydrophobicContact CB-CG 4.28Å; V31-P64 WeakPolarHBondContact O-CD 3.33Å; I33-P64 HydrophobicContact CD1-CB 4.11Å |
| 65 | L | 97.8 | Very high | 97.1 | Very high | 77 Ų | 77 | 71.3 Ų | 71.3 | 40% | 0.403 | 40% | 0.4 | S | S | . | . | S | Bend | trans | -140.5 | 131.3 | 174.5 | -176.4 | 62.2 | 0 | 0 | 0 | 109.3 | Y18 K22 R63 | Y18-L65 HydrophobicContact CE1-CB 4.36Å; K22-L65 HydrophobicContact CB-CD2 4.09Å; R63-L65 PolarHBondContact O-N 3.19Å |
| 66 | S | 98.1 | Very high | 97.1 | Very high | 40 Ų | 40 | 68.3 Ų | 68.3 | 28% | 0.28 | 39% | 0.39 | S | S | . | . | trans | -142.2 | 142.3 | 177.9 | -69.8 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 67 | L | 98.3 | Very high | 97.1 | Very high | 175 Ų | 175 | 73.1 Ų | 73.1 | 92% | 0.916 | 42% | 0.418 | S | S | * | . | trans | -113 | 126 | 170.5 | -71.2 | 170.3 | 0 | 0 | 0 | 108.5 | ||||
| 68 | I | 97.9 | Very high | 97.1 | Very high | 72 Ų | 72 | 75 Ų | 75 | 37% | 0.369 | 43% | 0.429 | S | S | . | . | trans | -111.1 | 122.5 | 176.3 | -54.5 | 174.7 | 0 | 0 | 0 | 108.1 | V60 I83 | V60-I68 HydrophobicContact CG2-CD1 3.73Å; V60-I68 HydrophobicContact CG2-CG1 4.03Å; I68-I83 HydrophobicContact CD1-CD1 3.46Å; I68-I83 VanDerWaalsContact CD1-CD1 3.46Å | ||
| 69 | Q | 97.7 | Very high | 97.2 | Very high | 193 Ų | 193 | 70.6 Ų | 70.6 | 90% | 0.902 | 41% | 0.41 | S | S | * | . | trans | -114 | 141.7 | 174.8 | -173.1 | -174.2 | -4.1 | 0 | 0 | 109.8 | ||||
| 70 | G | 95.8 | Very high | 97.3 | Very high | 16 Ų | 16 | 72.2 Ų | 72.2 | 17% | 0.165 | 42% | 0.422 | C | S | . | . | trans | -159.8 | 139.2 | 173 | 0 | 0 | 0 | 0 | 0 | 111.6 | T74 K76 | G70-T74 WeakPolarHBondContact CA-OG1 3.36Å; G70-K76 WeakPolarHBondContact O-CD 3.46Å; G70-K76 WeakPolarHBondContact O-CE 3.29Å; G70-K76 PolarHBondContact O-NZ 2.91Å | ||
| 71 | P | 96.6 | Very high | 97.3 | Very high | 89 Ų | 89 | 72.9 Ų | 72.9 | 58% | 0.578 | 43% | 0.431 | S | S | * | . | trans | -54.3 | 171.1 | 170.6 | -25.9 | 31.3 | 0 | 0 | 0 | 114.2 | G73 T74 K76 | P71-G73 PolarHBondContact O-N 3.48Å; P71-T74 HydrophobicContact CB-CG2 3.81Å; P71-T74 HydrophobicContact CG-CG2 4.05Å; P71-T74 PolarHBondContact O-N 3.47Å; P71-T74 PolarHBondContact O-OG1 2.93Å; P71-T74 VanDerWaalsContact O-OG1 3.05Å; P71-K76 PolarHBondContact O-NZ 2.96Å | ||
| 72 | P | 97.5 | Very high | 97.4 | Very high | 128 Ų | 128 | 72.6 Ų | 72.6 | 83% | 0.831 | 43% | 0.429 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.4 | 139.8 | 168.8 | -24.2 | 35.3 | 0 | 0 | 0 | 111.2 | T74 | P72-T74 VanDerWaalsContact C-N 3.31Å; P72-T74 PolarHBondContact O-N 3.18Å |
| 73 | G | 95.8 | Very high | 97.4 | Very high | 86 Ų | 86 | 70.5 Ų | 70.5 | 89% | 0.887 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 78.8 | -4.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | P71 G75 | P71-G73 PolarHBondContact O-N 3.48Å; G73-G75 PolarHBondContact O-N 3.4Å; G73-G75 VanDerWaalsContact O-N 3.1Å |
| 74 | T | 96.6 | Very high | 97.4 | Very high | 59 Ų | 59 | 68.8 Ų | 68.8 | 36% | 0.362 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -82.4 | 17.4 | -175.3 | 68.9 | 0 | 0 | 0 | 0 | 115.5 | Q53 G70 P71 P72 K76 | Q53-T74 PolarHBondContact NE2-O 3.21Å; G70-T74 WeakPolarHBondContact CA-OG1 3.36Å; P71-T74 HydrophobicContact CB-CG2 3.81Å; P71-T74 HydrophobicContact CG-CG2 4.05Å; P71-T74 PolarHBondContact O-N 3.47Å; P71-T74 PolarHBondContact O-OG1 2.93Å; P71-T74 VanDerWaalsContact O-OG1 3.05Å; P72-T74 VanDerWaalsContact C-N 3.31Å; P72-T74 PolarHBondContact O-N 3.18Å; T74-K76 PolarHBondContact O-N 3.44Å |
| 75 | G | 97.2 | Very high | 97.4 | Very high | 23 Ų | 23 | 70.6 Ų | 70.6 | 24% | 0.237 | 43% | 0.427 | C | S | . | . | trans | 69.9 | 29.1 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | G73 T77 V78 T79 | G73-G75 PolarHBondContact O-N 3.4Å; G73-G75 VanDerWaalsContact O-N 3.1Å; G75-T77 VanDerWaalsContact C-N 3.31Å; G75-T77 PolarHBondContact O-N 3Å; G75-V78 PolarHBondContact O-N 3.23Å; G75-T79 WeakPolarHBondContact O-CB 3.38Å; G75-T79 PolarHBondContact O-N 2.8Å; G75-T79 PolarHBondContact O-OG1 3.4Å | ||
| 76 | K | 97.7 | Very high | 97.2 | Very high | 84 Ų | 84 | 67.8 Ų | 67.8 | 37% | 0.365 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -51.6 | -48.5 | 174.7 | -69.8 | -172.7 | -66.4 | -71.4 | 0 | 111.9 | G70 P71 T74 V78 T79 S80 | G70-K76 WeakPolarHBondContact O-CD 3.46Å; G70-K76 WeakPolarHBondContact O-CE 3.29Å; G70-K76 PolarHBondContact O-NZ 2.91Å; P71-K76 PolarHBondContact O-NZ 2.96Å; T74-K76 PolarHBondContact O-N 3.44Å; K76-V78 PolarHBondContact O-N 2.96Å; K76-T79 WeakPolarHBondContact O-CB 3.38Å; K76-T79 PolarHBondContact O-N 2.98Å; K76-S80 WeakPolarHBondContact O-CB 3.28Å; K76-S80 PolarHBondContact O-N 2.95Å; K76-S80 PolarHBondContact O-OG 2.77Å; K76-S80 VanDerWaalsContact O-OG 3.07Å |
| 77 | T | 97.6 | Very high | 97 | Very high | 120 Ų | 120 | 70 Ų | 70 | 74% | 0.736 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -62.6 | -43.1 | 179.7 | -48.5 | 0 | 0 | 0 | 0 | 112.5 | G75 T79 S80 A81 | G75-T77 VanDerWaalsContact C-N 3.31Å; G75-T77 PolarHBondContact O-N 3Å; T77-T79 VanDerWaalsContact C-N 3.34Å; T77-T79 PolarHBondContact O-N 3.48Å; T77-S80 PolarHBondContact O-N 3.24Å; T77-A81 VanDerWaalsContact O-CB 3.32Å; T77-A81 WeakPolarHBondContact O-CB 3.37Å; T77-A81 PolarHBondContact O-N 3.25Å |
| 78 | V | 98.1 | Very high | 96.8 | Very high | 38 Ų | 38 | 65.5 Ų | 65.5 | 23% | 0.23 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -63.2 | -42.5 | 176.3 | 175.3 | 0 | 0 | 0 | 0 | 110.8 | L46 L49 G75 K76 A81 T82 | L46-V78 HydrophobicContact CB-CG1 4.43Å; L49-V78 HydrophobicContact CD2-CG1 3.92Å; G75-V78 PolarHBondContact O-N 3.23Å; K76-V78 PolarHBondContact O-N 2.96Å; V78-A81 PolarHBondContact O-N 3.47Å; V78-T82 WeakPolarHBondContact O-CB 3.43Å; V78-T82 PolarHBondContact O-N 2.77Å; V78-T82 PolarHBondContact O-OG1 3.14Å |
| 79 | T | 98.2 | Very high | 96.5 | Very high | 5 Ų | 5 | 70.5 Ų | 70.5 | 3% | 0.031 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -63.3 | -47.4 | 177.3 | -51.4 | 0 | 0 | 0 | 0 | 110.8 | Q53 A56 V57 G75 K76 T77 T82 I83 | Q53-T79 HydrophobicContact CB-CG2 4.44Å; Q53-T79 WeakPolarHBondContact CG-OG1 3.43Å; A56-T79 HydrophobicContact CB-CG2 4.06Å; V57-T79 HydrophobicContact CG2-CG2 3.89Å; G75-T79 WeakPolarHBondContact O-CB 3.38Å; G75-T79 PolarHBondContact O-N 2.8Å; G75-T79 PolarHBondContact O-OG1 3.4Å; K76-T79 WeakPolarHBondContact O-CB 3.38Å; K76-T79 PolarHBondContact O-N 2.98Å; T77-T79 VanDerWaalsContact C-N 3.34Å; T77-T79 PolarHBondContact O-N 3.48Å; T79-T82 WeakPolarHBondContact O-CB 3.49Å; T79-T82 PolarHBondContact O-N 2.87Å; T79-I83 HydrophobicContact CG2-CD1 4.21Å; T79-I83 WeakPolarHBondContact O-CG1 3.47Å; T79-I83 PolarHBondContact O-N 2.83Å |
| 80 | S | 98.3 | Very high | 95.9 | Very high | 57 Ų | 57 | 64.1 Ų | 64.1 | 40% | 0.399 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.8 | -44.7 | 177.2 | -62 | 0 | 0 | 0 | 0 | 112.4 | K76 T77 T82 I83 V84 | K76-S80 WeakPolarHBondContact O-CB 3.28Å; K76-S80 PolarHBondContact O-N 2.95Å; K76-S80 PolarHBondContact O-OG 2.77Å; K76-S80 VanDerWaalsContact O-OG 3.07Å; T77-S80 PolarHBondContact O-N 3.24Å; S80-T82 PolarHBondContact O-N 3.5Å; S80-I83 WeakPolarHBondContact O-CB 3.49Å; S80-I83 PolarHBondContact O-N 3.35Å; S80-V84 WeakPolarHBondContact O-CG2 3.32Å; S80-V84 PolarHBondContact O-N 3.18Å |
| 81 | A | 98.2 | Very high | 94.4 | Very high | 43 Ų | 43 | 66.3 Ų | 66.3 | 36% | 0.355 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.4 | -37 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L46 T77 V78 V84 Y85 | L46-A81 HydrophobicContact CD1-CB 3.67Å; T77-A81 VanDerWaalsContact O-CB 3.32Å; T77-A81 WeakPolarHBondContact O-CB 3.37Å; T77-A81 PolarHBondContact O-N 3.25Å; V78-A81 PolarHBondContact O-N 3.47Å; A81-V84 PolarHBondContact O-N 3.36Å; A81-Y85 WeakPolarHBondContact O-CB 3.41Å; A81-Y85 PolarHBondContact O-N 3.41Å |
| 82 | T | 97.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 69.4 Ų | 69.4 | 0% | 0 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -67.9 | -39.7 | 175.1 | -55.9 | 0 | 0 | 0 | 0 | 112.4 | F41 A43 L46 L49 V57 V78 T79 S80 Y85 H86 | F41-T82 WeakPolarHBondContact O-CG2 3.42Å; A43-T82 HydrophobicContact CB-CG2 4.1Å; L46-T82 WeakPolarHBondContact CD1-OG1 3.47Å; L49-T82 HydrophobicContact CD1-CG2 3.87Å; V57-T82 HydrophobicContact CG1-CG2 4.46Å; V57-T82 HydrophobicContact CG2-CG2 4.21Å; V78-T82 WeakPolarHBondContact O-CB 3.43Å; V78-T82 PolarHBondContact O-N 2.77Å; V78-T82 PolarHBondContact O-OG1 3.14Å; T79-T82 WeakPolarHBondContact O-CB 3.49Å; T79-T82 PolarHBondContact O-N 2.87Å; S80-T82 PolarHBondContact O-N 3.5Å; T82-Y85 WeakPolarHBondContact O-CB 3.4Å; T82-Y85 PolarHBondContact O-N 3.48Å; T82-H86 PolarHBondContact O-CD2 2.92Å; T82-H86 PolarHBondContact O-N 3.07Å; T82-H86 VanDerWaalsContact O-N 3.13Å |
| 83 | I | 97.2 | Very high | 90.2 | Very high | 13 Ų | 13 | 70.2 Ų | 70.2 | 7% | 0.067 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -60.2 | -50.5 | 173.5 | -71.1 | 159.9 | 0 | 0 | 0 | 110.5 | V57 V60 I68 T79 S80 Y85 H86 L87 | V57-I83 HydrophobicContact CB-CG1 4.19Å; V57-I83 HydrophobicContact CG1-CG1 4.15Å; V57-I83 HydrophobicContact CG2-CD1 4.41Å; V57-I83 HydrophobicContact CG2-CG1 3.82Å; V60-I83 HydrophobicContact CB-CD1 4.1Å; V60-I83 HydrophobicContact CB-CG1 4.42Å; V60-I83 HydrophobicContact CG1-CD1 4.07Å; V60-I83 HydrophobicContact CG1-CG1 4.34Å; V60-I83 HydrophobicContact CG1-CG2 3.72Å; V60-I83 HydrophobicContact CG2-CD1 3.97Å; I68-I83 HydrophobicContact CD1-CD1 3.46Å; I68-I83 VanDerWaalsContact CD1-CD1 3.46Å; T79-I83 HydrophobicContact CG2-CD1 4.21Å; T79-I83 WeakPolarHBondContact O-CG1 3.47Å; T79-I83 PolarHBondContact O-N 2.83Å; S80-I83 WeakPolarHBondContact O-CB 3.49Å; S80-I83 PolarHBondContact O-N 3.35Å; I83-Y85 VanDerWaalsContact C-N 3.3Å; I83-Y85 PolarHBondContact O-N 2.92Å; I83-H86 PolarHBondContact O-N 3.33Å; I83-L87 HydrophobicContact CG2-CD1 3.83Å; I83-L87 HydrophobicContact CG2-CG 4.36Å; I83-L87 WeakPolarHBondContact O-CG 3.5Å; I83-L87 PolarHBondContact O-N 2.74Å |
| 84 | V | 96.8 | Very high | 89.9 | Confident | 93 Ų | 93 | 69.5 Ų | 69.5 | 56% | 0.564 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -59.8 | -42.5 | 178.8 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | S80 A81 H86 L87 A88 | S80-V84 WeakPolarHBondContact O-CG2 3.32Å; S80-V84 PolarHBondContact O-N 3.18Å; A81-V84 PolarHBondContact O-N 3.36Å; V84-H86 VanDerWaalsContact C-N 3.34Å; V84-H86 PolarHBondContact O-N 3.5Å; V84-L87 PolarHBondContact O-N 3.04Å; V84-A88 WeakPolarHBondContact O-CB 3.35Å; V84-A88 PolarHBondContact O-N 3.05Å |
| 85 | Y | 95.8 | Very high | 89.6 | Confident | 72 Ų | 72 | 70 Ų | 70 | 28% | 0.282 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -55.4 | -46.4 | 175.6 | 172.6 | -92.2 | 0 | 0 | 0 | 112.4 | A43 A81 T82 I83 R89 | A43-Y85 HydrophobicContact CB-CD1 3.54Å; A43-Y85 HydrophobicContact CB-CD2 4.05Å; A43-Y85 HydrophobicContact CB-CE1 4.05Å; A43-Y85 HydrophobicContact CB-CE2 4.49Å; A43-Y85 HydrophobicContact CB-CG 3.54Å; A81-Y85 WeakPolarHBondContact O-CB 3.41Å; A81-Y85 PolarHBondContact O-N 3.41Å; T82-Y85 WeakPolarHBondContact O-CB 3.4Å; T82-Y85 PolarHBondContact O-N 3.48Å; I83-Y85 VanDerWaalsContact C-N 3.3Å; I83-Y85 PolarHBondContact O-N 2.92Å; Y85-R89 VanDerWaalsContact CE1-CD 3.47Å; Y85-R89 WeakPolarHBondContact O-CD 3.46Å; Y85-R89 VanDerWaalsContact O-CG 3.29Å; Y85-R89 WeakPolarHBondContact O-CG 3.46Å; Y85-R89 PolarHBondContact O-N 3.46Å |
| 86 | H | 94.8 | Very high | 89.2 | Confident | 18 Ų | 18 | 72.6 Ų | 72.6 | 8% | 0.083 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -70.9 | -41 | 178.6 | -71.5 | -63 | 0 | 0 | 0 | 112.4 | S38 F41 L61 T82 I83 V84 R89 Q90 | S38-H86 PolarHBondContact OG-CE1 3.12Å; F41-H86 PolarHBondContact O-NE2 3.45Å; L61-H86 HydrophobicContact CD1-CB 3.9Å; L61-H86 HydrophobicContact CD2-CB 4.02Å; T82-H86 PolarHBondContact O-CD2 2.92Å; T82-H86 PolarHBondContact O-N 3.07Å; T82-H86 VanDerWaalsContact O-N 3.13Å; I83-H86 PolarHBondContact O-N 3.33Å; V84-H86 VanDerWaalsContact C-N 3.34Å; V84-H86 PolarHBondContact O-N 3.5Å; H86-R89 PolarHBondContact O-N 3.1Å; H86-Q90 WeakPolarHBondContact O-CG 3.32Å; H86-Q90 PolarHBondContact O-N 3.35Å |
| 87 | L | 94.1 | Very high | 88.7 | Confident | 85 Ų | 85 | 71.9 Ų | 71.9 | 45% | 0.445 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.9 | -45.4 | 177.4 | -72.6 | 173.1 | 0 | 0 | 0 | 111.9 | L61 I83 V84 R89 Q90 | L61-L87 HydrophobicContact CD2-CD2 3.69Å; L61-L87 HydrophobicContact CD2-CG 3.83Å; I83-L87 HydrophobicContact CG2-CD1 3.83Å; I83-L87 HydrophobicContact CG2-CG 4.36Å; I83-L87 WeakPolarHBondContact O-CG 3.5Å; I83-L87 PolarHBondContact O-N 2.74Å; V84-L87 PolarHBondContact O-N 3.04Å; L87-R89 PolarHBondContact O-N 3.22Å; L87-Q90 PolarHBondContact O-N 2.89Å; L87-Q90 VanDerWaalsContact O-N 3.08Å |
| 88 | A | 93.3 | Very high | 88.1 | Confident | 81 Ų | 81 | 68.9 Ų | 68.9 | 67% | 0.669 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -60.4 | -28.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | V84 | V84-A88 WeakPolarHBondContact O-CB 3.35Å; V84-A88 PolarHBondContact O-N 3.05Å |
| 89 | R | 90.8 | Very high | 87.4 | Confident | 177 Ų | 177 | 71 Ų | 71 | 67% | 0.668 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -86.6 | -10.4 | 179.7 | -68.7 | 173.8 | 61.9 | 75.8 | 3.7 | 114 | Y85 H86 L87 G91 | Y85-R89 VanDerWaalsContact CE1-CD 3.47Å; Y85-R89 WeakPolarHBondContact O-CD 3.46Å; Y85-R89 VanDerWaalsContact O-CG 3.29Å; Y85-R89 WeakPolarHBondContact O-CG 3.46Å; Y85-R89 PolarHBondContact O-N 3.46Å; H86-R89 PolarHBondContact O-N 3.1Å; L87-R89 PolarHBondContact O-N 3.22Å; R89-G91 VanDerWaalsContact C-N 3.26Å |
| 90 | Q | 85.6 | Confident | 86.7 | Confident | 60 Ų | 60 | 75.7 Ų | 75.7 | 28% | 0.28 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.6 | -12.8 | 175 | -72.1 | 178.5 | 10.3 | 0 | 0 | 112.7 | H86 L87 N92 | H86-Q90 WeakPolarHBondContact O-CG 3.32Å; H86-Q90 PolarHBondContact O-N 3.35Å; L87-Q90 PolarHBondContact O-N 2.89Å; L87-Q90 VanDerWaalsContact O-N 3.08Å; Q90-N92 VanDerWaalsContact C-N 3.28Å; Q90-N92 PolarHBondContact O-N 3.49Å |
| 91 | G | 65.4 | Low | 85.8 | Confident | 62 Ų | 62 | 77.2 Ų | 77.2 | 64% | 0.639 | 49% | 0.491 | S | S | * | . | trans | 70.7 | 17.2 | 171 | 0 | 0 | 0 | 0 | 0 | 115.4 | R89 G93 | R89-G91 VanDerWaalsContact C-N 3.26Å; G91-G93 VanDerWaalsContact C-N 3.32Å | ||
| 92 | N | 60.5 | Low | 84.8 | Confident | 153 Ų | 153 | 80 Ų | 80 | 82% | 0.818 | 50% | 0.502 | S | S | * | . | trans | -95.8 | 29.3 | 177.3 | -68.3 | -20.5 | 0 | 0 | 0 | 112.6 | Q90 | Q90-N92 VanDerWaalsContact C-N 3.28Å; Q90-N92 PolarHBondContact O-N 3.49Å | ||
| 93 | G | 44.9 | Very low | 83.6 | Confident | 146 Ų | 146 | 87.3 Ų | 87.3 | 100% | 1.505 | 55% | 0.547 | S | S | * | . | trans | -100.6 | 0 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | G91 | G91-G93 VanDerWaalsContact C-N 3.32Š|
Retrieved 93 of 93 residues in 90.5 ms
(Link to these results)