| 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 | 87.1 | Confident | 95.3 | Very high | 204 Ų | 204 | 105.3 Ų | 105.3 | 100% | 1.005 | 59% | 0.588 | S | S | * | * | 0 | -51.5 | 0 | -74 | -168.8 | -82 | 0 | 0 | 113 | S3 A4 L5 | M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 3.14Å; M1-A4 PolarHBondContact O-N 3.26Å; M1-L5 PolarHBondContact O-N 3.46Å | |||
| 2 | Q | 95.8 | Very high | 95 | Very high | 171 Ų | 171 | 112.5 Ų | 112.5 | 80% | 0.799 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -53.1 | -42.9 | -178.1 | -70.8 | -176.2 | -10.3 | 0 | 0 | 114.5 | A4 L5 K6 | Q2-A4 PolarHBondContact O-N 3.34Å; Q2-L5 PolarHBondContact O-N 3.32Å; Q2-K6 PolarHBondContact O-N 3.47Å |
| 3 | S | 96.4 | Very high | 94.9 | Very high | 94 Ų | 94 | 113.2 Ų | 113.2 | 66% | 0.657 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -59.6 | -44.3 | 176 | -168.7 | 0 | 0 | 0 | 0 | 112.6 | M1 K6 T7 | M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 3.14Å; S3-K6 PolarHBondContact O-N 3.03Å; S3-T7 PolarHBondContact O-N 3.26Å; S3-T7 PolarHBondContact O-OG1 3.38Å; S3-T7 VanDerWaalsContact O-OG1 3.1Å |
| 4 | A | 96.4 | Very high | 95 | Very high | 66 Ų | 66 | 108.1 Ų | 108.1 | 55% | 0.545 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -67.4 | -38 | -180 | 0 | 0 | 0 | 0 | 0 | 111.8 | M1 Q2 T7 F8 | M1-A4 PolarHBondContact O-N 3.26Å; Q2-A4 PolarHBondContact O-N 3.34Å; A4-T7 PolarHBondContact O-N 2.92Å; A4-F8 WeakPolarHBondContact O-CB 3.38Å; A4-F8 PolarHBondContact O-N 3.15Å |
| 5 | L | 97.1 | Very high | 95.1 | Very high | 117 Ų | 117 | 104.3 Ų | 104.3 | 61% | 0.613 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -65.2 | -39.6 | 174.1 | -68.5 | 174.5 | 0 | 0 | 0 | 111.7 | M1 Q2 F8 A9 | M1-L5 PolarHBondContact O-N 3.46Å; Q2-L5 PolarHBondContact O-N 3.32Å; L5-F8 PolarHBondContact O-N 3.08Å; L5-A9 VanDerWaalsContact O-CB 3.27Å; L5-A9 WeakPolarHBondContact O-CB 3.3Å; L5-A9 PolarHBondContact O-N 3.17Å |
| 6 | K | 97.1 | Very high | 95.1 | Very high | 148 Ų | 148 | 101.9 Ų | 101.9 | 64% | 0.643 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -64.6 | -45 | 174.2 | -172.1 | 178.1 | -179.9 | -179.2 | 0 | 111.2 | Q2 S3 A9 V10 | Q2-K6 PolarHBondContact O-N 3.47Å; S3-K6 PolarHBondContact O-N 3.03Å; K6-A9 PolarHBondContact O-N 3.34Å; K6-V10 HydrophobicContact CG-CG2 4.08Å; K6-V10 WeakPolarHBondContact O-CB 3.39Å; K6-V10 WeakPolarHBondContact O-CG2 3.31Å; K6-V10 PolarHBondContact O-N 3.43Å |
| 7 | T | 97.1 | Very high | 95.1 | Very high | 64 Ų | 64 | 98.6 Ų | 98.6 | 39% | 0.393 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -59.4 | -49.3 | 174.9 | -60.2 | 0 | 0 | 0 | 0 | 110.9 | S3 A4 A9 V10 D11 | S3-T7 PolarHBondContact O-N 3.26Å; S3-T7 PolarHBondContact O-OG1 3.38Å; S3-T7 VanDerWaalsContact O-OG1 3.1Å; A4-T7 PolarHBondContact O-N 2.92Å; T7-A9 VanDerWaalsContact C-N 3.27Å; T7-A9 PolarHBondContact O-N 3.24Å; T7-V10 PolarHBondContact O-N 3.32Å; T7-D11 HydrophobicContact CG2-CB 4.19Å; T7-D11 WeakPolarHBondContact O-CB 3.42Å; T7-D11 PolarHBondContact O-N 3.32Å |
| 8 | F | 97.1 | Very high | 95.1 | Very high | 47 Ų | 47 | 95.1 Ų | 95.1 | 21% | 0.206 | 54% | 0.544 | C | S | . | . | H | α-helix | trans | -59.1 | -34.9 | 177.5 | 179.8 | -106.4 | 0 | 0 | 0 | 113.6 | A4 L5 V15 Y20 L23 L24 | A4-F8 WeakPolarHBondContact O-CB 3.38Å; A4-F8 PolarHBondContact O-N 3.15Å; L5-F8 PolarHBondContact O-N 3.08Å; F8-V15 HydrophobicContact CD2-CG1 4.48Å; F8-V15 HydrophobicContact CD2-CG2 4.04Å; F8-V15 HydrophobicContact CE2-CG2 3.81Å; F8-Y20 HydrophobicContact CD2-CD2 4.3Å; F8-Y20 HydrophobicContact CE1-CD2 4.27Å; F8-Y20 HydrophobicContact CE1-CE2 4.19Å; F8-Y20 AromaticContact CE2-CD2 3.65Å; F8-Y20 HydrophobicContact CE2-CD2 3.65Å; F8-Y20 HydrophobicContact CE2-CE2 4.31Å; F8-Y20 AromaticContact CZ-CD2 3.62Å; F8-Y20 HydrophobicContact CZ-CD2 3.62Å; F8-Y20 AromaticContact CZ-CE2 4Å; F8-Y20 HydrophobicContact CZ-CE2 4Å; F8-Y20 HydrophobicContact CZ-CG 4.42Å; F8-L23 HydrophobicContact CE2-CD1 4.03Å; F8-L23 HydrophobicContact CZ-CB 4.19Å; F8-L23 HydrophobicContact CZ-CD1 4.25Å; F8-L24 HydrophobicContact CE1-CD2 4.13Å |
| 9 | A | 94.4 | Very high | 95.2 | Very high | 70 Ų | 70 | 91.7 Ų | 91.7 | 58% | 0.579 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -83.4 | -28.1 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | L5 K6 T7 | L5-A9 VanDerWaalsContact O-CB 3.27Å; L5-A9 WeakPolarHBondContact O-CB 3.3Å; L5-A9 PolarHBondContact O-N 3.17Å; K6-A9 PolarHBondContact O-N 3.34Å; T7-A9 VanDerWaalsContact C-N 3.27Å; T7-A9 PolarHBondContact O-N 3.24Å |
| 10 | V | 94.5 | Very high | 95.3 | Very high | 110 Ų | 110 | 91.3 Ų | 91.3 | 67% | 0.667 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -116.5 | -26.6 | -168.1 | -162 | 0 | 0 | 0 | 0 | 113 | K6 T7 | K6-V10 HydrophobicContact CG-CG2 4.08Å; K6-V10 WeakPolarHBondContact O-CB 3.39Å; K6-V10 WeakPolarHBondContact O-CG2 3.31Å; K6-V10 PolarHBondContact O-N 3.43Å; T7-V10 PolarHBondContact O-N 3.32Å |
| 11 | D | 95.5 | Very high | 95.3 | Very high | 67 Ų | 67 | 90.7 Ų | 90.7 | 36% | 0.358 | 51% | 0.506 | S | S | . | . | trans | -98.7 | 104.1 | 178.2 | 178.8 | 4.4 | 0 | 0 | 0 | 110.4 | T7 T13 S14 | T7-D11 HydrophobicContact CG2-CB 4.19Å; T7-D11 WeakPolarHBondContact O-CB 3.42Å; T7-D11 PolarHBondContact O-N 3.32Å; D11-T13 PolarHBondContact O-N 3.34Å; D11-T13 VanDerWaalsContact O-N 3.13Å; D11-T13 WeakPolarHBondContact OD1-CA 3.45Å; D11-T13 WeakPolarHBondContact OD1-CB 3.44Å; D11-T13 PolarHBondContact OD1-N 3.37Å; D11-T13 PolarHBondContact OD1-OG1 2.94Å; D11-S14 VanDerWaalsContact O-CB 3.29Å; D11-S14 WeakPolarHBondContact O-CB 3.41Å; D11-S14 PolarHBondContact O-N 3.39Å; D11-S14 VanDerWaalsContact O-N 3.11Å; D11-S14 PolarHBondContact O-OG 3.45Å | ||
| 12 | E | 91.3 | Very high | 95.8 | Very high | 192 Ų | 192 | 84.6 Ų | 84.6 | 90% | 0.897 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -14.2 | 179.1 | -62.6 | -177.2 | 176.7 | 0 | 0 | 113.3 | ||
| 13 | T | 94.4 | Very high | 95.8 | Very high | 122 Ų | 122 | 81.5 Ų | 81.5 | 75% | 0.748 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -97 | -3.8 | 178 | 71.3 | 0 | 0 | 0 | 0 | 113.8 | D11 V15 | D11-T13 PolarHBondContact O-N 3.34Å; D11-T13 VanDerWaalsContact O-N 3.13Å; D11-T13 WeakPolarHBondContact OD1-CA 3.45Å; D11-T13 WeakPolarHBondContact OD1-CB 3.44Å; D11-T13 PolarHBondContact OD1-N 3.37Å; D11-T13 PolarHBondContact OD1-OG1 2.94Å; T13-V15 VanDerWaalsContact C-N 3.31Å; T13-V15 PolarHBondContact O-N 2.92Å |
| 14 | S | 95.9 | Very high | 95.8 | Very high | 42 Ų | 42 | 80.9 Ų | 80.9 | 29% | 0.294 | 45% | 0.451 | S | S | . | . | S | Bend | trans | -65 | -30.1 | -174.4 | 62.9 | 0 | 0 | 0 | 0 | 114.5 | D11 | D11-S14 VanDerWaalsContact O-CB 3.29Å; D11-S14 WeakPolarHBondContact O-CB 3.41Å; D11-S14 PolarHBondContact O-N 3.39Å; D11-S14 VanDerWaalsContact O-N 3.11Å; D11-S14 PolarHBondContact O-OG 3.45Å |
| 15 | V | 96 | Very high | 95.8 | Very high | 50 Ų | 50 | 80.9 Ų | 80.9 | 30% | 0.303 | 46% | 0.458 | S | S | . | . | S | Bend | trans | -145.8 | 163.7 | 174.3 | -65.3 | 0 | 0 | 0 | 0 | 109.9 | F8 T13 I19 Y20 | F8-V15 HydrophobicContact CD2-CG1 4.48Å; F8-V15 HydrophobicContact CD2-CG2 4.04Å; F8-V15 HydrophobicContact CE2-CG2 3.81Å; T13-V15 VanDerWaalsContact C-N 3.31Å; T13-V15 PolarHBondContact O-N 2.92Å; V15-I19 HydrophobicContact CB-CB 4.35Å; V15-I19 HydrophobicContact CB-CG2 4.19Å; V15-I19 HydrophobicContact CG1-CG2 4.36Å; V15-I19 HydrophobicContact CG2-CG2 4.48Å; V15-Y20 HydrophobicContact CG2-CD2 4.36Å |
| 16 | S | 95.3 | Very high | 95.8 | Very high | 66 Ų | 66 | 80 Ų | 80 | 46% | 0.462 | 45% | 0.451 | S | S | . | . | trans | -66.3 | 150.9 | 171.9 | 71.1 | 0 | 0 | 0 | 0 | 111.6 | Y18 I19 Y20 | S16-Y18 PolarHBondContact O-N 3.16Å; S16-I19 PolarHBondContact O-N 3.39Å; S16-I19 WeakPolarHBondContact OG-CG1 3.35Å; S16-I19 PolarHBondContact OG-N 3.11Å; S16-Y20 PolarHBondContact O-N 3.01Å | ||
| 17 | G | 95 | Very high | 95.8 | Very high | 46 Ų | 46 | 82.5 Ų | 82.5 | 47% | 0.474 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -57 | -34.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y20 H21 | G17-Y20 PolarHBondContact O-N 3.23Å; G17-H21 PolarHBondContact O-CD2 2.99Å; G17-H21 VanDerWaalsContact O-CD2 3.23Å; G17-H21 PolarHBondContact O-N 3.32Å; G17-H21 VanDerWaalsContact O-N 3.08Å |
| 18 | Y | 96.1 | Very high | 95.7 | Very high | 36 Ų | 36 | 81.3 Ų | 81.3 | 14% | 0.141 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -58.3 | -50.5 | 172.9 | 178.9 | -85.1 | 0 | 0 | 0 | 111.4 | S16 K22 V28 E29 V31 P64 L65 | S16-Y18 PolarHBondContact O-N 3.16Å; Y18-K22 HydrophobicContact CE1-CB 4.43Å; Y18-K22 HydrophobicContact CE1-CG 4.45Å; Y18-K22 VanDerWaalsContact O-CB 3.22Å; Y18-K22 WeakPolarHBondContact O-CB 3.36Å; Y18-K22 PolarHBondContact O-N 3.2Å; Y18-V28 HydrophobicContact CD2-CG1 3.56Å; Y18-V28 HydrophobicContact CE2-CB 4.47Å; Y18-V28 HydrophobicContact CE2-CG1 3.82Å; Y18-V28 HydrophobicContact CG-CG1 4.43Å; Y18-E29 VanDerWaalsContact CE2-O 3.32Å; Y18-E29 WeakPolarHBondContact CE2-O 3.48Å; Y18-V31 HydrophobicContact CD2-CB 4.22Å; Y18-V31 HydrophobicContact CD2-CG2 3.54Å; Y18-V31 HydrophobicContact CE2-CB 4.14Å; Y18-V31 HydrophobicContact CE2-CG2 3.75Å; Y18-V31 HydrophobicContact CG-CG2 4.47Å; Y18-P64 HydrophobicContact CD1-CB 3.98Å; Y18-P64 HydrophobicContact CD1-CG 3.54Å; Y18-P64 HydrophobicContact CD2-CG 4.46Å; Y18-P64 HydrophobicContact CE1-CB 4.17Å; Y18-P64 HydrophobicContact CE1-CG 3.38Å; Y18-P64 HydrophobicContact CE2-CG 4.3Å; Y18-P64 HydrophobicContact CG-CG 4.11Å; Y18-L65 HydrophobicContact CE1-CB 4.19Å |
| 19 | I | 96.6 | Very high | 95.6 | Very high | 31 Ų | 31 | 87.5 Ų | 87.5 | 16% | 0.159 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -67.3 | -42 | -178.5 | -64.4 | -65.7 | 0 | 0 | 0 | 110.7 | V15 S16 K22 L23 L65 | V15-I19 HydrophobicContact CB-CB 4.35Å; V15-I19 HydrophobicContact CB-CG2 4.19Å; V15-I19 HydrophobicContact CG1-CG2 4.36Å; V15-I19 HydrophobicContact CG2-CG2 4.48Å; S16-I19 PolarHBondContact O-N 3.39Å; S16-I19 WeakPolarHBondContact OG-CG1 3.35Å; S16-I19 PolarHBondContact OG-N 3.11Å; I19-K22 PolarHBondContact O-N 2.98Å; I19-L23 HydrophobicContact CG2-CD1 3.69Å; I19-L23 HydrophobicContact CG2-CG 4.14Å; I19-L23 WeakPolarHBondContact O-CB 3.41Å; I19-L23 VanDerWaalsContact O-CG 3.24Å; I19-L23 WeakPolarHBondContact O-CG 3.37Å; I19-L23 PolarHBondContact O-N 3.47Å; I19-L65 HydrophobicContact CD1-CB 3.78Å; I19-L65 HydrophobicContact CD1-CD1 4.3Å; I19-L65 HydrophobicContact CD1-CD2 4.4Å; I19-L65 HydrophobicContact CD1-CG 4.38Å |
| 20 | Y | 96.6 | Very high | 95.5 | Very high | 82 Ų | 82 | 89.5 Ų | 89.5 | 32% | 0.322 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -54.2 | -57.3 | 177.2 | -178 | -98.4 | 0 | 0 | 0 | 111.8 | F8 V15 S16 G17 K22 L23 L24 | F8-Y20 HydrophobicContact CD2-CD2 4.3Å; F8-Y20 HydrophobicContact CE1-CD2 4.27Å; F8-Y20 HydrophobicContact CE1-CE2 4.19Å; F8-Y20 AromaticContact CE2-CD2 3.65Å; F8-Y20 HydrophobicContact CE2-CD2 3.65Å; F8-Y20 HydrophobicContact CE2-CE2 4.31Å; F8-Y20 AromaticContact CZ-CD2 3.62Å; F8-Y20 HydrophobicContact CZ-CD2 3.62Å; F8-Y20 AromaticContact CZ-CE2 4Å; F8-Y20 HydrophobicContact CZ-CE2 4Å; F8-Y20 HydrophobicContact CZ-CG 4.42Å; V15-Y20 HydrophobicContact CG2-CD2 4.36Å; S16-Y20 PolarHBondContact O-N 3.01Å; G17-Y20 PolarHBondContact O-N 3.23Å; Y20-K22 PolarHBondContact O-N 3.33Å; Y20-L23 PolarHBondContact O-N 3.44Å; Y20-L24 HydrophobicContact CD1-CD1 4.05Å; Y20-L24 HydrophobicContact CE1-CD1 3.45Å; Y20-L24 VanDerWaalsContact CE1-CD1 3.45Å; Y20-L24 HydrophobicContact CE2-CD1 4.24Å; Y20-L24 WeakPolarHBondContact O-CG 3.38Å; Y20-L24 PolarHBondContact O-N 3.48Å; Y20-L24 VanDerWaalsContact O-N 3.15Å |
| 21 | H | 96.3 | Very high | 95.4 | Very high | 79 Ų | 79 | 87.5 Ų | 87.5 | 37% | 0.366 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -68.4 | -36.4 | -177.8 | -71.9 | -54.6 | 0 | 0 | 0 | 112.9 | G17 L23 L24 G25 H26 V28 | G17-H21 PolarHBondContact O-CD2 2.99Å; G17-H21 VanDerWaalsContact O-CD2 3.23Å; G17-H21 PolarHBondContact O-N 3.32Å; G17-H21 VanDerWaalsContact O-N 3.08Å; H21-L23 VanDerWaalsContact C-N 3.35Å; H21-L23 PolarHBondContact O-N 2.92Å; H21-L24 PolarHBondContact O-N 3.43Å; H21-G25 PolarHBondContact O-N 3.31Å; H21-H26 HydrophobicContact CB-CB 4.14Å; H21-H26 AromaticContact CE1-ND1 3.96Å; H21-H26 AromaticContact CG-ND1 3.98Å; H21-H26 AromaticContact ND1-CE1 3.75Å; H21-H26 AromaticContact ND1-ND1 3.11Å; H21-H26 PolarHBondContact ND1-ND1 3.43Å; H21-H26 VanDerWaalsContact ND1-ND1 3.11Å; H21-H26 PolarHBondContact O-N 3.26Å; H21-V28 HydrophobicContact CB-CG2 3.49Å; H21-V28 VanDerWaalsContact CB-CG2 3.49Å |
| 22 | K | 96.3 | Very high | 95.4 | Very high | 76 Ų | 76 | 90.1 Ų | 90.1 | 33% | 0.33 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -65.6 | -38.1 | 177.3 | -158 | 69.6 | 166.7 | -170.9 | 0 | 111.8 | Y18 I19 Y20 G25 V28 D30 L65 | Y18-K22 HydrophobicContact CE1-CB 4.43Å; Y18-K22 HydrophobicContact CE1-CG 4.45Å; Y18-K22 VanDerWaalsContact O-CB 3.22Å; Y18-K22 WeakPolarHBondContact O-CB 3.36Å; Y18-K22 PolarHBondContact O-N 3.2Å; I19-K22 PolarHBondContact O-N 2.98Å; Y20-K22 PolarHBondContact O-N 3.33Å; K22-G25 PolarHBondContact O-N 2.76Å; K22-V28 HydrophobicContact CD-CB 4.34Å; K22-V28 HydrophobicContact CD-CG2 4.42Å; K22-D30 IonicContact NZ-OD1 3.79Å; K22-L65 HydrophobicContact CG-CD2 4.06Å |
| 23 | L | 96 | Very high | 95.5 | Very high | 107 Ų | 107 | 84.3 Ų | 84.3 | 56% | 0.56 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -70.1 | -30.3 | 175.9 | -71.8 | 177.2 | 0 | 0 | 0 | 113 | F8 I19 Y20 H21 G25 | F8-L23 HydrophobicContact CE2-CD1 4.03Å; F8-L23 HydrophobicContact CZ-CB 4.19Å; F8-L23 HydrophobicContact CZ-CD1 4.25Å; I19-L23 HydrophobicContact CG2-CD1 3.69Å; I19-L23 HydrophobicContact CG2-CG 4.14Å; I19-L23 WeakPolarHBondContact O-CB 3.41Å; I19-L23 VanDerWaalsContact O-CG 3.24Å; I19-L23 WeakPolarHBondContact O-CG 3.37Å; I19-L23 PolarHBondContact O-N 3.47Å; Y20-L23 PolarHBondContact O-N 3.44Å; H21-L23 VanDerWaalsContact C-N 3.35Å; H21-L23 PolarHBondContact O-N 2.92Å; L23-G25 PolarHBondContact O-N 2.87Å |
| 24 | L | 96.4 | Very high | 95.4 | Very high | 80 Ų | 80 | 88.1 Ų | 88.1 | 42% | 0.419 | 47% | 0.469 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.5 | -2 | 174.2 | -66.6 | -176.8 | 0 | 0 | 0 | 114 | F8 Y20 H21 H26 | F8-L24 HydrophobicContact CE1-CD2 4.13Å; Y20-L24 HydrophobicContact CD1-CD1 4.05Å; Y20-L24 HydrophobicContact CE1-CD1 3.45Å; Y20-L24 VanDerWaalsContact CE1-CD1 3.45Å; Y20-L24 HydrophobicContact CE2-CD1 4.24Å; Y20-L24 WeakPolarHBondContact O-CG 3.38Å; Y20-L24 PolarHBondContact O-N 3.48Å; Y20-L24 VanDerWaalsContact O-N 3.15Å; H21-L24 PolarHBondContact O-N 3.43Å; L24-H26 VanDerWaalsContact C-N 3.32Å |
| 25 | G | 97.1 | Very high | 95.1 | Very high | 67 Ų | 67 | 87.5 Ų | 87.5 | 69% | 0.691 | 46% | 0.464 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 77.2 | 15.5 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | H21 K22 L23 | H21-G25 PolarHBondContact O-N 3.31Å; K22-G25 PolarHBondContact O-N 2.76Å; L23-G25 PolarHBondContact O-N 2.87Å |
| 26 | H | 97.6 | Very high | 94.9 | Very high | 97 Ų | 97 | 93.8 Ų | 93.8 | 45% | 0.449 | 49% | 0.49 | S | S | . | . | trans | -71 | 151.9 | 171.9 | -61.1 | -176.9 | 0 | 0 | 0 | 110 | H21 L24 V28 | H21-H26 HydrophobicContact CB-CB 4.14Å; H21-H26 AromaticContact CE1-ND1 3.96Å; H21-H26 AromaticContact CG-ND1 3.98Å; H21-H26 AromaticContact ND1-CE1 3.75Å; H21-H26 AromaticContact ND1-ND1 3.11Å; H21-H26 PolarHBondContact ND1-ND1 3.43Å; H21-H26 VanDerWaalsContact ND1-ND1 3.11Å; H21-H26 PolarHBondContact O-N 3.26Å; L24-H26 VanDerWaalsContact C-N 3.32Å; H26-V28 PolarHBondContact O-N 2.88Å | ||
| 27 | E | 96.3 | Very high | 94.8 | Very high | 202 Ų | 202 | 93.5 Ų | 93.5 | 94% | 0.944 | 48% | 0.483 | S | S | * | . | trans | -69.5 | 123.7 | 168.6 | -68.3 | -168 | 166.9 | 0 | 0 | 109.6 | ||||
| 28 | V | 96.1 | Very high | 94.7 | Very high | 38 Ų | 38 | 93 Ų | 93 | 23% | 0.23 | 47% | 0.471 | C | S | . | . | trans | -133.5 | 132.2 | 178.8 | -169.5 | 0 | 0 | 0 | 0 | 107.3 | Y18 H21 K22 H26 | Y18-V28 HydrophobicContact CD2-CG1 3.56Å; Y18-V28 HydrophobicContact CE2-CB 4.47Å; Y18-V28 HydrophobicContact CE2-CG1 3.82Å; Y18-V28 HydrophobicContact CG-CG1 4.43Å; H21-V28 HydrophobicContact CB-CG2 3.49Å; H21-V28 VanDerWaalsContact CB-CG2 3.49Å; K22-V28 HydrophobicContact CD-CB 4.34Å; K22-V28 HydrophobicContact CD-CG2 4.42Å; H26-V28 PolarHBondContact O-N 2.88Å | ||
| 29 | E | 94.8 | Very high | 94.4 | Very high | 177 Ų | 177 | 101.6 Ų | 101.6 | 83% | 0.827 | 51% | 0.51 | S | S | * | . | P | Polyproline II helix | trans | -58.6 | 138.9 | 175.6 | -65.5 | -174.2 | 172.5 | 0 | 0 | 111.2 | Y18 V31 | Y18-E29 VanDerWaalsContact CE2-O 3.32Å; Y18-E29 WeakPolarHBondContact CE2-O 3.48Å; E29-V31 PolarHBondContact O-N 3.47Å |
| 30 | D | 91.1 | Very high | 94.3 | Very high | 112 Ų | 112 | 109.6 Ų | 109.6 | 60% | 0.599 | 54% | 0.538 | S | S | * | . | P | Polyproline II helix | trans | -68.3 | 122.4 | 179.3 | -81.1 | -19.2 | 0 | 0 | 0 | 111.3 | K22 | K22-D30 IonicContact NZ-OD1 3.79Š|
| 31 | V | 93.6 | Very high | 94.2 | Very high | 68 Ų | 68 | 107.2 Ų | 107.2 | 41% | 0.412 | 53% | 0.529 | S | S | . | . | P | Polyproline II helix | trans | -94.3 | 131.4 | 179.2 | 177.6 | 0 | 0 | 0 | 0 | 110 | Y18 E29 P64 | Y18-V31 HydrophobicContact CD2-CB 4.22Å; Y18-V31 HydrophobicContact CD2-CG2 3.54Å; Y18-V31 HydrophobicContact CE2-CB 4.14Å; Y18-V31 HydrophobicContact CE2-CG2 3.75Å; Y18-V31 HydrophobicContact CG-CG2 4.47Å; E29-V31 PolarHBondContact O-N 3.47Å; V31-P64 HydrophobicContact CB-CG 4.2Å; V31-P64 WeakPolarHBondContact O-CD 3.44Å |
| 32 | I | 94.6 | Very high | 94.1 | Very high | 122 Ų | 122 | 106.4 Ų | 106.4 | 63% | 0.626 | 53% | 0.53 | S | S | * | . | trans | -106 | 117.1 | 169.9 | -59.2 | 178.6 | 0 | 0 | 0 | 108.9 | K34 Q62 | I32-K34 PolarHBondContact O-N 3.44Å; I32-Q62 CarbonylContact C-O 3.59Å; I32-Q62 WeakPolarHBondContact CA-O 3.34Å; I32-Q62 HydrophobicContact CG2-CB 4.36Å | ||
| 33 | I | 93.1 | Very high | 94.1 | Very high | 71 Ų | 71 | 103.2 Ų | 103.2 | 36% | 0.364 | 52% | 0.518 | S | S | . | . | trans | -74.8 | 120.8 | 173 | -57.8 | 173.3 | 0 | 0 | 0 | 108.1 | C35 Q62 P64 | I33-C35 PolarHBondContact O-N 2.87Å; I33-Q62 PolarHBondContact N-O 3.32Å; I33-P64 HydrophobicContact CD1-CB 4.28Å | ||
| 34 | K | 92.4 | Very high | 94 | Very high | 201 Ų | 201 | 106.3 Ų | 106.3 | 87% | 0.874 | 53% | 0.529 | S | S | * | . | trans | -74.4 | 114.1 | 172.9 | -66.6 | -178 | -178 | 176.5 | 0 | 108.6 | I32 | I32-K34 PolarHBondContact O-N 3.44Š| ||
| 35 | C | 90.3 | Very high | 94 | Very high | 29 Ų | 29 | 106.4 Ų | 106.4 | 20% | 0.196 | 55% | 0.55 | C | S | . | . | trans | -139.3 | 158.1 | 174.6 | 68.6 | 0 | 0 | 0 | 0 | 110.3 | I33 L37 L61 | I33-C35 PolarHBondContact O-N 2.87Å; C35-L37 PolarHBondContact O-N 3.25Å; C35-L61 PolarHBondContact SG-O 2.67Å | ||
| 36 | Q | 91.5 | Very high | 94 | Very high | 183 Ų | 183 | 106.1 Ų | 106.1 | 86% | 0.855 | 53% | 0.532 | S | S | * | . | trans | -78.9 | 109.4 | 168.9 | -69 | -171.4 | -8 | 0 | 0 | 108.9 | Q90 | Q36-Q90 PolarHBondContact O-NE2 3.28Š| ||
| 37 | L | 93.4 | Very high | 93.9 | Very high | 60 Ų | 60 | 105.5 Ų | 105.5 | 31% | 0.314 | 54% | 0.536 | S | S | . | . | trans | -69.8 | 140.4 | 176.1 | -69.7 | 176.8 | 0 | 0 | 0 | 110.7 | C35 F41 K58 L61 Q62 | C35-L37 PolarHBondContact O-N 3.25Å; L37-F41 HydrophobicContact CB-CZ 4.41Å; L37-F41 HydrophobicContact CD2-CE1 4.42Å; L37-F41 HydrophobicContact CD2-CZ 4.45Å; L37-K58 HydrophobicContact CD1-CD 4.41Å; L37-K58 HydrophobicContact CD1-CG 4Å; L37-K58 HydrophobicContact CD2-CG 4.45Å; L37-L61 HydrophobicContact CD2-CB 4.09Å; L37-L61 HydrophobicContact CD2-CD1 4.18Å; L37-Q62 HydrophobicContact CD2-CG 3.98Å | ||
| 38 | P | 92.4 | Very high | 93.9 | Very high | 34 Ų | 34 | 102.3 Ų | 102.3 | 22% | 0.221 | 53% | 0.526 | C | S | . | . | trans | -68.3 | 148.7 | 176.9 | 31.9 | -36.7 | 0 | 0 | 0 | 110.5 | R40 F41 L61 | P38-R40 WeakPolarHBondContact CB-O 3.36Å; P38-R40 PolarHBondContact O-N 3.33Å; P38-F41 HydrophobicContact CG-CD1 3.66Å; P38-F41 HydrophobicContact CG-CE1 3.59Å; P38-F41 HydrophobicContact CG-CG 4.31Å; P38-F41 HydrophobicContact CG-CZ 4.15Å; P38-L61 HydrophobicContact CG-CD1 4.38Å | ||
| 39 | K | 91.2 | Very high | 94 | Very high | 217 Ų | 217 | 101.6 Ų | 101.6 | 94% | 0.943 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -66.6 | -26.5 | 174.5 | -65.6 | -176.4 | 180 | -180 | 0 | 112.6 | ||
| 40 | R | 92.8 | Very high | 94.1 | Very high | 200 Ų | 200 | 97 Ų | 97 | 76% | 0.755 | 50% | 0.502 | S | S | * | . | trans | -134.1 | 132.5 | 177 | -64.7 | -175.4 | -178.3 | -177 | 0.2 | 109 | P38 T42 H86 | P38-R40 WeakPolarHBondContact CB-O 3.36Å; P38-R40 PolarHBondContact O-N 3.33Å; R40-T42 PolarHBondContact O-N 2.78Å; R40-H86 PolarHBondContact O-CE1 2.78Å | ||
| 41 | F | 95.3 | Very high | 94.4 | Very high | 32 Ų | 32 | 99.5 Ų | 99.5 | 14% | 0.14 | 51% | 0.509 | C | S | . | . | trans | -93 | 38.4 | 179.6 | -65.5 | -85.7 | 0 | 0 | 0 | 111.7 | L37 P38 L49 V54 V57 K58 L61 T82 H86 | L37-F41 HydrophobicContact CB-CZ 4.41Å; L37-F41 HydrophobicContact CD2-CE1 4.42Å; L37-F41 HydrophobicContact CD2-CZ 4.45Å; P38-F41 HydrophobicContact CG-CD1 3.66Å; P38-F41 HydrophobicContact CG-CE1 3.59Å; P38-F41 HydrophobicContact CG-CG 4.31Å; P38-F41 HydrophobicContact CG-CZ 4.15Å; F41-L49 WeakPolarHBondContact O-CD1 3.36Å; F41-V54 HydrophobicContact CB-CG1 4.25Å; F41-V54 HydrophobicContact CB-CG2 4.41Å; F41-V54 HydrophobicContact CD2-CG1 3.7Å; F41-V54 HydrophobicContact CE2-CG1 4.34Å; F41-V54 HydrophobicContact CG-CG1 4.11Å; F41-V57 HydrophobicContact CD1-CB 4.13Å; F41-V57 HydrophobicContact CD1-CG1 3.63Å; F41-V57 HydrophobicContact CE1-CG1 4.35Å; F41-K58 HydrophobicContact CE1-CB 3.98Å; F41-K58 HydrophobicContact CE1-CG 4.47Å; F41-K58 HydrophobicContact CZ-CB 3.89Å; F41-K58 HydrophobicContact CZ-CD 4.49Å; F41-K58 HydrophobicContact CZ-CG 4.04Å; F41-L61 HydrophobicContact CD1-CD1 4.47Å; F41-L61 HydrophobicContact CE1-CD1 4.05Å; F41-T82 WeakPolarHBondContact O-CG2 3.32Å; F41-H86 WeakPolarHBondContact CA-NE2 3.24Å | ||
| 42 | T | 94.4 | Very high | 94.6 | Very high | 62 Ų | 62 | 100 Ų | 100 | 38% | 0.38 | 52% | 0.516 | S | S | . | . | trans | -102.5 | 149.5 | 177.4 | 58.2 | 0 | 0 | 0 | 0 | 110.2 | R40 | R40-T42 PolarHBondContact O-N 2.78Š| ||
| 43 | A | 96 | Very high | 94.8 | Very high | 9 Ų | 9 | 95.2 Ų | 95.2 | 7% | 0.074 | 49% | 0.491 | C | S | . | . | trans | -119.4 | 139.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | G45 L46 T82 Y85 | A43-G45 PolarHBondContact O-N 3.35Å; A43-L46 HydrophobicContact CB-CB 4.26Å; A43-L46 HydrophobicContact CB-CD1 3.84Å; A43-L46 HydrophobicContact CB-CG 4.21Å; A43-L46 PolarHBondContact O-N 3.32Å; A43-T82 HydrophobicContact CB-CG2 4.05Å; A43-Y85 HydrophobicContact CB-CD1 3.54Å; A43-Y85 HydrophobicContact CB-CD2 4.21Å; A43-Y85 HydrophobicContact CB-CE1 4.1Å; A43-Y85 HydrophobicContact CB-CG 3.6Å | ||
| 44 | Q | 94.4 | Very high | 95 | Very high | 171 Ų | 171 | 93.9 Ų | 93.9 | 80% | 0.799 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.9 | 129.5 | -178.2 | -175 | 177.7 | 5.4 | 0 | 0 | 110.5 | L46 | Q44-L46 VanDerWaalsContact C-N 3.29Å; Q44-L46 PolarHBondContact O-N 3.28Å |
| 45 | G | 95.6 | Very high | 95.3 | Very high | 82 Ų | 82 | 91.4 Ų | 91.4 | 85% | 0.845 | 47% | 0.472 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79 | 4.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | A43 | A43-G45 PolarHBondContact O-N 3.35Š|
| 46 | L | 96.9 | Very high | 95.7 | Very high | 62 Ų | 62 | 90.9 Ų | 90.9 | 33% | 0.325 | 47% | 0.47 | S | S | . | . | S | Bend | trans | -109.9 | 153.2 | 174.2 | -63.5 | -173.2 | 0 | 0 | 0 | 111.8 | A43 Q44 A81 | A43-L46 HydrophobicContact CB-CB 4.26Å; A43-L46 HydrophobicContact CB-CD1 3.84Å; A43-L46 HydrophobicContact CB-CG 4.21Å; A43-L46 PolarHBondContact O-N 3.32Å; Q44-L46 VanDerWaalsContact C-N 3.29Å; Q44-L46 PolarHBondContact O-N 3.28Å; L46-A81 HydrophobicContact CD1-CB 3.53Å |
| 47 | P | 96.7 | Very high | 95.9 | Very high | 83 Ų | 83 | 82.2 Ų | 82.2 | 54% | 0.539 | 43% | 0.43 | S | S | . | . | P | Polyproline II helix | trans | -59 | 155.3 | 173.6 | -22.6 | 33.1 | 0 | 0 | 0 | 112.7 | V78 | P47-V78 HydrophobicContact CG-CG1 4.47Š|
| 48 | D | 96.4 | Very high | 96.1 | Very high | 135 Ų | 135 | 83.9 Ų | 83.9 | 72% | 0.722 | 44% | 0.435 | S | S | * | . | P | Polyproline II helix | trans | -62.3 | 143.6 | 171.3 | -75.9 | -33.3 | 0 | 0 | 0 | 111.3 | ||
| 49 | L | 97.8 | Very high | 96.3 | Very high | 24 Ų | 24 | 83.5 Ų | 83.5 | 13% | 0.126 | 43% | 0.432 | C | S | . | . | P | Polyproline II helix | trans | -89.3 | 140.9 | -179.5 | -59.9 | -170 | 0 | 0 | 0 | 110.8 | F41 Q53 V54 V57 V78 T82 | F41-L49 WeakPolarHBondContact O-CD1 3.36Å; L49-Q53 HydrophobicContact CB-CB 3.94Å; L49-Q53 HydrophobicContact CD1-CB 4.31Å; L49-Q53 HydrophobicContact CD2-CB 4.18Å; L49-Q53 HydrophobicContact CG-CB 4.38Å; L49-V54 HydrophobicContact CB-CG2 3.67Å; L49-V54 HydrophobicContact CD1-CG2 4.44Å; L49-V57 HydrophobicContact CD1-CG2 3.55Å; L49-V78 HydrophobicContact CD2-CG1 3.87Å; L49-T82 HydrophobicContact CD1-CG2 3.86Å |
| 50 | N | 97.3 | Very high | 96.6 | Very high | 80 Ų | 80 | 74.6 Ų | 74.6 | 43% | 0.428 | 40% | 0.395 | S | S | . | . | trans | -78.3 | 176.3 | 167.6 | 70.8 | 35.5 | 0 | 0 | 0 | 111.4 | S52 Q53 V54 | N50-S52 PolarHBondContact O-N 3.15Å; N50-S52 PolarHBondContact OD1-N 3.45Å; N50-S52 VanDerWaalsContact OD1-N 3.11Å; N50-S52 PolarHBondContact OD1-OG 3.04Å; N50-Q53 PolarHBondContact O-N 3.1Å; N50-Q53 VanDerWaalsContact OD1-CG 3.31Å; N50-Q53 WeakPolarHBondContact OD1-CG 3.41Å; N50-Q53 PolarHBondContact OD1-N 3.29Å; N50-V54 WeakPolarHBondContact O-CG2 3.38Å; N50-V54 PolarHBondContact O-N 2.92Å | ||
| 51 | H | 97.4 | Very high | 96.7 | Very high | 164 Ų | 164 | 65.3 Ų | 65.3 | 76% | 0.759 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -57.9 | -43.1 | -175.6 | -172.1 | 78.3 | 0 | 0 | 0 | 114 | V54 Y55 | H51-V54 PolarHBondContact O-N 3.32Å; H51-Y55 WeakPolarHBondContact O-CB 3.42Å; H51-Y55 PolarHBondContact O-N 3.41Å |
| 52 | S | 97.8 | Very high | 96.7 | Very high | 78 Ų | 78 | 66.2 Ų | 66.2 | 55% | 0.545 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -70.7 | -34.9 | -178.2 | 61.6 | 0 | 0 | 0 | 0 | 112.1 | N50 Y55 A56 | N50-S52 PolarHBondContact O-N 3.15Å; N50-S52 PolarHBondContact OD1-N 3.45Å; N50-S52 VanDerWaalsContact OD1-N 3.11Å; N50-S52 PolarHBondContact OD1-OG 3.04Å; S52-Y55 PolarHBondContact O-N 3.14Å; S52-A56 PolarHBondContact O-N 3.01Å |
| 53 | Q | 98.3 | Very high | 96.8 | Very high | 23 Ų | 23 | 69 Ų | 69 | 11% | 0.107 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -69.1 | -43.7 | 174.6 | -64.8 | 167.9 | -19.3 | 0 | 0 | 111.2 | L49 N50 Y55 A56 V57 T74 T79 | L49-Q53 HydrophobicContact CB-CB 3.94Å; L49-Q53 HydrophobicContact CD1-CB 4.31Å; L49-Q53 HydrophobicContact CD2-CB 4.18Å; L49-Q53 HydrophobicContact CG-CB 4.38Å; N50-Q53 PolarHBondContact O-N 3.1Å; N50-Q53 VanDerWaalsContact OD1-CG 3.31Å; N50-Q53 WeakPolarHBondContact OD1-CG 3.41Å; N50-Q53 PolarHBondContact OD1-N 3.29Å; Q53-Y55 VanDerWaalsContact C-N 3.3Å; Q53-Y55 PolarHBondContact O-N 2.97Å; Q53-A56 WeakPolarHBondContact O-CB 3.43Å; Q53-A56 PolarHBondContact O-N 3.34Å; Q53-A56 VanDerWaalsContact O-N 3.14Å; Q53-V57 WeakPolarHBondContact O-CG2 3.48Å; Q53-V57 PolarHBondContact O-N 2.94Å; Q53-T74 PolarHBondContact NE2-O 3.34Å; Q53-T79 HydrophobicContact CB-CG2 4.36Å; Q53-T79 WeakPolarHBondContact CG-OG1 3.29Å |
| 54 | V | 97.9 | Very high | 96.7 | Very high | 43 Ų | 43 | 70.8 Ų | 70.8 | 26% | 0.261 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.3 | -43.8 | 173.3 | 171.2 | 0 | 0 | 0 | 0 | 111 | F41 L49 N50 H51 A56 V57 K58 | F41-V54 HydrophobicContact CB-CG1 4.25Å; F41-V54 HydrophobicContact CB-CG2 4.41Å; F41-V54 HydrophobicContact CD2-CG1 3.7Å; F41-V54 HydrophobicContact CE2-CG1 4.34Å; F41-V54 HydrophobicContact CG-CG1 4.11Å; L49-V54 HydrophobicContact CB-CG2 3.67Å; L49-V54 HydrophobicContact CD1-CG2 4.44Å; N50-V54 WeakPolarHBondContact O-CG2 3.38Å; N50-V54 PolarHBondContact O-N 2.92Å; H51-V54 PolarHBondContact O-N 3.32Å; V54-A56 VanDerWaalsContact C-N 3.33Å; V54-A56 PolarHBondContact O-N 2.8Å; V54-V57 PolarHBondContact O-N 3.47Å; V54-K58 WeakPolarHBondContact O-CB 3.12Å; V54-K58 PolarHBondContact O-N 3.46Å |
| 55 | Y | 97.4 | Very high | 96.8 | Very high | 148 Ų | 148 | 66.5 Ų | 66.5 | 58% | 0.58 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -60.9 | -42 | 175.6 | 178.6 | -98.3 | 0 | 0 | 0 | 112 | H51 S52 Q53 K58 T59 | H51-Y55 WeakPolarHBondContact O-CB 3.42Å; H51-Y55 PolarHBondContact O-N 3.41Å; S52-Y55 PolarHBondContact O-N 3.14Å; Q53-Y55 VanDerWaalsContact C-N 3.3Å; Q53-Y55 PolarHBondContact O-N 2.97Å; Y55-K58 PolarHBondContact O-N 2.95Å; Y55-T59 WeakPolarHBondContact O-CB 3.42Å; Y55-T59 PolarHBondContact O-N 2.91Å; Y55-T59 PolarHBondContact O-OG1 3.01Å |
| 56 | A | 98 | Very high | 96.9 | Very high | 19 Ų | 19 | 64.7 Ų | 64.7 | 16% | 0.157 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.6 | -48.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | S52 Q53 V54 K58 T59 V60 T79 | S52-A56 PolarHBondContact O-N 3.01Å; Q53-A56 WeakPolarHBondContact O-CB 3.43Å; Q53-A56 PolarHBondContact O-N 3.34Å; Q53-A56 VanDerWaalsContact O-N 3.14Å; V54-A56 VanDerWaalsContact C-N 3.33Å; V54-A56 PolarHBondContact O-N 2.8Å; A56-K58 PolarHBondContact O-N 3.44Å; A56-T59 PolarHBondContact O-N 2.79Å; A56-V60 WeakPolarHBondContact O-CB 3.36Å; A56-V60 WeakPolarHBondContact O-CG2 3.31Å; A56-V60 PolarHBondContact O-N 3.26Å; A56-T79 HydrophobicContact CB-CG2 3.94Å |
| 57 | V | 97.4 | Very high | 96.9 | Very high | 0 Ų | 0 | 69.5 Ų | 69.5 | 0% | 0 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -58.5 | -50.4 | 176.7 | -178.8 | 0 | 0 | 0 | 0 | 110.6 | F41 L49 Q53 V54 T59 V60 L61 T79 T82 I83 | F41-V57 HydrophobicContact CD1-CB 4.13Å; F41-V57 HydrophobicContact CD1-CG1 3.63Å; F41-V57 HydrophobicContact CE1-CG1 4.35Å; L49-V57 HydrophobicContact CD1-CG2 3.55Å; Q53-V57 WeakPolarHBondContact O-CG2 3.48Å; Q53-V57 PolarHBondContact O-N 2.94Å; V54-V57 PolarHBondContact O-N 3.47Å; V57-T59 VanDerWaalsContact C-N 3.3Å; V57-T59 PolarHBondContact O-N 2.97Å; V57-V60 PolarHBondContact O-N 3.11Å; V57-L61 HydrophobicContact CG1-CD1 4.17Å; V57-L61 HydrophobicContact CG1-CG 4.42Å; V57-L61 WeakPolarHBondContact O-CG 3.44Å; V57-L61 PolarHBondContact O-N 3.33Å; V57-L61 VanDerWaalsContact O-N 3.1Å; V57-T79 HydrophobicContact CG2-CG2 4.01Å; V57-T82 HydrophobicContact CG1-CG2 4.41Å; V57-T82 HydrophobicContact CG2-CG2 4.1Å; V57-I83 HydrophobicContact CB-CG1 4.24Å; V57-I83 HydrophobicContact CG1-CG1 4.13Å; V57-I83 HydrophobicContact CG2-CG1 4.03Å |
| 58 | K | 96.6 | Very high | 96.9 | Very high | 96 Ų | 96 | 68.3 Ų | 68.3 | 42% | 0.417 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -56.6 | -45.2 | 179.7 | -178.1 | -178.4 | 176.6 | -175.1 | 0 | 111.9 | L37 F41 V54 Y55 A56 | L37-K58 HydrophobicContact CD1-CD 4.41Å; L37-K58 HydrophobicContact CD1-CG 4Å; L37-K58 HydrophobicContact CD2-CG 4.45Å; F41-K58 HydrophobicContact CE1-CB 3.98Å; F41-K58 HydrophobicContact CE1-CG 4.47Å; F41-K58 HydrophobicContact CZ-CB 3.89Å; F41-K58 HydrophobicContact CZ-CD 4.49Å; F41-K58 HydrophobicContact CZ-CG 4.04Å; V54-K58 WeakPolarHBondContact O-CB 3.12Å; V54-K58 PolarHBondContact O-N 3.46Å; Y55-K58 PolarHBondContact O-N 2.95Å; A56-K58 PolarHBondContact O-N 3.44Å |
| 59 | T | 96.6 | Very high | 96.9 | Very high | 26 Ų | 26 | 69.9 Ų | 69.9 | 16% | 0.16 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65.5 | -44.4 | -178.7 | -59.3 | 0 | 0 | 0 | 0 | 111.4 | Y55 A56 V57 L61 Q62 R63 | Y55-T59 WeakPolarHBondContact O-CB 3.42Å; Y55-T59 PolarHBondContact O-N 2.91Å; Y55-T59 PolarHBondContact O-OG1 3.01Å; A56-T59 PolarHBondContact O-N 2.79Å; V57-T59 VanDerWaalsContact C-N 3.3Å; V57-T59 PolarHBondContact O-N 2.97Å; T59-L61 VanDerWaalsContact C-N 3.35Å; T59-L61 PolarHBondContact O-N 2.91Å; T59-Q62 PolarHBondContact O-N 2.9Å; T59-Q62 VanDerWaalsContact O-N 3.15Å; T59-R63 HydrophobicContact CG2-CG 4.38Å; T59-R63 PolarHBondContact O-N 2.76Å |
| 60 | V | 96.9 | Very high | 96.8 | Very high | 29 Ų | 29 | 69.6 Ų | 69.6 | 18% | 0.176 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -65.8 | -38 | -177.6 | 174.7 | 0 | 0 | 0 | 0 | 111.7 | A56 V57 Q62 R63 I68 I83 | A56-V60 WeakPolarHBondContact O-CB 3.36Å; A56-V60 WeakPolarHBondContact O-CG2 3.31Å; A56-V60 PolarHBondContact O-N 3.26Å; V57-V60 PolarHBondContact O-N 3.11Å; V60-Q62 PolarHBondContact O-N 3.13Å; V60-R63 PolarHBondContact O-N 3.11Å; V60-I68 HydrophobicContact CG2-CD1 3.98Å; V60-I68 HydrophobicContact CG2-CG1 4.26Å; V60-I83 HydrophobicContact CB-CD1 3.94Å; V60-I83 HydrophobicContact CB-CG1 4.22Å; V60-I83 HydrophobicContact CB-CG2 4.4Å; V60-I83 HydrophobicContact CG1-CD1 4.02Å; V60-I83 HydrophobicContact CG1-CG1 4.25Å; V60-I83 HydrophobicContact CG1-CG2 3.58Å; V60-I83 HydrophobicContact CG2-CD1 3.77Å |
| 61 | L | 95.7 | Very high | 96.8 | Very high | 5 Ų | 5 | 70 Ų | 70 | 3% | 0.026 | 36% | 0.362 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.2 | -13.4 | 177.3 | -67.9 | 178.6 | 0 | 0 | 0 | 113.8 | C35 L37 P38 F41 V57 T59 H86 L87 | C35-L61 PolarHBondContact SG-O 2.67Å; L37-L61 HydrophobicContact CD2-CB 4.09Å; L37-L61 HydrophobicContact CD2-CD1 4.18Å; P38-L61 HydrophobicContact CG-CD1 4.38Å; F41-L61 HydrophobicContact CD1-CD1 4.47Å; F41-L61 HydrophobicContact CE1-CD1 4.05Å; V57-L61 HydrophobicContact CG1-CD1 4.17Å; V57-L61 HydrophobicContact CG1-CG 4.42Å; V57-L61 WeakPolarHBondContact O-CG 3.44Å; V57-L61 PolarHBondContact O-N 3.33Å; V57-L61 VanDerWaalsContact O-N 3.1Å; T59-L61 VanDerWaalsContact C-N 3.35Å; T59-L61 PolarHBondContact O-N 2.91Å; L61-H86 HydrophobicContact CD1-CB 4.06Å; L61-H86 HydrophobicContact CD2-CB 3.96Å; L61-L87 HydrophobicContact CD2-CD2 3.56Å; L61-L87 HydrophobicContact CD2-CG 3.74Å |
| 62 | Q | 95.8 | Very high | 96.8 | Very high | 52 Ų | 52 | 68.2 Ų | 68.2 | 24% | 0.243 | 37% | 0.365 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -118 | 1.5 | -176.1 | -58.1 | -170.5 | -83.2 | 0 | 0 | 113.4 | I32 I33 L37 T59 V60 | I32-Q62 CarbonylContact C-O 3.59Å; I32-Q62 WeakPolarHBondContact CA-O 3.34Å; I32-Q62 HydrophobicContact CG2-CB 4.36Å; I33-Q62 PolarHBondContact N-O 3.32Å; L37-Q62 HydrophobicContact CD2-CG 3.98Å; T59-Q62 PolarHBondContact O-N 2.9Å; T59-Q62 VanDerWaalsContact O-N 3.15Å; V60-Q62 PolarHBondContact O-N 3.13Å |
| 63 | R | 95.7 | Very high | 96.6 | Very high | 120 Ų | 120 | 68.6 Ų | 68.6 | 45% | 0.453 | 38% | 0.382 | S | S | . | . | trans | -126.4 | 136 | -176.3 | -70.4 | -169.8 | 176.9 | -158.3 | -5.9 | 111.4 | T59 V60 L65 | T59-R63 HydrophobicContact CG2-CG 4.38Å; T59-R63 PolarHBondContact O-N 2.76Å; V60-R63 PolarHBondContact O-N 3.11Å; R63-L65 PolarHBondContact O-N 3.19Å | ||
| 64 | P | 94.9 | Very high | 96.6 | Very high | 47 Ų | 47 | 70.3 Ų | 70.3 | 31% | 0.305 | 39% | 0.394 | S | S | . | . | S | Bend | trans | -68 | -24.3 | 177.9 | 28.7 | -36.6 | 0 | 0 | 0 | 113.2 | Y18 V31 I33 | Y18-P64 HydrophobicContact CD1-CB 3.98Å; Y18-P64 HydrophobicContact CD1-CG 3.54Å; Y18-P64 HydrophobicContact CD2-CG 4.46Å; Y18-P64 HydrophobicContact CE1-CB 4.17Å; Y18-P64 HydrophobicContact CE1-CG 3.38Å; Y18-P64 HydrophobicContact CE2-CG 4.3Å; Y18-P64 HydrophobicContact CG-CG 4.11Å; V31-P64 HydrophobicContact CB-CG 4.2Å; V31-P64 WeakPolarHBondContact O-CD 3.44Å; I33-P64 HydrophobicContact CD1-CB 4.28Å |
| 65 | L | 96 | Very high | 96.5 | Very high | 80 Ų | 80 | 69.3 Ų | 69.3 | 42% | 0.419 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -137.8 | 132.9 | 175.2 | -174.9 | 61 | 0 | 0 | 0 | 109.3 | Y18 I19 K22 R63 | Y18-L65 HydrophobicContact CE1-CB 4.19Å; I19-L65 HydrophobicContact CD1-CB 3.78Å; I19-L65 HydrophobicContact CD1-CD1 4.3Å; I19-L65 HydrophobicContact CD1-CD2 4.4Å; I19-L65 HydrophobicContact CD1-CG 4.38Å; K22-L65 HydrophobicContact CG-CD2 4.06Å; R63-L65 PolarHBondContact O-N 3.19Å |
| 66 | S | 96.6 | Very high | 96.5 | Very high | 44 Ų | 44 | 65.7 Ų | 65.7 | 31% | 0.308 | 38% | 0.38 | S | S | . | . | trans | -142 | 142.7 | 177.6 | -70.6 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 67 | L | 96.9 | Very high | 96.5 | Very high | 164 Ų | 164 | 70.5 Ų | 70.5 | 86% | 0.859 | 41% | 0.407 | S | S | * | . | trans | -113.6 | 116.3 | 173.5 | -178.6 | 65.2 | 0 | 0 | 0 | 108.9 | ||||
| 68 | I | 96.8 | Very high | 96.5 | Very high | 57 Ų | 57 | 72.4 Ų | 72.4 | 29% | 0.292 | 42% | 0.419 | S | S | . | . | trans | -101.1 | 121.9 | 174.6 | -57 | 175.8 | 0 | 0 | 0 | 108.3 | V60 T79 I83 | V60-I68 HydrophobicContact CG2-CD1 3.98Å; V60-I68 HydrophobicContact CG2-CG1 4.26Å; I68-T79 HydrophobicContact CD1-CG2 4.43Å; I68-I83 HydrophobicContact CD1-CD1 3.41Å; I68-I83 VanDerWaalsContact CD1-CD1 3.41Å | ||
| 69 | Q | 96.9 | Very high | 96.6 | Very high | 169 Ų | 169 | 68 Ų | 68 | 79% | 0.79 | 40% | 0.4 | S | S | * | . | trans | -133.1 | 147.7 | -176.3 | -170.2 | -99.9 | -12.4 | 0 | 0 | 110.7 | ||||
| 70 | G | 95.4 | Very high | 96.6 | Very high | 18 Ų | 18 | 69.2 Ų | 69.2 | 19% | 0.186 | 41% | 0.41 | C | S | . | . | trans | 174.3 | 159.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K76 | G70-K76 PolarHBondContact O-NZ 3.46Š| ||
| 71 | P | 97.1 | Very high | 96.7 | Very high | 87 Ų | 87 | 69.8 Ų | 69.8 | 57% | 0.565 | 42% | 0.417 | S | S | * | . | trans | -54.2 | 168.6 | 177 | -27.8 | 32.7 | 0 | 0 | 0 | 115.2 | T74 K76 | P71-T74 HydrophobicContact CB-CG2 3.97Å; P71-T74 HydrophobicContact CG-CG2 4.24Å; P71-T74 WeakPolarHBondContact O-CG2 3.47Å; P71-T74 PolarHBondContact O-N 2.94Å; P71-T74 PolarHBondContact O-OG1 3.48Å; P71-K76 PolarHBondContact O-NZ 3.38Å | ||
| 72 | P | 97.3 | Very high | 96.8 | Very high | 127 Ų | 127 | 69.6 Ų | 69.6 | 83% | 0.825 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | 142.2 | 167.7 | -24 | 35.1 | 0 | 0 | 0 | 111.3 | T74 | P72-T74 VanDerWaalsContact C-N 3.33Å; P72-T74 PolarHBondContact O-N 3Å |
| 73 | G | 95.4 | Very high | 96.8 | Very high | 86 Ų | 86 | 67.7 Ų | 67.7 | 89% | 0.887 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 79.7 | -1.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 116.6 | G75 | G73-G75 PolarHBondContact O-N 3.48Å; G73-G75 VanDerWaalsContact O-N 3.14Å |
| 74 | T | 96.6 | Very high | 96.9 | Very high | 59 Ų | 59 | 66.5 Ų | 66.5 | 36% | 0.362 | 41% | 0.414 | S | S | . | . | S | Bend | trans | -81.1 | 14 | -177.3 | 62.3 | 0 | 0 | 0 | 0 | 115.8 | Q53 P71 P72 K76 | Q53-T74 PolarHBondContact NE2-O 3.34Å; P71-T74 HydrophobicContact CB-CG2 3.97Å; P71-T74 HydrophobicContact CG-CG2 4.24Å; P71-T74 WeakPolarHBondContact O-CG2 3.47Å; P71-T74 PolarHBondContact O-N 2.94Å; P71-T74 PolarHBondContact O-OG1 3.48Å; P72-T74 VanDerWaalsContact C-N 3.33Å; P72-T74 PolarHBondContact O-N 3Å; T74-K76 PolarHBondContact O-N 2.96Å |
| 75 | G | 96.9 | Very high | 96.9 | Very high | 23 Ų | 23 | 67.5 Ų | 67.5 | 24% | 0.237 | 41% | 0.412 | C | S | . | . | trans | 72.4 | 25.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | G73 T77 V78 T79 | G73-G75 PolarHBondContact O-N 3.48Å; G73-G75 VanDerWaalsContact O-N 3.14Å; G75-T77 VanDerWaalsContact C-N 3.29Å; G75-T77 PolarHBondContact O-N 3.28Å; G75-V78 PolarHBondContact O-N 3.1Å; G75-T79 WeakPolarHBondContact O-CB 3.49Å; G75-T79 PolarHBondContact O-N 3.29Å; G75-T79 PolarHBondContact O-OG1 3.14Å | ||
| 76 | K | 97.6 | Very high | 96.9 | Very high | 71 Ų | 71 | 64.3 Ų | 64.3 | 31% | 0.309 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -52.8 | -44.6 | 174.9 | -68.1 | -174.2 | -66.6 | -72.7 | 0 | 112.7 | G70 P71 T74 T79 S80 | G70-K76 PolarHBondContact O-NZ 3.46Å; P71-K76 PolarHBondContact O-NZ 3.38Å; T74-K76 PolarHBondContact O-N 2.96Å; K76-T79 PolarHBondContact O-N 2.9Å; K76-S80 WeakPolarHBondContact O-CB 3.33Å; K76-S80 PolarHBondContact O-N 3.37Å; K76-S80 PolarHBondContact O-OG 3.26Å |
| 77 | T | 96.8 | Very high | 96.8 | Very high | 120 Ų | 120 | 65.7 Ų | 65.7 | 74% | 0.736 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -66.1 | -45.2 | 179.1 | -50.7 | 0 | 0 | 0 | 0 | 111.9 | G75 T79 S80 A81 | G75-T77 VanDerWaalsContact C-N 3.29Å; G75-T77 PolarHBondContact O-N 3.28Å; T77-T79 VanDerWaalsContact C-N 3.33Å; T77-T79 PolarHBondContact O-N 2.91Å; T77-S80 PolarHBondContact O-N 3Å; T77-A81 WeakPolarHBondContact O-CB 3.35Å; T77-A81 PolarHBondContact O-N 3.29Å |
| 78 | V | 97.8 | Very high | 96.6 | Very high | 40 Ų | 40 | 61.6 Ų | 61.6 | 24% | 0.242 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -60.3 | -45.7 | 175.9 | 175.7 | 0 | 0 | 0 | 0 | 110.4 | P47 L49 G75 S80 A81 T82 | P47-V78 HydrophobicContact CG-CG1 4.47Å; L49-V78 HydrophobicContact CD2-CG1 3.87Å; G75-V78 PolarHBondContact O-N 3.1Å; V78-S80 VanDerWaalsContact C-N 3.35Å; V78-S80 PolarHBondContact O-N 3.45Å; V78-A81 PolarHBondContact O-N 3.03Å; V78-T82 PolarHBondContact O-N 2.95Å; V78-T82 PolarHBondContact O-OG1 3.11Å; V78-T82 VanDerWaalsContact O-OG1 3.11Å |
| 79 | T | 98.1 | Very high | 96.3 | Very high | 3 Ų | 3 | 67.5 Ų | 67.5 | 2% | 0.018 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -59.7 | -44.9 | 176.8 | -52 | 0 | 0 | 0 | 0 | 111.4 | Q53 A56 V57 I68 G75 K76 T77 T82 I83 | Q53-T79 HydrophobicContact CB-CG2 4.36Å; Q53-T79 WeakPolarHBondContact CG-OG1 3.29Å; A56-T79 HydrophobicContact CB-CG2 3.94Å; V57-T79 HydrophobicContact CG2-CG2 4.01Å; I68-T79 HydrophobicContact CD1-CG2 4.43Å; G75-T79 WeakPolarHBondContact O-CB 3.49Å; G75-T79 PolarHBondContact O-N 3.29Å; G75-T79 PolarHBondContact O-OG1 3.14Å; K76-T79 PolarHBondContact O-N 2.9Å; T77-T79 VanDerWaalsContact C-N 3.33Å; T77-T79 PolarHBondContact O-N 2.91Å; T79-T82 PolarHBondContact O-N 3.47Å; T79-I83 HydrophobicContact CG2-CD1 4.28Å; T79-I83 WeakPolarHBondContact O-CG1 3.2Å; T79-I83 PolarHBondContact O-N 3.08Å |
| 80 | S | 97.7 | Very high | 95.7 | Very high | 52 Ų | 52 | 61.9 Ų | 61.9 | 36% | 0.364 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -66.2 | -40.7 | 179.1 | -56 | 0 | 0 | 0 | 0 | 112.1 | K76 T77 V78 T82 I83 V84 | K76-S80 WeakPolarHBondContact O-CB 3.33Å; K76-S80 PolarHBondContact O-N 3.37Å; K76-S80 PolarHBondContact O-OG 3.26Å; T77-S80 PolarHBondContact O-N 3Å; V78-S80 VanDerWaalsContact C-N 3.35Å; V78-S80 PolarHBondContact O-N 3.45Å; S80-T82 VanDerWaalsContact C-N 3.33Å; S80-T82 PolarHBondContact O-N 2.86Å; S80-I83 WeakPolarHBondContact O-CB 3.45Å; S80-I83 PolarHBondContact O-N 3.23Å; S80-V84 WeakPolarHBondContact O-CG2 3.33Å; S80-V84 PolarHBondContact O-N 3.47Å |
| 81 | A | 97.9 | Very high | 94.2 | Very high | 41 Ų | 41 | 64 Ų | 64 | 34% | 0.339 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -64.2 | -39.1 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | L46 T77 V78 V84 Y85 | L46-A81 HydrophobicContact CD1-CB 3.53Å; T77-A81 WeakPolarHBondContact O-CB 3.35Å; T77-A81 PolarHBondContact O-N 3.29Å; V78-A81 PolarHBondContact O-N 3.03Å; A81-V84 PolarHBondContact O-N 3.36Å; A81-Y85 WeakPolarHBondContact O-CB 3.36Å; A81-Y85 PolarHBondContact O-N 2.94Å |
| 82 | T | 97.8 | Very high | 92.2 | Very high | 1 Ų | 1 | 65.7 Ų | 65.7 | 1% | 0.006 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -65.2 | -37.2 | 173.3 | -58.2 | 0 | 0 | 0 | 0 | 112.6 | F41 A43 L49 V57 V78 T79 S80 Y85 H86 | F41-T82 WeakPolarHBondContact O-CG2 3.32Å; A43-T82 HydrophobicContact CB-CG2 4.05Å; L49-T82 HydrophobicContact CD1-CG2 3.86Å; V57-T82 HydrophobicContact CG1-CG2 4.41Å; V57-T82 HydrophobicContact CG2-CG2 4.1Å; V78-T82 PolarHBondContact O-N 2.95Å; V78-T82 PolarHBondContact O-OG1 3.11Å; V78-T82 VanDerWaalsContact O-OG1 3.11Å; T79-T82 PolarHBondContact O-N 3.47Å; S80-T82 VanDerWaalsContact C-N 3.33Å; S80-T82 PolarHBondContact O-N 2.86Å; T82-Y85 PolarHBondContact O-N 3.49Å; T82-H86 PolarHBondContact O-CD2 3.38Å; T82-H86 PolarHBondContact O-N 3.48Å; T82-H86 VanDerWaalsContact O-N 3.08Å |
| 83 | I | 97.1 | Very high | 89.8 | Confident | 12 Ų | 12 | 66.4 Ų | 66.4 | 6% | 0.062 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -59.5 | -52.8 | 172.9 | -72.7 | 159.1 | 0 | 0 | 0 | 110.6 | V57 V60 I68 T79 S80 Y85 H86 L87 | V57-I83 HydrophobicContact CB-CG1 4.24Å; V57-I83 HydrophobicContact CG1-CG1 4.13Å; V57-I83 HydrophobicContact CG2-CG1 4.03Å; V60-I83 HydrophobicContact CB-CD1 3.94Å; V60-I83 HydrophobicContact CB-CG1 4.22Å; V60-I83 HydrophobicContact CB-CG2 4.4Å; V60-I83 HydrophobicContact CG1-CD1 4.02Å; V60-I83 HydrophobicContact CG1-CG1 4.25Å; V60-I83 HydrophobicContact CG1-CG2 3.58Å; V60-I83 HydrophobicContact CG2-CD1 3.77Å; I68-I83 HydrophobicContact CD1-CD1 3.41Å; I68-I83 VanDerWaalsContact CD1-CD1 3.41Å; T79-I83 HydrophobicContact CG2-CD1 4.28Å; T79-I83 WeakPolarHBondContact O-CG1 3.2Å; T79-I83 PolarHBondContact O-N 3.08Å; S80-I83 WeakPolarHBondContact O-CB 3.45Å; S80-I83 PolarHBondContact O-N 3.23Å; I83-Y85 VanDerWaalsContact C-N 3.3Å; I83-Y85 PolarHBondContact O-N 3.15Å; I83-H86 PolarHBondContact O-N 3.43Å; I83-H86 VanDerWaalsContact O-N 3.15Å; I83-L87 HydrophobicContact CG2-CD1 3.79Å; I83-L87 HydrophobicContact CG2-CG 4.36Å; I83-L87 WeakPolarHBondContact O-CG 3.46Å; I83-L87 PolarHBondContact O-N 3.01Å |
| 84 | V | 96.4 | Very high | 89.5 | Confident | 95 Ų | 95 | 65.4 Ų | 65.4 | 58% | 0.576 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -59.8 | -42.7 | -179.9 | 173.6 | 0 | 0 | 0 | 0 | 110.7 | S80 A81 H86 L87 A88 | S80-V84 WeakPolarHBondContact O-CG2 3.33Å; S80-V84 PolarHBondContact O-N 3.47Å; A81-V84 PolarHBondContact O-N 3.36Å; V84-H86 VanDerWaalsContact C-N 3.33Å; V84-H86 PolarHBondContact O-N 2.84Å; V84-L87 PolarHBondContact O-N 3.23Å; V84-A88 VanDerWaalsContact O-CB 3.31Å; V84-A88 WeakPolarHBondContact O-CB 3.22Å; V84-A88 PolarHBondContact O-N 2.93Å |
| 85 | Y | 96.4 | Very high | 89.1 | Confident | 69 Ų | 69 | 65.7 Ų | 65.7 | 27% | 0.271 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -55.5 | -45.9 | 175.5 | 172.8 | -96.3 | 0 | 0 | 0 | 112.4 | A43 A81 T82 I83 R89 | A43-Y85 HydrophobicContact CB-CD1 3.54Å; A43-Y85 HydrophobicContact CB-CD2 4.21Å; A43-Y85 HydrophobicContact CB-CE1 4.1Å; A43-Y85 HydrophobicContact CB-CG 3.6Å; A81-Y85 WeakPolarHBondContact O-CB 3.36Å; A81-Y85 PolarHBondContact O-N 2.94Å; T82-Y85 PolarHBondContact O-N 3.49Å; I83-Y85 VanDerWaalsContact C-N 3.3Å; I83-Y85 PolarHBondContact O-N 3.15Å; Y85-R89 VanDerWaalsContact O-CG 3.3Å; Y85-R89 WeakPolarHBondContact O-CG 3.27Å; Y85-R89 PolarHBondContact O-N 3.34Å |
| 86 | H | 95.4 | Very high | 88.7 | Confident | 13 Ų | 13 | 68.1 Ų | 68.1 | 6% | 0.06 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -71.3 | -41.8 | 178.9 | -75 | -58.9 | 0 | 0 | 0 | 112.9 | R40 F41 L61 T82 I83 V84 R89 Q90 | R40-H86 PolarHBondContact O-CE1 2.78Å; F41-H86 WeakPolarHBondContact CA-NE2 3.24Å; L61-H86 HydrophobicContact CD1-CB 4.06Å; L61-H86 HydrophobicContact CD2-CB 3.96Å; T82-H86 PolarHBondContact O-CD2 3.38Å; T82-H86 PolarHBondContact O-N 3.48Å; T82-H86 VanDerWaalsContact O-N 3.08Å; I83-H86 PolarHBondContact O-N 3.43Å; I83-H86 VanDerWaalsContact O-N 3.15Å; V84-H86 VanDerWaalsContact C-N 3.33Å; V84-H86 PolarHBondContact O-N 2.84Å; H86-R89 PolarHBondContact O-N 3.05Å; H86-Q90 WeakPolarHBondContact O-CG 3.45Å; H86-Q90 PolarHBondContact O-N 3.31Å |
| 87 | L | 94.1 | Very high | 88.2 | Confident | 73 Ų | 73 | 67.9 Ų | 67.9 | 38% | 0.382 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61 | -46 | 177.4 | -72.3 | 173.7 | 0 | 0 | 0 | 111.7 | L61 I83 V84 R89 Q90 G91 | L61-L87 HydrophobicContact CD2-CD2 3.56Å; L61-L87 HydrophobicContact CD2-CG 3.74Å; I83-L87 HydrophobicContact CG2-CD1 3.79Å; I83-L87 HydrophobicContact CG2-CG 4.36Å; I83-L87 WeakPolarHBondContact O-CG 3.46Å; I83-L87 PolarHBondContact O-N 3.01Å; V84-L87 PolarHBondContact O-N 3.23Å; L87-R89 PolarHBondContact O-N 3.45Å; L87-Q90 PolarHBondContact O-N 3.26Å; L87-Q90 VanDerWaalsContact O-N 3.14Å; L87-G91 PolarHBondContact O-N 3.36Å |
| 88 | A | 93 | Very high | 87.6 | Confident | 78 Ų | 78 | 64.7 Ų | 64.7 | 65% | 0.645 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -60.1 | -34.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | V84 | V84-A88 VanDerWaalsContact O-CB 3.31Å; V84-A88 WeakPolarHBondContact O-CB 3.22Å; V84-A88 PolarHBondContact O-N 2.93Å |
| 89 | R | 90.1 | Very high | 86.9 | Confident | 180 Ų | 180 | 66.3 Ų | 66.3 | 68% | 0.679 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -82.4 | -21.7 | 178.6 | -70.2 | 178.9 | 65.4 | 85.1 | 7.5 | 114.2 | Y85 H86 L87 | Y85-R89 VanDerWaalsContact O-CG 3.3Å; Y85-R89 WeakPolarHBondContact O-CG 3.27Å; Y85-R89 PolarHBondContact O-N 3.34Å; H86-R89 PolarHBondContact O-N 3.05Å; L87-R89 PolarHBondContact O-N 3.45Å |
| 90 | Q | 84.3 | Confident | 86.1 | Confident | 52 Ų | 52 | 70.9 Ų | 70.9 | 24% | 0.243 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -75.1 | -16.5 | 174.7 | -76.1 | 179.1 | 4 | 0 | 0 | 112.1 | Q36 H86 L87 N92 | Q36-Q90 PolarHBondContact O-NE2 3.28Å; H86-Q90 WeakPolarHBondContact O-CG 3.45Å; H86-Q90 PolarHBondContact O-N 3.31Å; L87-Q90 PolarHBondContact O-N 3.26Å; L87-Q90 VanDerWaalsContact O-N 3.14Å; Q90-N92 PolarHBondContact O-N 3.06Å |
| 91 | G | 64.5 | Low | 85.3 | Confident | 62 Ų | 62 | 72.3 Ų | 72.3 | 64% | 0.639 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 70.4 | 15.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | L87 | L87-G91 PolarHBondContact O-N 3.36Š|
| 92 | N | 55.5 | Low | 84.2 | Confident | 122 Ų | 122 | 74.9 Ų | 74.9 | 65% | 0.652 | 47% | 0.473 | S | S | * | . | trans | -99 | 25 | 177.5 | -69.2 | -18.4 | 0 | 0 | 0 | 112.3 | Q90 | Q90-N92 PolarHBondContact O-N 3.06Š| ||
| 93 | G | 45.7 | Very low | 83 | Confident | 142 Ų | 142 | 81.6 Ų | 81.6 | 100% | 1.464 | 52% | 0.516 | S | S | * | . | trans | -86.9 | 0 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 |
Retrieved 93 of 93 residues in 57.2 ms
(Link to these results)