| 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 | 48.6 | Very low | 77.1 | Confident | 218 Ų | 218 | 130.2 Ų | 130.2 | 100% | 1.074 | 63% | 0.627 | S | S | * | * | 0 | 127.1 | 0 | -155.7 | 145.1 | 176.7 | 0 | 0 | 107.3 | |||||
| 2 | P | 55.7 | Low | 78.2 | Confident | 116 Ų | 116 | 126.3 Ų | 126.3 | 75% | 0.753 | 61% | 0.613 | S | S | * | * | trans | -55.8 | 143.3 | 178.2 | -17.3 | 29.9 | 0 | 0 | 0 | 109.1 | E4 | P2-E4 PolarHBondContact O-N 2.95Š| ||
| 3 | R | 60.8 | Low | 79.1 | Confident | 247 Ų | 247 | 118.6 Ų | 118.6 | 93% | 0.932 | 57% | 0.573 | S | S | * | * | trans | -60.8 | 107.9 | 169.9 | -105.5 | 177 | 163.6 | 164.1 | -4 | 106.8 | ||||
| 4 | E | 74.4 | Confident | 79.8 | Confident | 100 Ų | 100 | 113.4 Ų | 113.4 | 47% | 0.467 | 55% | 0.546 | S | S | . | . | trans | -53.3 | 144.4 | 169.7 | -75.6 | 178.9 | 163.9 | 0 | 0 | 109.7 | P2 R6 W9 | P2-E4 PolarHBondContact O-N 2.95Å; E4-R6 PolarHBondContact O-N 2.94Å; E4-W9 HydrophobicContact CB-CB 4.37Å | ||
| 5 | D | 87.1 | Confident | 80.5 | Confident | 125 Ų | 125 | 114.2 Ų | 114.2 | 67% | 0.668 | 55% | 0.551 | S | S | * | * | trans | -55.8 | 138.4 | 173.7 | -76.1 | -37.2 | 0 | 0 | 0 | 110.6 | T7 T8 W9 | D5-T7 PolarHBondContact O-N 3.04Å; D5-T8 PolarHBondContact O-N 2.94Å; D5-T8 VanDerWaalsContact O-N 3.09Å; D5-T8 PolarHBondContact O-OG1 3.11Å; D5-W9 PolarHBondContact O-N 3.2Å | ||
| 6 | R | 82.9 | Confident | 81.2 | Confident | 188 Ų | 188 | 114.3 Ų | 114.3 | 71% | 0.709 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -57.1 | -29.3 | -173.3 | -171.5 | 172.2 | 72.1 | 169 | 0.2 | 112.8 | E4 K10 | E4-R6 PolarHBondContact O-N 2.94Å; R6-K10 WeakPolarHBondContact O-CB 3.21Å; R6-K10 WeakPolarHBondContact O-CG 3.47Å; R6-K10 PolarHBondContact O-N 2.84Å |
| 7 | T | 85.9 | Confident | 81.8 | Confident | 114 Ų | 114 | 107.8 Ų | 107.8 | 70% | 0.699 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -74.2 | -45.6 | 179.8 | -51.7 | 0 | 0 | 0 | 0 | 111.4 | D5 K10 S11 | D5-T7 PolarHBondContact O-N 3.04Å; T7-K10 PolarHBondContact O-N 3.02Å; T7-S11 PolarHBondContact O-N 2.59Å; T7-S11 PolarHBondContact O-OG 3.43Å |
| 8 | T | 89.2 | Confident | 82.2 | Confident | 63 Ų | 63 | 103.5 Ų | 103.5 | 39% | 0.387 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.8 | -39.2 | 178.6 | 55.3 | 0 | 0 | 0 | 0 | 111.2 | D5 K10 S11 N12 | D5-T8 PolarHBondContact O-N 2.94Å; D5-T8 VanDerWaalsContact O-N 3.09Å; D5-T8 PolarHBondContact O-OG1 3.11Å; T8-K10 VanDerWaalsContact C-N 3.31Å; T8-K10 PolarHBondContact O-N 3.24Å; T8-S11 WeakPolarHBondContact CA-OG 3.5Å; T8-S11 PolarHBondContact O-N 2.94Å; T8-S11 PolarHBondContact O-OG 2.85Å; T8-N12 WeakPolarHBondContact O-CB 3.44Å; T8-N12 PolarHBondContact O-N 2.85Å; T8-N12 PolarHBondContact O-ND2 2.68Å; T8-N12 PolarHBondContact O-OD1 3.02Å |
| 9 | W | 87.6 | Confident | 82.7 | Confident | 129 Ų | 129 | 104.2 Ų | 104.2 | 49% | 0.489 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.7 | -42.4 | 173.4 | 178.5 | 78 | 0 | 0 | 0 | 112.3 | E4 D5 N12 Y13 | E4-W9 HydrophobicContact CB-CB 4.37Å; D5-W9 PolarHBondContact O-N 3.2Å; W9-N12 PolarHBondContact O-N 3.28Å; W9-Y13 WeakPolarHBondContact O-CB 3.41Å; W9-Y13 PolarHBondContact O-N 3.18Å |
| 10 | K | 87.3 | Confident | 83.1 | Confident | 76 Ų | 76 | 99.8 Ų | 99.8 | 33% | 0.33 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.6 | -46.5 | 177.2 | -78.9 | 179.6 | -178.4 | -179.9 | 0 | 111.6 | R6 T7 T8 N12 Y13 F14 M60 | R6-K10 WeakPolarHBondContact O-CB 3.21Å; R6-K10 WeakPolarHBondContact O-CG 3.47Å; R6-K10 PolarHBondContact O-N 2.84Å; T7-K10 PolarHBondContact O-N 3.02Å; T8-K10 VanDerWaalsContact C-N 3.31Å; T8-K10 PolarHBondContact O-N 3.24Å; K10-N12 VanDerWaalsContact C-N 3.34Å; K10-Y13 PolarHBondContact O-N 3.23Å; K10-F14 WeakPolarHBondContact O-CD2 3.26Å; K10-F14 PolarHBondContact O-N 3.27Å; K10-M60 HydrophobicContact CB-CE 3.9Å; K10-M60 HydrophobicContact CD-CE 4.12Å; K10-M60 HydrophobicContact CD-SD 4.31Å; K10-M60 HydrophobicContact CG-CE 3.62Å; K10-M60 HydrophobicContact CG-SD 4.4Å |
| 11 | S | 88.6 | Confident | 83.3 | Confident | 56 Ų | 56 | 96.2 Ų | 96.2 | 39% | 0.392 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -61.7 | -43.4 | 177.9 | 55.6 | 0 | 0 | 0 | 0 | 111.3 | T7 T8 Y13 F14 M15 | T7-S11 PolarHBondContact O-N 2.59Å; T7-S11 PolarHBondContact O-OG 3.43Å; T8-S11 WeakPolarHBondContact CA-OG 3.5Å; T8-S11 PolarHBondContact O-N 2.94Å; T8-S11 PolarHBondContact O-OG 2.85Å; S11-Y13 VanDerWaalsContact C-N 3.3Å; S11-Y13 PolarHBondContact O-N 3.28Å; S11-F14 PolarHBondContact O-N 3.2Å; S11-M15 WeakPolarHBondContact O-CG 3.4Å; S11-M15 PolarHBondContact O-N 3.12Å |
| 12 | N | 90.6 | Very high | 85.1 | Confident | 84 Ų | 84 | 90.8 Ų | 90.8 | 45% | 0.449 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61.2 | -40.3 | 176.5 | -67.7 | -9.1 | 0 | 0 | 0 | 111.6 | T8 W9 K10 M15 K16 | T8-N12 WeakPolarHBondContact O-CB 3.44Å; T8-N12 PolarHBondContact O-N 2.85Å; T8-N12 PolarHBondContact O-ND2 2.68Å; T8-N12 PolarHBondContact O-OD1 3.02Å; W9-N12 PolarHBondContact O-N 3.28Å; K10-N12 VanDerWaalsContact C-N 3.34Å; N12-M15 PolarHBondContact O-N 3.14Å; N12-K16 WeakPolarHBondContact O-CB 3.24Å; N12-K16 PolarHBondContact O-N 2.98Å |
| 13 | Y | 89.7 | Confident | 86.7 | Confident | 26 Ų | 26 | 88.7 Ų | 88.7 | 10% | 0.102 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -65.1 | -41.4 | 175.4 | -175.3 | -93.8 | 0 | 0 | 0 | 112.5 | W9 K10 S11 K16 I17 L54 M55 G56 M60 M61 | W9-Y13 WeakPolarHBondContact O-CB 3.41Å; W9-Y13 PolarHBondContact O-N 3.18Å; K10-Y13 PolarHBondContact O-N 3.23Å; S11-Y13 VanDerWaalsContact C-N 3.3Å; S11-Y13 PolarHBondContact O-N 3.28Å; Y13-K16 PolarHBondContact O-N 3.36Å; Y13-I17 HydrophobicContact CD1-CD1 3.9Å; Y13-I17 HydrophobicContact CD1-CG1 4.42Å; Y13-I17 HydrophobicContact CE1-CD1 3.16Å; Y13-I17 HydrophobicContact CE1-CG1 3.98Å; Y13-I17 PolarHBondContact O-N 3.38Å; Y13-L54 HydrophobicContact CE2-CD2 4.48Å; Y13-L54 WeakPolarHBondContact OH-CD2 3.2Å; Y13-M55 PolarHBondContact OH-O 3.36Å; Y13-G56 VanDerWaalsContact OH-CA 3.23Å; Y13-G56 WeakPolarHBondContact OH-CA 3.31Å; Y13-G56 PolarHBondContact OH-N 3.37Å; Y13-M60 HydrophobicContact CD1-CE 4.37Å; Y13-M60 HydrophobicContact CE1-CB 4.35Å; Y13-M61 HydrophobicContact CE1-CG 4.37Å |
| 14 | F | 89.1 | Confident | 88.1 | Confident | 45 Ų | 45 | 79.4 Ų | 79.4 | 20% | 0.197 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -60 | -53.2 | 174 | -80.3 | -69.4 | 0 | 0 | 0 | 110.7 | K10 S11 K16 I17 I18 M60 K63 A64 | K10-F14 WeakPolarHBondContact O-CD2 3.26Å; K10-F14 PolarHBondContact O-N 3.27Å; S11-F14 PolarHBondContact O-N 3.2Å; F14-K16 PolarHBondContact O-N 3.02Å; F14-I17 PolarHBondContact O-N 3.26Å; F14-I17 VanDerWaalsContact O-N 3.14Å; F14-I18 HydrophobicContact CB-CD1 4.47Å; F14-I18 WeakPolarHBondContact O-CB 3.41Å; F14-I18 WeakPolarHBondContact O-CD1 3.47Å; F14-I18 WeakPolarHBondContact O-CG1 3.27Å; F14-I18 PolarHBondContact O-N 3.3Å; F14-M60 HydrophobicContact CD2-CE 3.97Å; F14-M60 HydrophobicContact CE1-CE 4.4Å; F14-M60 WeakPolarHBondContact CE1-O 3.19Å; F14-M60 HydrophobicContact CE2-CE 3.23Å; F14-M60 HydrophobicContact CE2-SD 4.06Å; F14-M60 HydrophobicContact CZ-CE 3.48Å; F14-M60 VanDerWaalsContact CZ-CE 3.48Å; F14-M60 HydrophobicContact CZ-SD 3.89Å; F14-K63 HydrophobicContact CE1-CB 4.17Å; F14-K63 HydrophobicContact CE1-CG 4.38Å; F14-K63 HydrophobicContact CZ-CB 4.33Å; F14-K63 HydrophobicContact CZ-CD 4.31Å; F14-K63 HydrophobicContact CZ-CG 4.41Å; F14-A64 HydrophobicContact CD1-CB 3.5Å; F14-A64 VanDerWaalsContact CD1-CB 3.5Å; F14-A64 HydrophobicContact CE1-CB 3.72Å |
| 15 | M | 90.7 | Very high | 88.7 | Confident | 126 Ų | 126 | 77.1 Ų | 77.1 | 62% | 0.621 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -56 | -41 | 178.5 | -66.5 | -59.4 | -70.3 | 0 | 0 | 111.9 | S11 N12 I18 Q19 | S11-M15 WeakPolarHBondContact O-CG 3.4Å; S11-M15 PolarHBondContact O-N 3.12Å; N12-M15 PolarHBondContact O-N 3.14Å; M15-I18 PolarHBondContact O-N 3.34Å; M15-Q19 WeakPolarHBondContact O-CB 3.41Å; M15-Q19 PolarHBondContact O-N 3.49Å |
| 16 | K | 91.5 | Very high | 88.9 | Confident | 116 Ų | 116 | 72.9 Ų | 72.9 | 50% | 0.504 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -65.3 | -42.5 | 178.3 | -175.6 | 172.3 | -177.3 | 171.6 | 0 | 113.2 | N12 Y13 F14 I18 L20 L54 | N12-K16 WeakPolarHBondContact O-CB 3.24Å; N12-K16 PolarHBondContact O-N 2.98Å; Y13-K16 PolarHBondContact O-N 3.36Å; F14-K16 PolarHBondContact O-N 3.02Å; K16-I18 VanDerWaalsContact C-N 3.33Å; K16-L20 HydrophobicContact CG-CD1 4.14Å; K16-L20 WeakPolarHBondContact O-CB 3.33Å; K16-L20 VanDerWaalsContact O-CG 3.25Å; K16-L20 WeakPolarHBondContact O-CG 3.24Å; K16-L20 PolarHBondContact O-N 3.03Å; K16-L20 VanDerWaalsContact O-N 3.1Å; K16-L54 HydrophobicContact CD-CD1 4.45Å; K16-L54 HydrophobicContact CG-CD1 4.27Å |
| 17 | I | 90.4 | Very high | 89.3 | Confident | 3 Ų | 3 | 64 Ų | 64 | 2% | 0.015 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.1 | -45.8 | 176.1 | -76.9 | -176.7 | 0 | 0 | 0 | 110.4 | Y13 F14 Q19 L20 L21 L54 M61 A64 | Y13-I17 HydrophobicContact CD1-CD1 3.9Å; Y13-I17 HydrophobicContact CD1-CG1 4.42Å; Y13-I17 HydrophobicContact CE1-CD1 3.16Å; Y13-I17 HydrophobicContact CE1-CG1 3.98Å; Y13-I17 PolarHBondContact O-N 3.38Å; F14-I17 PolarHBondContact O-N 3.26Å; F14-I17 VanDerWaalsContact O-N 3.14Å; I17-Q19 VanDerWaalsContact C-N 3.35Å; I17-L20 PolarHBondContact O-N 3.11Å; I17-L20 VanDerWaalsContact O-N 3.16Å; I17-L21 HydrophobicContact CG2-CD1 3.64Å; I17-L21 HydrophobicContact CG2-CG 4.19Å; I17-L21 WeakPolarHBondContact O-CG 3.29Å; I17-L21 PolarHBondContact O-N 3.39Å; I17-L54 HydrophobicContact CD1-CD2 3.88Å; I17-L54 HydrophobicContact CG1-CD1 3.82Å; I17-L54 HydrophobicContact CG1-CD2 3.65Å; I17-L54 HydrophobicContact CG1-CG 4.42Å; I17-M61 HydrophobicContact CD1-CB 4.41Å; I17-M61 HydrophobicContact CD1-CG 3.87Å; I17-A64 HydrophobicContact CB-CB 4.46Å; I17-A64 HydrophobicContact CD1-CB 4.4Å; I17-A64 HydrophobicContact CG2-CB 3.95Å |
| 18 | I | 88.9 | Confident | 89.6 | Confident | 31 Ų | 31 | 58.6 Ų | 58.6 | 16% | 0.159 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -58.6 | -51.5 | -177.7 | -69.2 | 167.8 | 0 | 0 | 0 | 109.9 | F14 M15 K16 L20 L21 D22 H68 | F14-I18 HydrophobicContact CB-CD1 4.47Å; F14-I18 WeakPolarHBondContact O-CB 3.41Å; F14-I18 WeakPolarHBondContact O-CD1 3.47Å; F14-I18 WeakPolarHBondContact O-CG1 3.27Å; F14-I18 PolarHBondContact O-N 3.3Å; M15-I18 PolarHBondContact O-N 3.34Å; K16-I18 VanDerWaalsContact C-N 3.33Å; I18-L20 VanDerWaalsContact C-N 3.27Å; I18-L20 PolarHBondContact O-N 3.42Å; I18-L21 PolarHBondContact O-N 3.18Å; I18-D22 PolarHBondContact O-N 3.06Å; I18-H68 WeakPolarHBondContact CD1-NE2 3.36Å; I18-H68 WeakPolarHBondContact CG1-CD2 3.33Å; I18-H68 WeakPolarHBondContact CG1-NE2 3.46Å; I18-H68 WeakPolarHBondContact CG2-CE1 3.48Å; I18-H68 VanDerWaalsContact CG2-NE2 3.34Å; I18-H68 WeakPolarHBondContact CG2-NE2 3.45Å |
| 19 | Q | 91.4 | Very high | 89.7 | Confident | 117 Ų | 117 | 55.6 Ų | 55.6 | 55% | 0.547 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -56.4 | -42.2 | 176.2 | -175.8 | 176.7 | 7 | 0 | 0 | 111.9 | M15 I17 D22 D23 | M15-Q19 WeakPolarHBondContact O-CB 3.41Å; M15-Q19 PolarHBondContact O-N 3.49Å; I17-Q19 VanDerWaalsContact C-N 3.35Å; Q19-D22 PolarHBondContact O-N 3.35Å; Q19-D23 WeakPolarHBondContact CG-OD2 3.31Å; Q19-D23 WeakPolarHBondContact O-CB 3.34Å; Q19-D23 PolarHBondContact O-N 3.14Å |
| 20 | L | 91.2 | Very high | 89.9 | Confident | 15 Ų | 15 | 49.4 Ų | 49.4 | 8% | 0.079 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -70.2 | -30.9 | 178.1 | -70.7 | 169.5 | 0 | 0 | 0 | 113.5 | K16 I17 I18 Y24 V52 L54 F90 | K16-L20 HydrophobicContact CG-CD1 4.14Å; K16-L20 WeakPolarHBondContact O-CB 3.33Å; K16-L20 VanDerWaalsContact O-CG 3.25Å; K16-L20 WeakPolarHBondContact O-CG 3.24Å; K16-L20 PolarHBondContact O-N 3.03Å; K16-L20 VanDerWaalsContact O-N 3.1Å; I17-L20 PolarHBondContact O-N 3.11Å; I17-L20 VanDerWaalsContact O-N 3.16Å; I18-L20 VanDerWaalsContact C-N 3.27Å; I18-L20 PolarHBondContact O-N 3.42Å; L20-Y24 HydrophobicContact CD2-CD2 3.89Å; L20-Y24 HydrophobicContact CD2-CE2 3.56Å; L20-Y24 WeakPolarHBondContact O-CB 3.29Å; L20-Y24 WeakPolarHBondContact O-CD2 3.34Å; L20-Y24 PolarHBondContact O-N 2.7Å; L20-V52 HydrophobicContact CD1-CG1 4.27Å; L20-V52 HydrophobicContact CD2-CB 4.26Å; L20-V52 HydrophobicContact CD2-CG1 4.06Å; L20-L54 HydrophobicContact CD1-CB 4.3Å; L20-L54 HydrophobicContact CD1-CD1 3.52Å; L20-F90 HydrophobicContact CB-CD1 4.44Å; L20-F90 HydrophobicContact CB-CD2 3.87Å; L20-F90 HydrophobicContact CB-CE1 4.45Å; L20-F90 HydrophobicContact CB-CE2 3.85Å; L20-F90 HydrophobicContact CB-CG 4.16Å; L20-F90 HydrophobicContact CB-CZ 4.16Å; L20-F90 HydrophobicContact CD1-CD2 4.04Å; L20-F90 HydrophobicContact CD1-CE2 4.09Å; L20-F90 HydrophobicContact CG-CD2 4.39Å |
| 21 | L | 87 | Confident | 90.1 | Very high | 26 Ų | 26 | 45.9 Ų | 45.9 | 14% | 0.136 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -71.6 | -34.7 | 174.9 | -74.3 | 168.3 | 0 | 0 | 0 | 112 | I17 I18 I65 L75 F90 | I17-L21 HydrophobicContact CG2-CD1 3.64Å; I17-L21 HydrophobicContact CG2-CG 4.19Å; I17-L21 WeakPolarHBondContact O-CG 3.29Å; I17-L21 PolarHBondContact O-N 3.39Å; I18-L21 PolarHBondContact O-N 3.18Å; L21-I65 HydrophobicContact CD1-CG1 4.06Å; L21-L75 HydrophobicContact CD2-CD2 4.22Å; L21-F90 HydrophobicContact CD2-CE1 3.81Å; L21-F90 HydrophobicContact CD2-CZ 4.19Å; L21-F90 HydrophobicContact CG-CE1 4.31Å; L21-F90 HydrophobicContact CG-CZ 4.43Å |
| 22 | D | 87.1 | Confident | 90.1 | Very high | 104 Ų | 104 | 43.5 Ų | 43.5 | 56% | 0.556 | 22% | 0.216 | S | C | * | . | H | α-helix | trans | -79.6 | -39.6 | 178.1 | -64.1 | -26.5 | 0 | 0 | 0 | 111.3 | I18 Q19 | I18-D22 PolarHBondContact O-N 3.06Å; Q19-D22 PolarHBondContact O-N 3.35Å |
| 23 | D | 90 | Very high | 89.9 | Confident | 72 Ų | 72 | 43.5 Ų | 43.5 | 39% | 0.385 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -71.9 | -32.8 | -177.5 | -75.6 | -18.5 | 0 | 0 | 0 | 112.8 | Q19 K92 | Q19-D23 WeakPolarHBondContact CG-OD2 3.31Å; Q19-D23 WeakPolarHBondContact O-CB 3.34Å; Q19-D23 PolarHBondContact O-N 3.14Å; D23-K92 WeakPolarHBondContact O-CE 3.4Å; D23-K92 PolarHBondContact O-NZ 2.88Å; D23-K92 VanDerWaalsContact O-NZ 3.15Å |
| 24 | Y | 89.6 | Confident | 89.5 | Confident | 51 Ų | 51 | 46.7 Ų | 46.7 | 20% | 0.2 | 23% | 0.234 | C | C | . | . | trans | -118.1 | 116.8 | -171.4 | -65.3 | -93.8 | 0 | 0 | 0 | 111.8 | L20 K26 V52 F90 K92 | L20-Y24 HydrophobicContact CD2-CD2 3.89Å; L20-Y24 HydrophobicContact CD2-CE2 3.56Å; L20-Y24 WeakPolarHBondContact O-CB 3.29Å; L20-Y24 WeakPolarHBondContact O-CD2 3.34Å; L20-Y24 PolarHBondContact O-N 2.7Å; Y24-K26 VanDerWaalsContact C-N 3.31Å; Y24-K26 PolarHBondContact O-N 3.35Å; Y24-V52 HydrophobicContact CE2-CG2 4.46Å; Y24-F90 HydrophobicContact CD1-CB 4.11Å; Y24-F90 HydrophobicContact CD2-CB 3.91Å; Y24-F90 HydrophobicContact CG-CB 3.69Å; Y24-K92 HydrophobicContact CD1-CD 4.26Å; Y24-K92 HydrophobicContact CD1-CG 3.48Å; Y24-K92 VanDerWaalsContact CD1-CG 3.48Å; Y24-K92 HydrophobicContact CE1-CD 4.2Å; Y24-K92 HydrophobicContact CE1-CG 3.76Å; Y24-K92 HydrophobicContact CG-CG 4.41Å | ||
| 25 | P | 87.4 | Confident | 89.4 | Confident | 52 Ų | 52 | 45.8 Ų | 45.8 | 34% | 0.338 | 23% | 0.232 | S | C | . | . | S | Bend | trans | -72.8 | -24.4 | -178.7 | 27.3 | -32.8 | 0 | 0 | 0 | 113.3 | N195 | P25-N195 VanDerWaalsContact CB-OD1 3.31Å; P25-N195 WeakPolarHBondContact CB-OD1 3.49Å; P25-N195 PolarHBondContact O-N 3.27Å |
| 26 | K | 91 | Very high | 89.1 | Confident | 36 Ų | 36 | 41.5 Ų | 41.5 | 16% | 0.157 | 22% | 0.22 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -113.4 | 138.2 | -175.6 | -59 | 170 | -179.7 | -176 | 0 | 110.6 | Y24 T91 E93 L95 Y193 | Y24-K26 VanDerWaalsContact C-N 3.31Å; Y24-K26 PolarHBondContact O-N 3.35Å; K26-T91 WeakPolarHBondContact CB-O 3.37Å; K26-T91 PolarHBondContact O-N 3.37Å; K26-T91 VanDerWaalsContact O-N 3.1Å; K26-E93 WeakPolarHBondContact CD-O 3.26Å; K26-E93 PolarHBondContact NZ-O 3.46Å; K26-L95 HydrophobicContact CB-CD2 3.98Å; K26-L95 HydrophobicContact CD-CD2 3.92Å; K26-L95 HydrophobicContact CD-CG 4.01Å; K26-L95 HydrophobicContact CG-CD2 4.26Å; K26-Y193 WeakPolarHBondContact CA-O 3.23Å |
| 27 | C | 91.1 | Very high | 88.9 | Confident | 2 Ų | 2 | 40.6 Ų | 40.6 | 1% | 0.014 | 23% | 0.229 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -143.3 | 145.2 | 170.8 | 71.5 | 0 | 0 | 0 | 0 | 113.5 | V89 F90 Y193 | C27-V89 CarbonylContact C-O 3.52Å; C27-V89 VanDerWaalsContact CA-O 3.29Å; C27-V89 WeakPolarHBondContact CA-O 3.22Å; C27-F90 HydrophobicContact CB-CD1 3.65Å; C27-F90 HydrophobicContact CB-CE1 3.8Å; C27-F90 HydrophobicContact CB-CG 4.48Å; C27-Y193 PolarHBondContact N-O 2.83Å; C27-Y193 WeakPolarHBondContact O-CB 3.24Å; C27-Y193 PolarHBondContact O-N 3.46Å; C27-Y193 WeakPolarHBondContact SG-CB 3.31Å |
| 28 | F | 92.3 | Very high | 88.8 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.5 | 135.5 | 169 | -65.3 | -84.1 | 0 | 0 | 0 | 110.3 | V30 F88 V89 T91 L95 I98 I189 V192 L204 | F28-V30 HydrophobicContact CB-CG1 4.08Å; F28-F88 CarbonylContact O-C 3.51Å; F28-F88 VanDerWaalsContact O-CA 3.32Å; F28-F88 WeakPolarHBondContact O-CA 3.49Å; F28-V89 HydrophobicContact CB-CB 4.16Å; F28-V89 HydrophobicContact CD2-CB 4.49Å; F28-V89 PolarHBondContact N-O 2.79Å; F28-V89 PolarHBondContact O-N 3.17Å; F28-T91 HydrophobicContact CD2-CG2 4.28Å; F28-T91 HydrophobicContact CE2-CG2 4.24Å; F28-L95 HydrophobicContact CE1-CD2 4.12Å; F28-L95 HydrophobicContact CE2-CD2 3.75Å; F28-L95 HydrophobicContact CZ-CB 3.95Å; F28-L95 HydrophobicContact CZ-CD2 3.44Å; F28-L95 VanDerWaalsContact CZ-CD2 3.44Å; F28-L95 HydrophobicContact CZ-CG 4.31Å; F28-L95 WeakPolarHBondContact CZ-O 3.49Å; F28-I98 HydrophobicContact CD2-CG2 4.08Å; F28-I98 HydrophobicContact CE2-CB 3.94Å; F28-I98 HydrophobicContact CE2-CG2 3.62Å; F28-I98 HydrophobicContact CZ-CB 4.44Å; F28-I98 HydrophobicContact CZ-CG2 4.42Å; F28-I189 HydrophobicContact CD1-CD1 4.37Å; F28-I189 HydrophobicContact CD1-CG1 4.46Å; F28-I189 HydrophobicContact CD1-CG2 3.74Å; F28-I189 HydrophobicContact CE1-CD1 4.46Å; F28-I189 HydrophobicContact CE1-CG2 4.4Å; F28-V192 HydrophobicContact CD1-CB 4.25Å; F28-V192 HydrophobicContact CD1-CG1 3.91Å; F28-V192 HydrophobicContact CD1-CG2 3.7Å; F28-V192 HydrophobicContact CE1-CB 4.27Å; F28-V192 HydrophobicContact CE1-CG1 3.66Å; F28-V192 HydrophobicContact CE1-CG2 3.67Å; F28-V192 HydrophobicContact CZ-CG1 4.31Å; F28-L204 HydrophobicContact CE1-CD1 4.11Å |
| 29 | I | 92.1 | Very high | 88.7 | Confident | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.7 | 111.4 | 164.2 | -59.1 | -173.4 | 0 | 0 | 0 | 107 | L78 H81 V86 F88 Q190 Q191 | I29-L78 HydrophobicContact CD1-CD2 3.8Å; I29-L78 HydrophobicContact CG1-CD2 4.5Å; I29-H81 HydrophobicContact CD1-CB 3.76Å; I29-V86 HydrophobicContact CG2-CG1 3.4Å; I29-V86 VanDerWaalsContact CG2-CG1 3.4Å; I29-F88 HydrophobicContact CD1-CE1 4.25Å; I29-F88 HydrophobicContact CG1-CD1 4.18Å; I29-F88 HydrophobicContact CG1-CE1 3.79Å; I29-Q190 HydrophobicContact CG2-CB 4.35Å; I29-Q190 PolarHBondContact O-N 3.39Å; I29-Q191 HydrophobicContact CB-CB 4.18Å; I29-Q191 HydrophobicContact CD1-CB 4.18Å; I29-Q191 HydrophobicContact CG1-CB 4.41Å; I29-Q191 PolarHBondContact N-O 3.2Å; I29-Q191 PolarHBondContact O-N 2.93Å |
| 30 | V | 91.9 | Very high | 88.6 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 24% | 0.242 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 134.2 | -178.1 | -65.4 | 0 | 0 | 0 | 0 | 111.3 | F28 V86 G87 V89 L102 L187 L188 I189 | F28-V30 HydrophobicContact CB-CG1 4.08Å; V30-V86 CarbonylContact O-C 3.59Å; V30-V86 VanDerWaalsContact O-CA 3.32Å; V30-V86 WeakPolarHBondContact O-CA 3.47Å; V30-G87 WeakPolarHBondContact CG2-O 3.4Å; V30-G87 PolarHBondContact N-O 3.42Å; V30-G87 PolarHBondContact O-N 3.33Å; V30-V89 HydrophobicContact CG1-CG2 3.86Å; V30-V89 HydrophobicContact CG2-CG2 3.79Å; V30-L102 HydrophobicContact CG1-CD1 4.44Å; V30-L187 HydrophobicContact CB-CB 4.32Å; V30-L187 HydrophobicContact CB-CD2 4.16Å; V30-L187 HydrophobicContact CG1-CB 4.46Å; V30-L187 HydrophobicContact CG2-CD2 3.96Å; V30-L188 CarbonylContact C-O 3.52Å; V30-L188 WeakPolarHBondContact CA-O 3.39Å; V30-I189 HydrophobicContact CG1-CG1 4.33Å |
| 31 | G | 91.4 | Very high | 88.5 | Confident | 1 Ų | 1 | 49.5 Ų | 49.5 | 1% | 0.01 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83 | 126.1 | 165.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | N85 L188 | G31-N85 WeakPolarHBondContact CA-O 2.94Å; G31-L188 PolarHBondContact N-O 3.11Å; G31-L188 PolarHBondContact O-N 2.86Å; G31-L188 VanDerWaalsContact O-N 3.11Å |
| 32 | A | 87.4 | Confident | 88.6 | Confident | 7 Ų | 7 | 51 Ų | 51 | 6% | 0.058 | 28% | 0.283 | C | S | . | . | trans | -108.3 | 43.4 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112 | V35 M55 N85 L187 | A32-V35 HydrophobicContact CB-CG2 4.34Å; A32-M55 HydrophobicContact CB-CE 3.68Å; A32-N85 PolarHBondContact N-O 3Å; A32-N85 PolarHBondContact O-ND2 3Å; A32-L187 HydrophobicContact CB-CD2 3.89Å | ||
| 33 | D | 86.5 | Confident | 88.7 | Confident | 84 Ų | 84 | 46.3 Ų | 46.3 | 45% | 0.449 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.7 | 134.4 | 179.1 | -66.8 | -40.5 | 0 | 0 | 0 | 111.4 | V35 N85 | D33-V35 PolarHBondContact O-N 2.98Å; D33-N85 WeakPolarHBondContact OD1-CB 3.28Å |
| 34 | N | 82.2 | Confident | 88.8 | Confident | 92 Ų | 92 | 48.9 Ų | 48.9 | 49% | 0.492 | 26% | 0.262 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 58.2 | 15.9 | -178.6 | -58.6 | -43.8 | 0 | 0 | 0 | 115.8 | F185 | N34-F185 HydrophobicContact CB-CD1 4.17Å; N34-F185 HydrophobicContact CB-CD2 4.07Å; N34-F185 HydrophobicContact CB-CE1 4.45Å; N34-F185 HydrophobicContact CB-CE2 4.4Å; N34-F185 HydrophobicContact CB-CG 4Å |
| 35 | V | 85.4 | Confident | 88.8 | Confident | 26 Ų | 26 | 52.3 Ų | 52.3 | 16% | 0.158 | 28% | 0.283 | C | S | . | . | trans | -84 | 123 | 178.4 | -170.5 | 0 | 0 | 0 | 0 | 110.5 | A32 D33 Q39 M40 | A32-V35 HydrophobicContact CB-CG2 4.34Å; D33-V35 PolarHBondContact O-N 2.98Å; V35-Q39 HydrophobicContact CG1-CB 4.05Å; V35-Q39 HydrophobicContact CG1-CG 3.81Å; V35-M40 HydrophobicContact CB-CG 4.49Å; V35-M40 HydrophobicContact CB-SD 4.47Å; V35-M40 HydrophobicContact CG1-CG 3.68Å; V35-M40 HydrophobicContact CG1-SD 3.68Å | ||
| 36 | G | 85.1 | Confident | 88.9 | Confident | 36 Ų | 36 | 52.3 Ų | 52.3 | 37% | 0.371 | 28% | 0.284 | S | S | . | . | trans | -75 | 154.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | K38 Q39 M40 | G36-K38 VanDerWaalsContact C-N 3.29Å; G36-K38 PolarHBondContact O-N 2.98Å; G36-Q39 WeakPolarHBondContact O-CB 2.98Å; G36-Q39 PolarHBondContact O-N 3.32Å; G36-Q39 VanDerWaalsContact O-N 3.09Å; G36-M40 PolarHBondContact O-N 3.48Å | ||
| 37 | S | 87.9 | Confident | 88.8 | Confident | 97 Ų | 97 | 50.6 Ų | 50.6 | 68% | 0.678 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -58.5 | -38.7 | 178.4 | -54.2 | 0 | 0 | 0 | 0 | 113.2 | M40 Q41 | S37-M40 PolarHBondContact O-N 3.28Å; S37-Q41 WeakPolarHBondContact O-CG 3.45Å; S37-Q41 PolarHBondContact O-N 2.99Å |
| 38 | K | 87.9 | Confident | 88.7 | Confident | 181 Ų | 181 | 59.8 Ų | 59.8 | 79% | 0.787 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -65.6 | -38.8 | 176.4 | -172.1 | 176.2 | -178.9 | -179.3 | 0 | 111.8 | G36 Q41 A42 | G36-K38 VanDerWaalsContact C-N 3.29Å; G36-K38 PolarHBondContact O-N 2.98Å; K38-Q41 PolarHBondContact O-N 3.46Å; K38-A42 PolarHBondContact O-N 3.4Å |
| 39 | Q | 87.3 | Confident | 88.5 | Confident | 20 Ų | 20 | 63.7 Ų | 63.7 | 9% | 0.093 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -65.6 | -44.6 | 175.2 | 179.4 | 177.3 | 12 | 0 | 0 | 111 | V35 G36 Q41 A42 I43 V107 F185 | V35-Q39 HydrophobicContact CG1-CB 4.05Å; V35-Q39 HydrophobicContact CG1-CG 3.81Å; G36-Q39 WeakPolarHBondContact O-CB 2.98Å; G36-Q39 PolarHBondContact O-N 3.32Å; G36-Q39 VanDerWaalsContact O-N 3.09Å; Q39-Q41 VanDerWaalsContact C-N 3.26Å; Q39-Q41 PolarHBondContact O-N 2.87Å; Q39-A42 PolarHBondContact O-N 3.42Å; Q39-A42 VanDerWaalsContact O-N 3.16Å; Q39-I43 HydrophobicContact CG-CD1 3.84Å; Q39-I43 HydrophobicContact CG-CG1 4.44Å; Q39-I43 VanDerWaalsContact O-CG1 3.3Å; Q39-I43 WeakPolarHBondContact O-CG1 3.36Å; Q39-I43 PolarHBondContact O-N 3.36Å; Q39-V107 HydrophobicContact CB-CG2 4.23Å; Q39-V107 VanDerWaalsContact CD-CG2 3.46Å; Q39-V107 HydrophobicContact CG-CB 4.34Å; Q39-V107 HydrophobicContact CG-CG2 3.59Å; Q39-F185 PolarHBondContact NE2-O 3.45Å |
| 40 | M | 88.8 | Confident | 88.3 | Confident | 24 Ų | 24 | 67 Ų | 67 | 12% | 0.118 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -60.2 | -36.1 | 174.6 | -74.8 | -60.6 | -70.8 | 0 | 0 | 112.8 | V35 G36 S37 R44 V53 M55 L187 | V35-M40 HydrophobicContact CB-CG 4.49Å; V35-M40 HydrophobicContact CB-SD 4.47Å; V35-M40 HydrophobicContact CG1-CG 3.68Å; V35-M40 HydrophobicContact CG1-SD 3.68Å; G36-M40 PolarHBondContact O-N 3.48Å; S37-M40 PolarHBondContact O-N 3.28Å; M40-R44 WeakPolarHBondContact O-CB 3.36Å; M40-R44 VanDerWaalsContact O-CG 3.25Å; M40-R44 WeakPolarHBondContact O-CG 3.46Å; M40-R44 PolarHBondContact O-N 3.37Å; M40-V53 HydrophobicContact CE-CG1 4.01Å; M40-M55 HydrophobicContact CE-CG 3.87Å; M40-M55 HydrophobicContact CE-SD 3.91Å; M40-L187 HydrophobicContact SD-CD2 4.05Å |
| 41 | Q | 89.7 | Confident | 88.3 | Confident | 129 Ų | 129 | 67.5 Ų | 67.5 | 60% | 0.603 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -67.1 | -44 | 174.5 | -72.5 | 172.1 | 2.6 | 0 | 0 | 111.7 | S37 K38 Q39 R44 L45 | S37-Q41 WeakPolarHBondContact O-CG 3.45Å; S37-Q41 PolarHBondContact O-N 2.99Å; K38-Q41 PolarHBondContact O-N 3.46Å; Q39-Q41 VanDerWaalsContact C-N 3.26Å; Q39-Q41 PolarHBondContact O-N 2.87Å; Q41-R44 PolarHBondContact O-N 2.84Å; Q41-L45 PolarHBondContact O-N 2.9Å |
| 42 | A | 89.2 | Confident | 88.4 | Confident | 57 Ų | 57 | 69.7 Ų | 69.7 | 47% | 0.471 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -60.9 | -44.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | K38 Q39 R44 L45 S46 | K38-A42 PolarHBondContact O-N 3.4Å; Q39-A42 PolarHBondContact O-N 3.42Å; Q39-A42 VanDerWaalsContact O-N 3.16Å; A42-R44 PolarHBondContact O-N 3.2Å; A42-L45 WeakPolarHBondContact O-CA 3.4Å; A42-L45 WeakPolarHBondContact O-CB 3.41Å; A42-L45 PolarHBondContact O-N 3.01Å; A42-S46 PolarHBondContact O-N 2.93Å |
| 43 | I | 89.4 | Confident | 88.6 | Confident | 5 Ų | 5 | 70.3 Ų | 70.3 | 3% | 0.026 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -62.4 | -41.7 | 176.2 | -67.2 | 166.5 | 0 | 0 | 0 | 111.3 | Q39 L45 S46 L47 L102 N105 L187 | Q39-I43 HydrophobicContact CG-CD1 3.84Å; Q39-I43 HydrophobicContact CG-CG1 4.44Å; Q39-I43 VanDerWaalsContact O-CG1 3.3Å; Q39-I43 WeakPolarHBondContact O-CG1 3.36Å; Q39-I43 PolarHBondContact O-N 3.36Å; I43-L45 PolarHBondContact O-N 2.96Å; I43-S46 WeakPolarHBondContact CA-OG 3.43Å; I43-S46 PolarHBondContact O-N 3.19Å; I43-S46 PolarHBondContact O-OG 3.08Å; I43-L47 HydrophobicContact CG2-CD1 3.58Å; I43-L47 HydrophobicContact CG2-CG 4.22Å; I43-L47 VanDerWaalsContact O-CB 3.29Å; I43-L47 WeakPolarHBondContact O-CB 3.48Å; I43-L47 VanDerWaalsContact O-CG 3.26Å; I43-L47 WeakPolarHBondContact O-CG 3.23Å; I43-L47 PolarHBondContact O-N 2.83Å; I43-L102 HydrophobicContact CG2-CD2 4.4Å; I43-N105 HydrophobicContact CG1-CB 4.22Å; I43-L187 HydrophobicContact CD1-CD1 3.79Å; I43-L187 HydrophobicContact CD1-CG 3.97Å; I43-L187 HydrophobicContact CG2-CD1 3.7Å |
| 44 | R | 90.4 | Very high | 88.8 | Confident | 127 Ų | 127 | 66.7 Ų | 66.7 | 48% | 0.479 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -65.2 | -28.7 | 174.8 | -75.6 | 174.7 | -175.9 | -172.4 | 3.2 | 112.6 | M40 Q41 A42 R48 V53 | M40-R44 WeakPolarHBondContact O-CB 3.36Å; M40-R44 VanDerWaalsContact O-CG 3.25Å; M40-R44 WeakPolarHBondContact O-CG 3.46Å; M40-R44 PolarHBondContact O-N 3.37Å; Q41-R44 PolarHBondContact O-N 2.84Å; A42-R44 PolarHBondContact O-N 3.2Å; R44-R48 PolarHBondContact O-N 3.01Å; R44-V53 HydrophobicContact CG-CB 4.22Å; R44-V53 HydrophobicContact CG-CG2 4.32Å |
| 45 | L | 91.2 | Very high | 89.2 | Confident | 123 Ų | 123 | 64.7 Ų | 64.7 | 64% | 0.644 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -74.3 | -43.3 | 176.5 | -138.8 | 76.9 | 0 | 0 | 0 | 111 | Q41 A42 I43 R48 | Q41-L45 PolarHBondContact O-N 2.9Å; A42-L45 WeakPolarHBondContact O-CA 3.4Å; A42-L45 WeakPolarHBondContact O-CB 3.41Å; A42-L45 PolarHBondContact O-N 3.01Å; I43-L45 PolarHBondContact O-N 2.96Å; L45-R48 VanDerWaalsContact O-CB 3.27Å; L45-R48 WeakPolarHBondContact O-CB 3.28Å; L45-R48 PolarHBondContact O-N 3.3Å |
| 46 | S | 88.9 | Confident | 89.3 | Confident | 51 Ų | 51 | 64.9 Ų | 64.9 | 36% | 0.357 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -68.5 | -35.2 | 178.4 | 62.6 | 0 | 0 | 0 | 0 | 112.6 | A42 I43 R48 N105 | A42-S46 PolarHBondContact O-N 2.93Å; I43-S46 WeakPolarHBondContact CA-OG 3.43Å; I43-S46 PolarHBondContact O-N 3.19Å; I43-S46 PolarHBondContact O-OG 3.08Å; S46-R48 VanDerWaalsContact C-N 3.27Å; S46-R48 PolarHBondContact O-N 3.19Å; S46-N105 PolarHBondContact OG-ND2 3.28Å; S46-N105 VanDerWaalsContact OG-ND2 3.14Å |
| 47 | L | 88.4 | Confident | 89.6 | Confident | 0 Ų | 0 | 70.1 Ų | 70.1 | 0% | 0 | 37% | 0.374 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -81 | -3.2 | 177.5 | -68.7 | 175.6 | 0 | 0 | 0 | 113.9 | I43 G49 K50 A51 V53 V89 I98 L102 | I43-L47 HydrophobicContact CG2-CD1 3.58Å; I43-L47 HydrophobicContact CG2-CG 4.22Å; I43-L47 VanDerWaalsContact O-CB 3.29Å; I43-L47 WeakPolarHBondContact O-CB 3.48Å; I43-L47 VanDerWaalsContact O-CG 3.26Å; I43-L47 WeakPolarHBondContact O-CG 3.23Å; I43-L47 PolarHBondContact O-N 2.83Å; L47-G49 PolarHBondContact O-N 3.4Å; L47-K50 PolarHBondContact O-N 3.34Å; L47-K50 VanDerWaalsContact O-N 3.14Å; L47-A51 HydrophobicContact CB-CB 4.11Å; L47-A51 HydrophobicContact CD1-CB 4.5Å; L47-A51 HydrophobicContact CD2-CB 4.08Å; L47-A51 HydrophobicContact CG-CB 4.46Å; L47-A51 PolarHBondContact O-N 2.96Å; L47-V53 HydrophobicContact CD1-CG2 3.5Å; L47-V53 VanDerWaalsContact CD1-CG2 3.5Å; L47-V89 HydrophobicContact CD1-CG1 4.2Å; L47-I98 HydrophobicContact CD2-CG2 4.46Å; L47-L102 HydrophobicContact CD1-CD2 3.89Å |
| 48 | R | 89.7 | Confident | 89.7 | Confident | 196 Ų | 196 | 67.2 Ų | 67.2 | 74% | 0.74 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.6 | 126.6 | -173.5 | -160.3 | 174.9 | -161.4 | 172 | 3.1 | 110.7 | R44 L45 S46 K50 | R44-R48 PolarHBondContact O-N 3.01Å; L45-R48 VanDerWaalsContact O-CB 3.27Å; L45-R48 WeakPolarHBondContact O-CB 3.28Å; L45-R48 PolarHBondContact O-N 3.3Å; S46-R48 VanDerWaalsContact C-N 3.27Å; S46-R48 PolarHBondContact O-N 3.19Å; R48-K50 VanDerWaalsContact C-N 3.32Å |
| 49 | G | 86.9 | Confident | 89.8 | Confident | 82 Ų | 82 | 62.4 Ų | 62.4 | 85% | 0.845 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 95.5 | -30.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | L47 | L47-G49 PolarHBondContact O-N 3.4Š|
| 50 | K | 88.8 | Confident | 89.8 | Confident | 69 Ų | 69 | 62.7 Ų | 62.7 | 30% | 0.3 | 34% | 0.339 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.1 | -40.5 | -178.2 | -58.7 | -167.9 | 149 | -138.2 | 0 | 113.4 | L47 R48 E93 E97 M101 | L47-K50 PolarHBondContact O-N 3.34Å; L47-K50 VanDerWaalsContact O-N 3.14Å; R48-K50 VanDerWaalsContact C-N 3.32Å; K50-E93 WeakPolarHBondContact CB-OE2 3.46Å; K50-E93 WeakPolarHBondContact CD-OE2 3.38Å; K50-E93 VanDerWaalsContact CE-OE2 3.26Å; K50-E93 WeakPolarHBondContact CE-OE2 3.36Å; K50-E93 WeakPolarHBondContact CG-OE1 3.33Å; K50-E93 WeakPolarHBondContact CG-OE2 3.41Å; K50-E93 IonicContact NZ-OE2 2.73Å; K50-E93 PolarHBondContact NZ-OE2 2.89Å; K50-E97 IonicContact NZ-OE2 3.07Å; K50-E97 PolarHBondContact NZ-OE2 3.33Å; K50-M101 HydrophobicContact CD-CE 3.75Å; K50-M101 HydrophobicContact CD-SD 3.87Å |
| 51 | A | 91.6 | Very high | 89.8 | Confident | 10 Ų | 10 | 61.5 Ų | 61.5 | 8% | 0.083 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.5 | 152.7 | -174.5 | 0 | 0 | 0 | 0 | 0 | 113 | L47 V89 F90 T91 | L47-A51 HydrophobicContact CB-CB 4.11Å; L47-A51 HydrophobicContact CD1-CB 4.5Å; L47-A51 HydrophobicContact CD2-CB 4.08Å; L47-A51 HydrophobicContact CG-CB 4.46Å; L47-A51 PolarHBondContact O-N 2.96Å; A51-V89 HydrophobicContact CB-CG1 3.74Å; A51-F90 CarbonylContact C-O 3.52Å; A51-F90 WeakPolarHBondContact CA-O 3.46Å; A51-F90 WeakPolarHBondContact CB-O 3.35Å; A51-T91 HydrophobicContact CB-CG2 3.47Å; A51-T91 VanDerWaalsContact CB-CG2 3.47Å |
| 52 | V | 92.6 | Very high | 89.8 | Confident | 48 Ų | 48 | 58.3 Ų | 58.3 | 29% | 0.291 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 117.8 | 175.4 | -177.9 | 0 | 0 | 0 | 0 | 109.8 | L20 Y24 F90 | L20-V52 HydrophobicContact CD1-CG1 4.27Å; L20-V52 HydrophobicContact CD2-CB 4.26Å; L20-V52 HydrophobicContact CD2-CG1 4.06Å; Y24-V52 HydrophobicContact CE2-CG2 4.46Å; V52-F90 PolarHBondContact N-O 2.84Å; V52-F90 PolarHBondContact O-N 3.14Å |
| 53 | V | 92.3 | Very high | 89.9 | Confident | 19 Ų | 19 | 62.7 Ų | 62.7 | 12% | 0.115 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.1 | 122.2 | 175.5 | -174.1 | 0 | 0 | 0 | 0 | 110.2 | M40 R44 L47 M55 F88 V89 | M40-V53 HydrophobicContact CE-CG1 4.01Å; R44-V53 HydrophobicContact CG-CB 4.22Å; R44-V53 HydrophobicContact CG-CG2 4.32Å; L47-V53 HydrophobicContact CD1-CG2 3.5Å; L47-V53 VanDerWaalsContact CD1-CG2 3.5Å; V53-M55 HydrophobicContact CG1-SD 4.47Å; V53-F88 WeakPolarHBondContact CA-O 3.47Å; V53-V89 HydrophobicContact CG1-CG2 4.4Å; V53-V89 HydrophobicContact CG2-CG1 4.29Å; V53-V89 HydrophobicContact CG2-CG2 4.13Å |
| 54 | L | 91.8 | Very high | 89.7 | Confident | 9 Ų | 9 | 62.6 Ų | 62.6 | 5% | 0.047 | 32% | 0.324 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 118 | 174.5 | -176.6 | 134.4 | 0 | 0 | 0 | 110.3 | Y13 K16 I17 L20 M61 F88 F90 | Y13-L54 HydrophobicContact CE2-CD2 4.48Å; Y13-L54 WeakPolarHBondContact OH-CD2 3.2Å; K16-L54 HydrophobicContact CD-CD1 4.45Å; K16-L54 HydrophobicContact CG-CD1 4.27Å; I17-L54 HydrophobicContact CD1-CD2 3.88Å; I17-L54 HydrophobicContact CG1-CD1 3.82Å; I17-L54 HydrophobicContact CG1-CD2 3.65Å; I17-L54 HydrophobicContact CG1-CG 4.42Å; L20-L54 HydrophobicContact CD1-CB 4.3Å; L20-L54 HydrophobicContact CD1-CD1 3.52Å; L54-M61 HydrophobicContact CD2-SD 4.43Å; L54-F88 HydrophobicContact CD2-CD2 4.46Å; L54-F88 PolarHBondContact N-O 3.44Å; L54-F88 PolarHBondContact O-N 2.86Å; L54-F90 HydrophobicContact CB-CD2 4.38Å; L54-F90 HydrophobicContact CB-CE2 4Å |
| 55 | M | 89.9 | Confident | 89.6 | Confident | 49 Ų | 49 | 56.7 Ų | 56.7 | 24% | 0.241 | 30% | 0.302 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106 | 145 | 172.4 | -59.9 | -61.3 | -60.9 | 0 | 0 | 109.4 | Y13 A32 M40 V53 G87 | Y13-M55 PolarHBondContact OH-O 3.36Å; A32-M55 HydrophobicContact CB-CE 3.68Å; M40-M55 HydrophobicContact CE-CG 3.87Å; M40-M55 HydrophobicContact CE-SD 3.91Å; V53-M55 HydrophobicContact CG1-SD 4.47Å; M55-G87 WeakPolarHBondContact SD-CA 3.35Å |
| 56 | G | 88.1 | Confident | 89.3 | Confident | 30 Ų | 30 | 58 Ų | 58 | 31% | 0.309 | 30% | 0.298 | S | S | . | . | trans | -178.7 | -166.3 | 161.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y13 N58 M61 | Y13-G56 VanDerWaalsContact OH-CA 3.23Å; Y13-G56 WeakPolarHBondContact OH-CA 3.31Å; Y13-G56 PolarHBondContact OH-N 3.37Å; G56-N58 PolarHBondContact O-N 3.42Å; G56-M61 VanDerWaalsContact O-CE 3.3Å; G56-M61 WeakPolarHBondContact O-CE 3.43Å | ||
| 57 | K | 90.3 | Very high | 89.1 | Confident | 146 Ų | 146 | 58.2 Ų | 58.2 | 64% | 0.635 | 31% | 0.308 | S | S | * | . | trans | -76.5 | 128 | -169.4 | -170.7 | 173.4 | -179.3 | 172.1 | 0 | 111.1 | T59 M60 M61 | K57-T59 VanDerWaalsContact C-N 3.27Å; K57-T59 PolarHBondContact O-N 3.34Å; K57-T59 VanDerWaalsContact O-N 3.12Å; K57-M60 HydrophobicContact CB-CB 4.34Å; K57-M60 HydrophobicContact CB-CG 4.14Å; K57-M60 WeakPolarHBondContact O-CA 3.4Å; K57-M60 WeakPolarHBondContact O-CB 3.15Å; K57-M60 PolarHBondContact O-N 2.94Å; K57-M61 PolarHBondContact O-N 3.02Å | ||
| 58 | N | 90.4 | Very high | 88.8 | Confident | 36 Ų | 36 | 59.8 Ų | 59.8 | 19% | 0.193 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -50.3 | -43.7 | -177.6 | -62 | -1.1 | 0 | 0 | 0 | 113.7 | G56 M60 M61 R62 I82 G84 | G56-N58 PolarHBondContact O-N 3.42Å; N58-M60 VanDerWaalsContact C-N 3.3Å; N58-M60 PolarHBondContact O-N 3.07Å; N58-M61 PolarHBondContact O-N 2.73Å; N58-R62 VanDerWaalsContact O-CB 3.24Å; N58-R62 WeakPolarHBondContact O-CB 3.42Å; N58-R62 PolarHBondContact O-N 3.39Å; N58-I82 HydrophobicContact CB-CG2 4.01Å; N58-G84 PolarHBondContact ND2-O 3.5Å |
| 59 | T | 89.1 | Confident | 88.3 | Confident | 80 Ų | 80 | 53 Ų | 53 | 49% | 0.491 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -66.3 | -32.7 | -179.9 | 58.8 | 0 | 0 | 0 | 0 | 112.8 | K57 K63 | K57-T59 VanDerWaalsContact C-N 3.27Å; K57-T59 PolarHBondContact O-N 3.34Å; K57-T59 VanDerWaalsContact O-N 3.12Å; T59-K63 WeakPolarHBondContact O-CB 3.25Å; T59-K63 PolarHBondContact O-N 3.34Å |
| 60 | M | 88.4 | Confident | 87.9 | Confident | 26 Ų | 26 | 57.7 Ų | 57.7 | 13% | 0.128 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -73.9 | -48.6 | 177.4 | -70.4 | -75 | -63.8 | 0 | 0 | 110.4 | K10 Y13 F14 K57 N58 R62 K63 A64 | K10-M60 HydrophobicContact CB-CE 3.9Å; K10-M60 HydrophobicContact CD-CE 4.12Å; K10-M60 HydrophobicContact CD-SD 4.31Å; K10-M60 HydrophobicContact CG-CE 3.62Å; K10-M60 HydrophobicContact CG-SD 4.4Å; Y13-M60 HydrophobicContact CD1-CE 4.37Å; Y13-M60 HydrophobicContact CE1-CB 4.35Å; F14-M60 HydrophobicContact CD2-CE 3.97Å; F14-M60 HydrophobicContact CE1-CE 4.4Å; F14-M60 WeakPolarHBondContact CE1-O 3.19Å; F14-M60 HydrophobicContact CE2-CE 3.23Å; F14-M60 HydrophobicContact CE2-SD 4.06Å; F14-M60 HydrophobicContact CZ-CE 3.48Å; F14-M60 VanDerWaalsContact CZ-CE 3.48Å; F14-M60 HydrophobicContact CZ-SD 3.89Å; K57-M60 HydrophobicContact CB-CB 4.34Å; K57-M60 HydrophobicContact CB-CG 4.14Å; K57-M60 WeakPolarHBondContact O-CA 3.4Å; K57-M60 WeakPolarHBondContact O-CB 3.15Å; K57-M60 PolarHBondContact O-N 2.94Å; N58-M60 VanDerWaalsContact C-N 3.3Å; N58-M60 PolarHBondContact O-N 3.07Å; M60-R62 VanDerWaalsContact C-N 3.32Å; M60-R62 PolarHBondContact O-N 3.34Å; M60-K63 PolarHBondContact O-N 3.23Å; M60-K63 VanDerWaalsContact O-N 3.13Å; M60-A64 PolarHBondContact O-N 3.18Å |
| 61 | M | 89.3 | Confident | 87.4 | Confident | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -59.6 | -44.3 | 178.3 | -61.1 | -171.2 | -61 | 0 | 0 | 111.2 | Y13 I17 L54 G56 K57 N58 K63 A64 I65 I82 F88 | Y13-M61 HydrophobicContact CE1-CG 4.37Å; I17-M61 HydrophobicContact CD1-CB 4.41Å; I17-M61 HydrophobicContact CD1-CG 3.87Å; L54-M61 HydrophobicContact CD2-SD 4.43Å; G56-M61 VanDerWaalsContact O-CE 3.3Å; G56-M61 WeakPolarHBondContact O-CE 3.43Å; K57-M61 PolarHBondContact O-N 3.02Å; N58-M61 PolarHBondContact O-N 2.73Å; M61-K63 VanDerWaalsContact C-N 3.31Å; M61-K63 PolarHBondContact O-N 3.4Å; M61-A64 WeakPolarHBondContact O-CB 3.35Å; M61-A64 PolarHBondContact O-N 3.12Å; M61-I65 VanDerWaalsContact O-CG1 3.32Å; M61-I65 WeakPolarHBondContact O-CG1 3.44Å; M61-I65 PolarHBondContact O-N 3.47Å; M61-I82 HydrophobicContact CE-CG2 3.94Å; M61-F88 HydrophobicContact CB-CE2 4.22Å; M61-F88 HydrophobicContact CE-CE2 4.26Å; M61-F88 HydrophobicContact CG-CE2 4.43Å; M61-F88 HydrophobicContact SD-CD2 3.78Å; M61-F88 HydrophobicContact SD-CE2 3.67Å |
| 62 | R | 89.9 | Confident | 86.7 | Confident | 62 Ų | 62 | 62.8 Ų | 62.8 | 23% | 0.234 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.2 | -38 | 176.4 | -163.5 | 179.9 | -63.6 | 126.1 | 3 | 112.8 | N58 M60 R66 L79 I82 | N58-R62 VanDerWaalsContact O-CB 3.24Å; N58-R62 WeakPolarHBondContact O-CB 3.42Å; N58-R62 PolarHBondContact O-N 3.39Å; M60-R62 VanDerWaalsContact C-N 3.32Å; M60-R62 PolarHBondContact O-N 3.34Å; R62-R66 WeakPolarHBondContact O-CB 3.3Å; R62-R66 VanDerWaalsContact O-CG 3.31Å; R62-R66 WeakPolarHBondContact O-CG 3.37Å; R62-R66 PolarHBondContact O-N 3.21Å; R62-R66 VanDerWaalsContact O-N 3.11Å; R62-L79 HydrophobicContact CG-CD2 3.67Å; R62-I82 PolarHBondContact NH2-O 2.89Å |
| 63 | K | 89.4 | Confident | 86.2 | Confident | 149 Ų | 149 | 64.9 Ų | 64.9 | 65% | 0.648 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -69.6 | -38.2 | 176.9 | -171.8 | 172.5 | -177.8 | 178.2 | 0 | 111.6 | F14 T59 M60 M61 G67 | F14-K63 HydrophobicContact CE1-CB 4.17Å; F14-K63 HydrophobicContact CE1-CG 4.38Å; F14-K63 HydrophobicContact CZ-CB 4.33Å; F14-K63 HydrophobicContact CZ-CD 4.31Å; F14-K63 HydrophobicContact CZ-CG 4.41Å; T59-K63 WeakPolarHBondContact O-CB 3.25Å; T59-K63 PolarHBondContact O-N 3.34Å; M60-K63 PolarHBondContact O-N 3.23Å; M60-K63 VanDerWaalsContact O-N 3.13Å; M61-K63 VanDerWaalsContact C-N 3.31Å; M61-K63 PolarHBondContact O-N 3.4Å; K63-G67 PolarHBondContact O-N 2.96Å; K63-G67 VanDerWaalsContact O-N 3.1Å |
| 64 | A | 87.1 | Confident | 85.6 | Confident | 3 Ų | 3 | 65 Ų | 65 | 3% | 0.025 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -62.3 | -50.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | F14 I17 M60 M61 R66 G67 H68 | F14-A64 HydrophobicContact CD1-CB 3.5Å; F14-A64 VanDerWaalsContact CD1-CB 3.5Å; F14-A64 HydrophobicContact CE1-CB 3.72Å; I17-A64 HydrophobicContact CB-CB 4.46Å; I17-A64 HydrophobicContact CD1-CB 4.4Å; I17-A64 HydrophobicContact CG2-CB 3.95Å; M60-A64 PolarHBondContact O-N 3.18Å; M61-A64 WeakPolarHBondContact O-CB 3.35Å; M61-A64 PolarHBondContact O-N 3.12Å; A64-R66 PolarHBondContact O-N 2.94Å; A64-G67 PolarHBondContact O-N 3.09Å; A64-G67 VanDerWaalsContact O-N 3.17Å; A64-H68 PolarHBondContact O-N 3.28Å |
| 65 | I | 86.9 | Confident | 85.1 | Confident | 2 Ų | 2 | 65 Ų | 65 | 1% | 0.01 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -64.3 | -41.8 | -178.5 | -64.4 | 165 | 0 | 0 | 0 | 111.2 | L21 M61 G67 H68 L69 L75 L79 I82 F88 | L21-I65 HydrophobicContact CD1-CG1 4.06Å; M61-I65 VanDerWaalsContact O-CG1 3.32Å; M61-I65 WeakPolarHBondContact O-CG1 3.44Å; M61-I65 PolarHBondContact O-N 3.47Å; I65-G67 VanDerWaalsContact C-N 3.3Å; I65-G67 PolarHBondContact O-N 2.94Å; I65-H68 CarbonylContact O-C 3.54Å; I65-H68 PolarHBondContact O-N 2.83Å; I65-H68 VanDerWaalsContact O-N 3.09Å; I65-L69 PolarHBondContact O-N 3.11Å; I65-L75 HydrophobicContact CG2-CB 3.71Å; I65-L75 HydrophobicContact CG2-CD1 4.38Å; I65-L79 HydrophobicContact CB-CD2 4.25Å; I65-L79 HydrophobicContact CG2-CD2 4Å; I65-I82 HydrophobicContact CD1-CD1 3.55Å; I65-F88 HydrophobicContact CD1-CE2 4.33Å; I65-F88 HydrophobicContact CD1-CZ 3.99Å |
| 66 | R | 86.2 | Confident | 84.9 | Confident | 151 Ų | 151 | 68.3 Ų | 68.3 | 57% | 0.57 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -62.9 | -35 | 175.2 | -77.1 | 178.3 | -175.2 | 163.6 | -3.6 | 113.2 | R62 A64 H68 L69 L79 | R62-R66 WeakPolarHBondContact O-CB 3.3Å; R62-R66 VanDerWaalsContact O-CG 3.31Å; R62-R66 WeakPolarHBondContact O-CG 3.37Å; R62-R66 PolarHBondContact O-N 3.21Å; R62-R66 VanDerWaalsContact O-N 3.11Å; A64-R66 PolarHBondContact O-N 2.94Å; R66-H68 PolarHBondContact O-N 2.96Å; R66-L69 WeakPolarHBondContact O-CB 3.38Å; R66-L69 PolarHBondContact O-N 3.25Å; R66-L79 HydrophobicContact CG-CD1 4.09Å; R66-L79 HydrophobicContact CG-CD2 4.12Å |
| 67 | G | 83.3 | Confident | 84.7 | Confident | 55 Ų | 55 | 72.4 Ų | 72.4 | 57% | 0.567 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -69 | -22.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | K63 A64 I65 | K63-G67 PolarHBondContact O-N 2.96Å; K63-G67 VanDerWaalsContact O-N 3.1Å; A64-G67 PolarHBondContact O-N 3.09Å; A64-G67 VanDerWaalsContact O-N 3.17Å; I65-G67 VanDerWaalsContact C-N 3.3Å; I65-G67 PolarHBondContact O-N 2.94Å |
| 68 | H | 82.2 | Confident | 84.5 | Confident | 33 Ų | 33 | 65.4 Ų | 65.4 | 15% | 0.153 | 33% | 0.334 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -97.8 | 3.7 | 178.9 | -87 | -91.8 | 0 | 0 | 0 | 114.2 | I18 A64 I65 R66 E70 N71 N72 L75 | I18-H68 WeakPolarHBondContact CD1-NE2 3.36Å; I18-H68 WeakPolarHBondContact CG1-CD2 3.33Å; I18-H68 WeakPolarHBondContact CG1-NE2 3.46Å; I18-H68 WeakPolarHBondContact CG2-CE1 3.48Å; I18-H68 VanDerWaalsContact CG2-NE2 3.34Å; I18-H68 WeakPolarHBondContact CG2-NE2 3.45Å; A64-H68 PolarHBondContact O-N 3.28Å; I65-H68 CarbonylContact O-C 3.54Å; I65-H68 PolarHBondContact O-N 2.83Å; I65-H68 VanDerWaalsContact O-N 3.09Å; R66-H68 PolarHBondContact O-N 2.96Å; H68-E70 PolarHBondContact O-N 3.5Å; H68-N71 PolarHBondContact O-N 3.41Å; H68-N72 PolarHBondContact O-N 2.96Å; H68-L75 HydrophobicContact CB-CD1 4.37Å |
| 69 | L | 78.8 | Confident | 84.2 | Confident | 53 Ų | 53 | 64.8 Ų | 64.8 | 28% | 0.277 | 33% | 0.331 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.5 | -26.9 | -175.1 | -160.8 | 147 | 0 | 0 | 0 | 112.2 | I65 R66 N71 N72 E76 | I65-L69 PolarHBondContact O-N 3.11Å; R66-L69 WeakPolarHBondContact O-CB 3.38Å; R66-L69 PolarHBondContact O-N 3.25Å; L69-N71 VanDerWaalsContact C-N 3.27Å; L69-N71 PolarHBondContact O-N 3.07Å; L69-N72 CarbonylContact O-C 3.32Å; L69-N72 VanDerWaalsContact O-C 3.32Å; L69-N72 PolarHBondContact O-N 3.36Å; L69-E76 HydrophobicContact CD1-CB 3.97Å; L69-E76 HydrophobicContact CD1-CG 4.19Å |
| 70 | E | 78.3 | Confident | 84.2 | Confident | 182 Ų | 182 | 64.2 Ų | 64.2 | 85% | 0.85 | 33% | 0.328 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -32 | 175.5 | -65 | 179.1 | -173.9 | 0 | 0 | 112.5 | H68 | H68-E70 PolarHBondContact O-N 3.5Š|
| 71 | N | 79 | Confident | 84.2 | Confident | 122 Ų | 122 | 65.9 Ų | 65.9 | 65% | 0.652 | 34% | 0.336 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -34.3 | 179.3 | -65 | -13 | 0 | 0 | 0 | 112.1 | H68 L69 | H68-N71 PolarHBondContact O-N 3.41Å; L69-N71 VanDerWaalsContact C-N 3.27Å; L69-N71 PolarHBondContact O-N 3.07Å |
| 72 | N | 77.5 | Confident | 84.2 | Confident | 64 Ų | 64 | 65.9 Ų | 65.9 | 34% | 0.342 | 34% | 0.336 | S | S | . | . | trans | -141.7 | 98.2 | 179.1 | -166.1 | -15 | 0 | 0 | 0 | 111.3 | H68 L69 A74 L75 | H68-N72 PolarHBondContact O-N 2.96Å; L69-N72 CarbonylContact O-C 3.32Å; L69-N72 VanDerWaalsContact O-C 3.32Å; L69-N72 PolarHBondContact O-N 3.36Å; N72-A74 PolarHBondContact O-N 2.89Å; N72-A74 WeakPolarHBondContact OD1-CB 3.48Å; N72-A74 PolarHBondContact OD1-N 2.74Å; N72-L75 HydrophobicContact CB-CD1 3.96Å; N72-L75 HydrophobicContact CB-CG 4.04Å; N72-L75 PolarHBondContact O-N 3Å | ||
| 73 | P | 81.4 | Confident | 84.1 | Confident | 91 Ų | 91 | 69.7 Ų | 69.7 | 59% | 0.591 | 35% | 0.354 | S | S | * | . | G | 310 helix | trans | -68 | -21.4 | -176.8 | 27.4 | -34.6 | 0 | 0 | 0 | 112.3 | L75 E76 | P73-L75 PolarHBondContact O-N 3.4Å; P73-E76 WeakPolarHBondContact O-CB 3.02Å; P73-E76 PolarHBondContact O-N 3.29Å |
| 74 | A | 80.6 | Confident | 84 | Confident | 23 Ų | 23 | 65.2 Ų | 65.2 | 19% | 0.19 | 35% | 0.35 | C | S | . | . | G | 310 helix | trans | -71 | -14.4 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | N72 E76 K77 | N72-A74 PolarHBondContact O-N 2.89Å; N72-A74 WeakPolarHBondContact OD1-CB 3.48Å; N72-A74 PolarHBondContact OD1-N 2.74Å; A74-E76 PolarHBondContact O-N 3.21Å; A74-K77 PolarHBondContact O-N 3.37Å |
| 75 | L | 81.3 | Confident | 84.2 | Confident | 8 Ų | 8 | 68.9 Ų | 68.9 | 4% | 0.042 | 37% | 0.369 | C | S | . | . | G | 310 helix | trans | -66.4 | -17.5 | 173.1 | -64.5 | 175.9 | 0 | 0 | 0 | 113.3 | L21 I65 H68 N72 P73 K77 L78 Y193 | L21-L75 HydrophobicContact CD2-CD2 4.22Å; I65-L75 HydrophobicContact CG2-CB 3.71Å; I65-L75 HydrophobicContact CG2-CD1 4.38Å; H68-L75 HydrophobicContact CB-CD1 4.37Å; N72-L75 HydrophobicContact CB-CD1 3.96Å; N72-L75 HydrophobicContact CB-CG 4.04Å; N72-L75 PolarHBondContact O-N 3Å; P73-L75 PolarHBondContact O-N 3.4Å; L75-K77 PolarHBondContact O-N 2.84Å; L75-L78 HydrophobicContact CD2-CD1 3.75Å; L75-L78 WeakPolarHBondContact O-CB 3.5Å; L75-L78 PolarHBondContact O-N 2.79Å; L75-Y193 HydrophobicContact CD2-CE1 4.18Å; L75-Y193 HydrophobicContact CD2-CE2 4.46Å |
| 76 | E | 84.6 | Confident | 84.4 | Confident | 119 Ų | 119 | 68.9 Ų | 68.9 | 56% | 0.556 | 37% | 0.369 | S | S | * | . | G | 310 helix | trans | -58.4 | -35.4 | 177 | -167 | 173.9 | -174.3 | 0 | 0 | 111.9 | L69 P73 A74 L78 L79 | L69-E76 HydrophobicContact CD1-CB 3.97Å; L69-E76 HydrophobicContact CD1-CG 4.19Å; P73-E76 WeakPolarHBondContact O-CB 3.02Å; P73-E76 PolarHBondContact O-N 3.29Å; A74-E76 PolarHBondContact O-N 3.21Å; E76-L78 PolarHBondContact O-N 3.27Å; E76-L78 VanDerWaalsContact O-N 3.14Å; E76-L79 HydrophobicContact CG-CD1 4.07Å; E76-L79 WeakPolarHBondContact O-CB 3.38Å; E76-L79 WeakPolarHBondContact O-CG 3.27Å; E76-L79 PolarHBondContact O-N 2.98Å; E76-L79 VanDerWaalsContact O-N 3.17Å |
| 77 | K | 85.1 | Confident | 84.6 | Confident | 115 Ų | 115 | 61.7 Ų | 61.7 | 50% | 0.5 | 34% | 0.342 | S | S | . | . | G | 310 helix | trans | -62.9 | -19.8 | 178.4 | -62.3 | 179.8 | -172.5 | 166.5 | 0 | 113.2 | A74 L75 P80 H81 G196 V198 | A74-K77 PolarHBondContact O-N 3.37Å; L75-K77 PolarHBondContact O-N 2.84Å; K77-P80 WeakPolarHBondContact O-CD 3.48Å; K77-P80 WeakPolarHBondContact O-CG 3.41Å; K77-H81 PolarHBondContact O-CD2 3.42Å; K77-H81 VanDerWaalsContact O-CD2 3.28Å; K77-G196 PolarHBondContact NZ-O 3.46Å; K77-V198 HydrophobicContact CB-CG2 3.7Å |
| 78 | L | 84.9 | Confident | 85.1 | Confident | 0 Ų | 0 | 59.2 Ų | 59.2 | 0% | 0 | 32% | 0.316 | C | S | . | . | G | 310 helix | trans | -79.9 | -29.1 | 178.2 | -62.5 | 172.1 | 0 | 0 | 0 | 113.1 | I29 L75 E76 P80 H81 I82 Y193 V198 | I29-L78 HydrophobicContact CD1-CD2 3.8Å; I29-L78 HydrophobicContact CG1-CD2 4.5Å; L75-L78 HydrophobicContact CD2-CD1 3.75Å; L75-L78 WeakPolarHBondContact O-CB 3.5Å; L75-L78 PolarHBondContact O-N 2.79Å; E76-L78 PolarHBondContact O-N 3.27Å; E76-L78 VanDerWaalsContact O-N 3.14Å; L78-P80 VanDerWaalsContact C-CD 3.45Å; L78-H81 PolarHBondContact O-N 3.05Å; L78-H81 VanDerWaalsContact O-N 3.08Å; L78-I82 WeakPolarHBondContact O-CG1 3.44Å; L78-Y193 HydrophobicContact CD1-CD1 4.49Å; L78-Y193 HydrophobicContact CD1-CD2 3.93Å; L78-Y193 HydrophobicContact CD1-CE2 4.12Å; L78-Y193 HydrophobicContact CD1-CG 4.09Å; L78-Y193 HydrophobicContact CD2-CD2 3.62Å; L78-Y193 HydrophobicContact CD2-CE2 4.45Å; L78-Y193 HydrophobicContact CD2-CG 3.89Å; L78-Y193 HydrophobicContact CG-CD2 3.89Å; L78-Y193 HydrophobicContact CG-CE2 4.25Å; L78-Y193 HydrophobicContact CG-CG 4.38Å; L78-V198 HydrophobicContact CD2-CG2 3.73Å; L78-V198 HydrophobicContact CG-CG2 4.38Å |
| 79 | L | 85.5 | Confident | 85.6 | Confident | 23 Ų | 23 | 57.7 Ų | 57.7 | 12% | 0.12 | 31% | 0.309 | C | S | . | . | G | 310 helix | trans | -53.1 | -42.2 | -175.2 | -58.4 | 175.8 | 0 | 0 | 0 | 115.2 | R62 I65 R66 E76 H81 | R62-L79 HydrophobicContact CG-CD2 3.67Å; I65-L79 HydrophobicContact CB-CD2 4.25Å; I65-L79 HydrophobicContact CG2-CD2 4Å; R66-L79 HydrophobicContact CG-CD1 4.09Å; R66-L79 HydrophobicContact CG-CD2 4.12Å; E76-L79 HydrophobicContact CG-CD1 4.07Å; E76-L79 WeakPolarHBondContact O-CB 3.38Å; E76-L79 WeakPolarHBondContact O-CG 3.27Å; E76-L79 PolarHBondContact O-N 2.98Å; E76-L79 VanDerWaalsContact O-N 3.17Å; L79-H81 VanDerWaalsContact C-N 3.27Å; L79-H81 PolarHBondContact O-N 3.36Å |
| 80 | P | 89.4 | Confident | 86.3 | Confident | 67 Ų | 67 | 55.2 Ų | 55.2 | 44% | 0.435 | 30% | 0.296 | S | S | . | . | G | 310 helix | trans | -68.2 | -24.4 | 179.7 | 24.7 | -34.2 | 0 | 0 | 0 | 113.9 | K77 L78 K83 | K77-P80 WeakPolarHBondContact O-CD 3.48Å; K77-P80 WeakPolarHBondContact O-CG 3.41Å; L78-P80 VanDerWaalsContact C-CD 3.45Å; P80-K83 WeakPolarHBondContact O-CD 3.33Å; P80-K83 WeakPolarHBondContact O-CE 3.48Å |
| 81 | H | 87.5 | Confident | 87 | Confident | 62 Ų | 62 | 46.5 Ų | 46.5 | 29% | 0.287 | 26% | 0.255 | S | S | . | . | G | 310 helix | trans | -89 | -11.4 | -175.6 | -58.4 | -67.3 | 0 | 0 | 0 | 113.5 | I29 K77 L78 L79 K83 Q191 | I29-H81 HydrophobicContact CD1-CB 3.76Å; K77-H81 PolarHBondContact O-CD2 3.42Å; K77-H81 VanDerWaalsContact O-CD2 3.28Å; L78-H81 PolarHBondContact O-N 3.05Å; L78-H81 VanDerWaalsContact O-N 3.08Å; L79-H81 VanDerWaalsContact C-N 3.27Å; L79-H81 PolarHBondContact O-N 3.36Å; H81-K83 VanDerWaalsContact C-N 3.29Å; H81-K83 PolarHBondContact O-N 3.33Å; H81-Q191 HydrophobicContact CB-CG 4.08Å |
| 82 | I | 88.2 | Confident | 87.5 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 25% | 0.25 | C | C | . | . | trans | -80.9 | 75.4 | 175.8 | -53.2 | 165.8 | 0 | 0 | 0 | 109.8 | N58 M61 R62 I65 L78 F88 | N58-I82 HydrophobicContact CB-CG2 4.01Å; M61-I82 HydrophobicContact CE-CG2 3.94Å; R62-I82 PolarHBondContact NH2-O 2.89Å; I65-I82 HydrophobicContact CD1-CD1 3.55Å; L78-I82 WeakPolarHBondContact O-CG1 3.44Å; I82-F88 HydrophobicContact CD1-CE2 4.48Å; I82-F88 HydrophobicContact CD1-CZ 3.82Å; I82-F88 HydrophobicContact CG1-CZ 3.95Å | ||
| 83 | K | 88.2 | Confident | 88.1 | Confident | 141 Ų | 141 | 46.7 Ų | 46.7 | 61% | 0.613 | 25% | 0.248 | S | C | * | . | trans | -138.9 | 140.6 | 179.3 | -65.6 | 176.9 | -177 | 168.8 | 0 | 110.9 | P80 H81 V86 | P80-K83 WeakPolarHBondContact O-CD 3.33Å; P80-K83 WeakPolarHBondContact O-CE 3.48Å; H81-K83 VanDerWaalsContact C-N 3.29Å; H81-K83 PolarHBondContact O-N 3.33Å; K83-V86 WeakPolarHBondContact O-CG2 3.44Å | ||
| 84 | G | 88.6 | Confident | 88.4 | Confident | 55 Ų | 55 | 46 Ų | 46 | 57% | 0.567 | 24% | 0.24 | S | C | * | . | S | Bend | trans | 84.8 | -155.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | N58 V86 | N58-G84 PolarHBondContact ND2-O 3.5Å; G84-V86 PolarHBondContact O-N 2.78Å |
| 85 | N | 90 | Very high | 88.7 | Confident | 81 Ų | 81 | 45.5 Ų | 45.5 | 43% | 0.433 | 23% | 0.233 | S | C | . | . | S | Bend | trans | -87.9 | 86.7 | 177.9 | -173.1 | 14.7 | 0 | 0 | 0 | 110.3 | G31 A32 D33 | G31-N85 WeakPolarHBondContact CA-O 2.94Å; A32-N85 PolarHBondContact N-O 3Å; A32-N85 PolarHBondContact O-ND2 3Å; D33-N85 WeakPolarHBondContact OD1-CB 3.28Å |
| 86 | V | 90.8 | Very high | 89 | Confident | 1 Ų | 1 | 46.9 Ų | 46.9 | 1% | 0.006 | 25% | 0.246 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 143.4 | -169.4 | 176.6 | 0 | 0 | 0 | 0 | 111.8 | I29 V30 K83 G84 | I29-V86 HydrophobicContact CG2-CG1 3.4Å; I29-V86 VanDerWaalsContact CG2-CG1 3.4Å; V30-V86 CarbonylContact O-C 3.59Å; V30-V86 VanDerWaalsContact O-CA 3.32Å; V30-V86 WeakPolarHBondContact O-CA 3.47Å; K83-V86 WeakPolarHBondContact O-CG2 3.44Å; G84-V86 PolarHBondContact O-N 2.78Å |
| 87 | G | 92.1 | Very high | 89.1 | Confident | 0 Ų | 0 | 45.8 Ų | 45.8 | 0% | 0 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 165.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V30 M55 | V30-G87 WeakPolarHBondContact CG2-O 3.4Å; V30-G87 PolarHBondContact N-O 3.42Å; V30-G87 PolarHBondContact O-N 3.33Å; M55-G87 WeakPolarHBondContact SD-CA 3.35Å |
| 88 | F | 92.4 | Very high | 89.3 | Confident | 4 Ų | 4 | 40.3 Ų | 40.3 | 2% | 0.018 | 22% | 0.217 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -108.7 | 138.3 | 169.8 | -68.8 | -71.7 | 0 | 0 | 0 | 110.3 | F28 I29 V53 L54 M61 I65 I82 F90 | F28-F88 CarbonylContact O-C 3.51Å; F28-F88 VanDerWaalsContact O-CA 3.32Å; F28-F88 WeakPolarHBondContact O-CA 3.49Å; I29-F88 HydrophobicContact CD1-CE1 4.25Å; I29-F88 HydrophobicContact CG1-CD1 4.18Å; I29-F88 HydrophobicContact CG1-CE1 3.79Å; V53-F88 WeakPolarHBondContact CA-O 3.47Å; L54-F88 HydrophobicContact CD2-CD2 4.46Å; L54-F88 PolarHBondContact N-O 3.44Å; L54-F88 PolarHBondContact O-N 2.86Å; M61-F88 HydrophobicContact CB-CE2 4.22Å; M61-F88 HydrophobicContact CE-CE2 4.26Å; M61-F88 HydrophobicContact CG-CE2 4.43Å; M61-F88 HydrophobicContact SD-CD2 3.78Å; M61-F88 HydrophobicContact SD-CE2 3.67Å; I65-F88 HydrophobicContact CD1-CE2 4.33Å; I65-F88 HydrophobicContact CD1-CZ 3.99Å; I82-F88 HydrophobicContact CD1-CE2 4.48Å; I82-F88 HydrophobicContact CD1-CZ 3.82Å; I82-F88 HydrophobicContact CG1-CZ 3.95Å; F88-F90 HydrophobicContact CB-CD2 4.22Å; F88-F90 HydrophobicContact CB-CE2 3.57Å; F88-F90 HydrophobicContact CB-CZ 3.75Å; F88-F90 HydrophobicContact CG-CE2 4.39Å; F88-F90 HydrophobicContact CG-CZ 4.13Å |
| 89 | V | 93.1 | Very high | 89.4 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 22% | 0.224 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 111.7 | 167.2 | -174.2 | 0 | 0 | 0 | 0 | 107.4 | C27 F28 V30 L47 A51 V53 T91 | C27-V89 CarbonylContact C-O 3.52Å; C27-V89 VanDerWaalsContact CA-O 3.29Å; C27-V89 WeakPolarHBondContact CA-O 3.22Å; F28-V89 HydrophobicContact CB-CB 4.16Å; F28-V89 HydrophobicContact CD2-CB 4.49Å; F28-V89 PolarHBondContact N-O 2.79Å; F28-V89 PolarHBondContact O-N 3.17Å; V30-V89 HydrophobicContact CG1-CG2 3.86Å; V30-V89 HydrophobicContact CG2-CG2 3.79Å; L47-V89 HydrophobicContact CD1-CG1 4.2Å; A51-V89 HydrophobicContact CB-CG1 3.74Å; V53-V89 HydrophobicContact CG1-CG2 4.4Å; V53-V89 HydrophobicContact CG2-CG1 4.29Å; V53-V89 HydrophobicContact CG2-CG2 4.13Å; V89-T91 HydrophobicContact CG1-CG2 4.16Å |
| 90 | F | 93.7 | Very high | 89.6 | Confident | 1 Ų | 1 | 45.3 Ų | 45.3 | 0% | 0.004 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -93.6 | 134.8 | -178.3 | -66.2 | -77.6 | 0 | 0 | 0 | 110.8 | L20 L21 Y24 C27 A51 V52 L54 F88 | L20-F90 HydrophobicContact CB-CD1 4.44Å; L20-F90 HydrophobicContact CB-CD2 3.87Å; L20-F90 HydrophobicContact CB-CE1 4.45Å; L20-F90 HydrophobicContact CB-CE2 3.85Å; L20-F90 HydrophobicContact CB-CG 4.16Å; L20-F90 HydrophobicContact CB-CZ 4.16Å; L20-F90 HydrophobicContact CD1-CD2 4.04Å; L20-F90 HydrophobicContact CD1-CE2 4.09Å; L20-F90 HydrophobicContact CG-CD2 4.39Å; L21-F90 HydrophobicContact CD2-CE1 3.81Å; L21-F90 HydrophobicContact CD2-CZ 4.19Å; L21-F90 HydrophobicContact CG-CE1 4.31Å; L21-F90 HydrophobicContact CG-CZ 4.43Å; Y24-F90 HydrophobicContact CD1-CB 4.11Å; Y24-F90 HydrophobicContact CD2-CB 3.91Å; Y24-F90 HydrophobicContact CG-CB 3.69Å; C27-F90 HydrophobicContact CB-CD1 3.65Å; C27-F90 HydrophobicContact CB-CE1 3.8Å; C27-F90 HydrophobicContact CB-CG 4.48Å; A51-F90 CarbonylContact C-O 3.52Å; A51-F90 WeakPolarHBondContact CA-O 3.46Å; A51-F90 WeakPolarHBondContact CB-O 3.35Å; V52-F90 PolarHBondContact N-O 2.84Å; V52-F90 PolarHBondContact O-N 3.14Å; L54-F90 HydrophobicContact CB-CD2 4.38Å; L54-F90 HydrophobicContact CB-CE2 4Å; F88-F90 HydrophobicContact CB-CD2 4.22Å; F88-F90 HydrophobicContact CB-CE2 3.57Å; F88-F90 HydrophobicContact CB-CZ 3.75Å; F88-F90 HydrophobicContact CG-CE2 4.39Å; F88-F90 HydrophobicContact CG-CZ 4.13Å |
| 91 | T | 92.6 | Very high | 89.5 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 23% | 0.232 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -146.6 | 144.4 | -168.9 | 56.4 | 0 | 0 | 0 | 0 | 111.3 | K26 F28 A51 V89 I98 | K26-T91 WeakPolarHBondContact CB-O 3.37Å; K26-T91 PolarHBondContact O-N 3.37Å; K26-T91 VanDerWaalsContact O-N 3.1Å; F28-T91 HydrophobicContact CD2-CG2 4.28Å; F28-T91 HydrophobicContact CE2-CG2 4.24Å; A51-T91 HydrophobicContact CB-CG2 3.47Å; A51-T91 VanDerWaalsContact CB-CG2 3.47Å; V89-T91 HydrophobicContact CG1-CG2 4.16Å; T91-I98 HydrophobicContact CG2-CB 4.39Å; T91-I98 HydrophobicContact CG2-CD1 3.21Å; T91-I98 HydrophobicContact CG2-CG1 4.05Å; T91-I98 HydrophobicContact CG2-CG2 3.89Å |
| 92 | K | 90.6 | Very high | 89.4 | Confident | 124 Ų | 124 | 41.5 Ų | 41.5 | 54% | 0.539 | 22% | 0.218 | S | C | . | . | S | Bend | trans | -103.6 | -23.7 | 169.2 | -63.5 | -176.1 | 178.1 | -170.4 | 0 | 112.2 | D23 Y24 | D23-K92 WeakPolarHBondContact O-CE 3.4Å; D23-K92 PolarHBondContact O-NZ 2.88Å; D23-K92 VanDerWaalsContact O-NZ 3.15Å; Y24-K92 HydrophobicContact CD1-CD 4.26Å; Y24-K92 HydrophobicContact CD1-CG 3.48Å; Y24-K92 VanDerWaalsContact CD1-CG 3.48Å; Y24-K92 HydrophobicContact CE1-CD 4.2Å; Y24-K92 HydrophobicContact CE1-CG 3.76Å; Y24-K92 HydrophobicContact CG-CG 4.41Å |
| 93 | E | 88.6 | Confident | 89.3 | Confident | 65 Ų | 65 | 43.8 Ų | 43.8 | 30% | 0.304 | 23% | 0.231 | S | C | . | . | S | Bend | trans | -73 | -172.9 | -178.4 | -64.2 | -174.8 | -179.8 | 0 | 0 | 112 | K26 K50 I98 | K26-E93 WeakPolarHBondContact CD-O 3.26Å; K26-E93 PolarHBondContact NZ-O 3.46Å; K50-E93 WeakPolarHBondContact CB-OE2 3.46Å; K50-E93 WeakPolarHBondContact CD-OE2 3.38Å; K50-E93 VanDerWaalsContact CE-OE2 3.26Å; K50-E93 WeakPolarHBondContact CE-OE2 3.36Å; K50-E93 WeakPolarHBondContact CG-OE1 3.33Å; K50-E93 WeakPolarHBondContact CG-OE2 3.41Å; K50-E93 IonicContact NZ-OE2 2.73Å; K50-E93 PolarHBondContact NZ-OE2 2.89Å; E93-I98 HydrophobicContact CB-CD1 3.86Å |
| 94 | D | 87.9 | Confident | 89.2 | Confident | 78 Ų | 78 | 41 Ų | 41 | 42% | 0.417 | 23% | 0.233 | S | C | . | . | trans | -71.1 | 143.7 | 179.6 | -173.1 | 43 | 0 | 0 | 0 | 113 | A96 E97 I98 | D94-A96 WeakPolarHBondContact OD2-CB 3.29Å; D94-A96 PolarHBondContact OD2-N 3.06Å; D94-E97 HydrophobicContact CB-CG 4.35Å; D94-I98 VanDerWaalsContact O-CD1 3.29Å; D94-I98 WeakPolarHBondContact O-CD1 3.38Å; D94-I98 PolarHBondContact O-N 3.04Å | ||
| 95 | L | 86.8 | Confident | 88.9 | Confident | 11 Ų | 11 | 41.1 Ų | 41.1 | 6% | 0.058 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -71 | -34.9 | -175.2 | -66.5 | 169.6 | 0 | 0 | 0 | 111.6 | K26 F28 R99 V192 D194 L204 | K26-L95 HydrophobicContact CB-CD2 3.98Å; K26-L95 HydrophobicContact CD-CD2 3.92Å; K26-L95 HydrophobicContact CD-CG 4.01Å; K26-L95 HydrophobicContact CG-CD2 4.26Å; F28-L95 HydrophobicContact CE1-CD2 4.12Å; F28-L95 HydrophobicContact CE2-CD2 3.75Å; F28-L95 HydrophobicContact CZ-CB 3.95Å; F28-L95 HydrophobicContact CZ-CD2 3.44Å; F28-L95 VanDerWaalsContact CZ-CD2 3.44Å; F28-L95 HydrophobicContact CZ-CG 4.31Å; F28-L95 WeakPolarHBondContact CZ-O 3.49Å; L95-R99 VanDerWaalsContact O-CB 3.25Å; L95-R99 WeakPolarHBondContact O-CB 3.28Å; L95-R99 PolarHBondContact O-N 2.64Å; L95-V192 HydrophobicContact CD1-CG1 3.93Å; L95-V192 HydrophobicContact CD2-CG1 3.72Å; L95-V192 HydrophobicContact CG-CG1 4.36Å; L95-D194 HydrophobicContact CD1-CB 4.21Å; L95-L204 HydrophobicContact CB-CD1 4.16Å; L95-L204 HydrophobicContact CB-CD2 3.92Å; L95-L204 HydrophobicContact CD1-CD2 4.19Å |
| 96 | A | 87.8 | Confident | 88.7 | Confident | 38 Ų | 38 | 41.9 Ų | 41.9 | 31% | 0.314 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -67.9 | -47.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | D94 I98 R99 D100 | D94-A96 WeakPolarHBondContact OD2-CB 3.29Å; D94-A96 PolarHBondContact OD2-N 3.06Å; A96-I98 VanDerWaalsContact C-N 3.34Å; A96-I98 PolarHBondContact O-N 3.16Å; A96-R99 WeakPolarHBondContact O-CB 3.25Å; A96-R99 PolarHBondContact O-N 2.99Å; A96-D100 PolarHBondContact O-N 3.32Å |
| 97 | E | 87.9 | Confident | 88.3 | Confident | 96 Ų | 96 | 44.7 Ų | 44.7 | 45% | 0.449 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -57.6 | -45.4 | 178.8 | -67.2 | -173 | -165.7 | 0 | 0 | 112.5 | K50 D94 R99 D100 M101 | K50-E97 IonicContact NZ-OE2 3.07Å; K50-E97 PolarHBondContact NZ-OE2 3.33Å; D94-E97 HydrophobicContact CB-CG 4.35Å; E97-R99 VanDerWaalsContact C-N 3.34Å; E97-D100 PolarHBondContact O-N 3.39Å; E97-M101 HydrophobicContact CB-CE 3.83Å; E97-M101 WeakPolarHBondContact O-CE 3.25Å; E97-M101 WeakPolarHBondContact O-CG 3.43Å; E97-M101 PolarHBondContact O-N 3.32Å |
| 98 | I | 88.6 | Confident | 87.9 | Confident | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -71.1 | -35.7 | -178.1 | -68.8 | 150.8 | 0 | 0 | 0 | 110.8 | F28 L47 T91 E93 D94 A96 D100 M101 L102 | F28-I98 HydrophobicContact CD2-CG2 4.08Å; F28-I98 HydrophobicContact CE2-CB 3.94Å; F28-I98 HydrophobicContact CE2-CG2 3.62Å; F28-I98 HydrophobicContact CZ-CB 4.44Å; F28-I98 HydrophobicContact CZ-CG2 4.42Å; L47-I98 HydrophobicContact CD2-CG2 4.46Å; T91-I98 HydrophobicContact CG2-CB 4.39Å; T91-I98 HydrophobicContact CG2-CD1 3.21Å; T91-I98 HydrophobicContact CG2-CG1 4.05Å; T91-I98 HydrophobicContact CG2-CG2 3.89Å; E93-I98 HydrophobicContact CB-CD1 3.86Å; D94-I98 VanDerWaalsContact O-CD1 3.29Å; D94-I98 WeakPolarHBondContact O-CD1 3.38Å; D94-I98 PolarHBondContact O-N 3.04Å; A96-I98 VanDerWaalsContact C-N 3.34Å; A96-I98 PolarHBondContact O-N 3.16Å; I98-D100 VanDerWaalsContact C-N 3.34Å; I98-M101 HydrophobicContact CG1-CE 4.42Å; I98-M101 PolarHBondContact O-N 3.11Å; I98-L102 HydrophobicContact CG2-CD1 3.99Å; I98-L102 HydrophobicContact CG2-CG 4.27Å; I98-L102 WeakPolarHBondContact O-CB 3.44Å; I98-L102 WeakPolarHBondContact O-CG 3.38Å; I98-L102 PolarHBondContact O-N 2.66Å |
| 99 | R | 87.4 | Confident | 87.5 | Confident | 35 Ų | 35 | 49.6 Ų | 49.6 | 13% | 0.132 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -59.4 | -47 | 172.3 | 168.5 | 170.7 | -174.8 | -99.3 | 1.8 | 111.1 | L95 A96 E97 M101 L102 L103 I189 D205 | L95-R99 VanDerWaalsContact O-CB 3.25Å; L95-R99 WeakPolarHBondContact O-CB 3.28Å; L95-R99 PolarHBondContact O-N 2.64Å; A96-R99 WeakPolarHBondContact O-CB 3.25Å; A96-R99 PolarHBondContact O-N 2.99Å; E97-R99 VanDerWaalsContact C-N 3.34Å; R99-M101 VanDerWaalsContact C-N 3.33Å; R99-M101 PolarHBondContact O-N 2.86Å; R99-L102 PolarHBondContact O-N 2.91Å; R99-L102 VanDerWaalsContact O-N 3.15Å; R99-L103 HydrophobicContact CG-CD1 3.86Å; R99-L103 HydrophobicContact CG-CG 4.39Å; R99-L103 WeakPolarHBondContact O-CB 3.4Å; R99-L103 WeakPolarHBondContact O-CG 3.42Å; R99-L103 PolarHBondContact O-N 2.79Å; R99-I189 HydrophobicContact CB-CD1 3.91Å; R99-I189 HydrophobicContact CG-CD1 3.68Å; R99-D205 IonicContact CZ-OD1 3.54Å; R99-D205 IonicContact CZ-OD2 2.66Å; R99-D205 IonicContact NH1-OD1 3.94Å; R99-D205 PolarHBondContact NH1-OD1 3.4Å; R99-D205 IonicContact NH1-OD2 2.64Å; R99-D205 IonicContact NH2-OD1 3.9Å; R99-D205 PolarHBondContact NH2-OD1 2.84Å; R99-D205 IonicContact NH2-OD2 3Å; R99-D205 PolarHBondContact NH2-OD2 2.73Å |
| 100 | D | 88.4 | Confident | 87 | Confident | 92 Ų | 92 | 51.2 Ų | 51.2 | 49% | 0.492 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -64.6 | -40.1 | 178.7 | -68.5 | -16.1 | 0 | 0 | 0 | 111.2 | A96 E97 I98 L102 L103 A104 | A96-D100 PolarHBondContact O-N 3.32Å; E97-D100 PolarHBondContact O-N 3.39Å; I98-D100 VanDerWaalsContact C-N 3.34Å; D100-L102 VanDerWaalsContact C-N 3.34Å; D100-L102 PolarHBondContact O-N 2.76Å; D100-L103 PolarHBondContact O-N 3.26Å; D100-A104 WeakPolarHBondContact O-CB 3.35Å; D100-A104 PolarHBondContact O-N 2.89Å |
| 101 | M | 87.4 | Confident | 86.5 | Confident | 47 Ų | 47 | 51.2 Ų | 51.2 | 23% | 0.232 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.5 | -38.2 | 172.8 | -75.5 | -177.1 | -108.1 | 0 | 0 | 112.9 | K50 E97 I98 R99 N105 | K50-M101 HydrophobicContact CD-CE 3.75Å; K50-M101 HydrophobicContact CD-SD 3.87Å; E97-M101 HydrophobicContact CB-CE 3.83Å; E97-M101 WeakPolarHBondContact O-CE 3.25Å; E97-M101 WeakPolarHBondContact O-CG 3.43Å; E97-M101 PolarHBondContact O-N 3.32Å; I98-M101 HydrophobicContact CG1-CE 4.42Å; I98-M101 PolarHBondContact O-N 3.11Å; R99-M101 VanDerWaalsContact C-N 3.33Å; R99-M101 PolarHBondContact O-N 2.86Å; M101-N105 PolarHBondContact O-N 2.95Å; M101-N105 PolarHBondContact O-ND2 2.84Å |
| 102 | L | 86.9 | Confident | 86.1 | Confident | 2 Ų | 2 | 59.1 Ų | 59.1 | 1% | 0.01 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -69.5 | -41.1 | 176.4 | -73.5 | 170.8 | 0 | 0 | 0 | 111.6 | V30 I43 L47 I98 R99 D100 L187 I189 | V30-L102 HydrophobicContact CG1-CD1 4.44Å; I43-L102 HydrophobicContact CG2-CD2 4.4Å; L47-L102 HydrophobicContact CD1-CD2 3.89Å; I98-L102 HydrophobicContact CG2-CD1 3.99Å; I98-L102 HydrophobicContact CG2-CG 4.27Å; I98-L102 WeakPolarHBondContact O-CB 3.44Å; I98-L102 WeakPolarHBondContact O-CG 3.38Å; I98-L102 PolarHBondContact O-N 2.66Å; R99-L102 PolarHBondContact O-N 2.91Å; R99-L102 VanDerWaalsContact O-N 3.15Å; D100-L102 VanDerWaalsContact C-N 3.34Å; D100-L102 PolarHBondContact O-N 2.76Å; L102-L187 HydrophobicContact CD2-CB 4.44Å; L102-L187 HydrophobicContact CD2-CD1 3.79Å; L102-I189 HydrophobicContact CB-CD1 4.45Å; L102-I189 HydrophobicContact CD1-CD1 4.04Å; L102-I189 HydrophobicContact CD1-CG1 4.13Å |
| 103 | L | 85.6 | Confident | 86.1 | Confident | 49 Ų | 49 | 56.2 Ų | 56.2 | 26% | 0.257 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -75.6 | -30.8 | 179.9 | -70 | 177 | 0 | 0 | 0 | 113.2 | R99 D100 N105 K106 | R99-L103 HydrophobicContact CG-CD1 3.86Å; R99-L103 HydrophobicContact CG-CG 4.39Å; R99-L103 WeakPolarHBondContact O-CB 3.4Å; R99-L103 WeakPolarHBondContact O-CG 3.42Å; R99-L103 PolarHBondContact O-N 2.79Å; D100-L103 PolarHBondContact O-N 3.26Å; L103-N105 VanDerWaalsContact C-N 3.32Å; L103-K106 VanDerWaalsContact O-CD 3.25Å; L103-K106 WeakPolarHBondContact O-CD 3.42Å; L103-K106 WeakPolarHBondContact O-CE 3.4Å; L103-K106 WeakPolarHBondContact O-CG 3.43Å |
| 104 | A | 86.8 | Confident | 85.9 | Confident | 81 Ų | 81 | 55.6 Ų | 55.6 | 67% | 0.669 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -68.2 | -33.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | D100 K106 | D100-A104 WeakPolarHBondContact O-CB 3.35Å; D100-A104 PolarHBondContact O-N 2.89Å; A104-K106 PolarHBondContact O-N 3.36Å |
| 105 | N | 82.6 | Confident | 85.9 | Confident | 59 Ų | 59 | 53.6 Ų | 53.6 | 32% | 0.316 | 32% | 0.32 | S | S | . | . | trans | -81.9 | 42 | 179.1 | -73.2 | -54.3 | 0 | 0 | 0 | 113.2 | I43 S46 M101 L103 | I43-N105 HydrophobicContact CG1-CB 4.22Å; S46-N105 PolarHBondContact OG-ND2 3.28Å; S46-N105 VanDerWaalsContact OG-ND2 3.14Å; M101-N105 PolarHBondContact O-N 2.95Å; M101-N105 PolarHBondContact O-ND2 2.84Å; L103-N105 VanDerWaalsContact C-N 3.32Å | ||
| 106 | K | 83.9 | Confident | 86 | Confident | 96 Ų | 96 | 58.4 Ų | 58.4 | 42% | 0.417 | 35% | 0.345 | S | S | . | . | P | Polyproline II helix | trans | -80.5 | 130.7 | 169.8 | -77.4 | 170.5 | -172.7 | 179.6 | 0 | 109.4 | L103 A104 | L103-K106 VanDerWaalsContact O-CD 3.25Å; L103-K106 WeakPolarHBondContact O-CD 3.42Å; L103-K106 WeakPolarHBondContact O-CE 3.4Å; L103-K106 WeakPolarHBondContact O-CG 3.43Å; A104-K106 PolarHBondContact O-N 3.36Å |
| 107 | V | 83.6 | Confident | 86 | Confident | 60 Ų | 60 | 56.7 Ų | 56.7 | 36% | 0.364 | 33% | 0.33 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.1 | 128 | 177.2 | 174.2 | 0 | 0 | 0 | 0 | 108.6 | Q39 A109 S184 F185 | Q39-V107 HydrophobicContact CB-CG2 4.23Å; Q39-V107 VanDerWaalsContact CD-CG2 3.46Å; Q39-V107 HydrophobicContact CG-CB 4.34Å; Q39-V107 HydrophobicContact CG-CG2 3.59Å; V107-A109 PolarHBondContact O-N 3.44Å; V107-S184 WeakPolarHBondContact O-CA 3.45Å; V107-F185 PolarHBondContact N-O 2.94Å; V107-F185 PolarHBondContact O-N 2.87Å |
| 108 | P | 84.2 | Confident | 85.9 | Confident | 84 Ų | 84 | 55.7 Ų | 55.7 | 55% | 0.545 | 33% | 0.332 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.5 | 129.6 | 170.6 | 25.9 | -32.4 | 0 | 0 | 0 | 109.1 | S181 | P108-S181 WeakPolarHBondContact CB-OG 3.32Å |
| 109 | A | 82.3 | Confident | 85.8 | Confident | 23 Ų | 23 | 59.2 Ų | 59.2 | 19% | 0.19 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.7 | 134.4 | -176.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | V107 F183 F185 | V107-A109 PolarHBondContact O-N 3.44Å; A109-F183 PolarHBondContact N-O 3.32Å; A109-F183 PolarHBondContact O-N 2.91Å; A109-F183 VanDerWaalsContact O-O 3.05Å; A109-F185 HydrophobicContact CB-CD2 3.3Å; A109-F185 HydrophobicContact CB-CE2 3.77Å; A109-F185 HydrophobicContact CB-CG 4.36Å |
| 110 | A | 82.6 | Confident | 85.9 | Confident | 34 Ų | 34 | 61.4 Ų | 61.4 | 28% | 0.281 | 37% | 0.37 | S | S | . | . | P | Polyproline II helix | trans | -70.7 | 149.1 | 174 | 0 | 0 | 0 | 0 | 0 | 111.3 | R112 N176 | A110-R112 PolarHBondContact O-N 3.37Å; A110-N176 WeakPolarHBondContact CB-OD1 3.2Å |
| 111 | A | 84.9 | Confident | 85.9 | Confident | 2 Ų | 2 | 57.1 Ų | 57.1 | 2% | 0.017 | 35% | 0.347 | C | S | . | . | P | Polyproline II helix | trans | -62 | 126.8 | 175 | 0 | 0 | 0 | 0 | 0 | 109.8 | V167 A172 L175 P182 F183 | A111-V167 HydrophobicContact CB-CG1 3.95Å; A111-V167 HydrophobicContact CB-CG2 4.28Å; A111-A172 WeakPolarHBondContact O-CB 3.32Å; A111-L175 HydrophobicContact CB-CD1 3.94Å; A111-P182 HydrophobicContact CB-CG 4.25Å; A111-F183 HydrophobicContact CB-CD2 4.09Å; A111-F183 HydrophobicContact CB-CE2 3.52Å; A111-F183 HydrophobicContact CB-CZ 4.25Å |
| 112 | R | 84.3 | Confident | 86 | Confident | 166 Ų | 166 | 58.4 Ų | 58.4 | 63% | 0.626 | 36% | 0.358 | S | S | * | . | P | Polyproline II helix | trans | -94 | 139.2 | 175.6 | -67.3 | -175.9 | -177.8 | 174.4 | 2.6 | 109.5 | A110 G114 A115 | A110-R112 PolarHBondContact O-N 3.37Å; R112-G114 PolarHBondContact O-N 3.32Å; R112-A115 HydrophobicContact CB-CB 4.24Å; R112-A115 VanDerWaalsContact O-CB 3.23Å; R112-A115 WeakPolarHBondContact O-CB 3.48Å; R112-A115 PolarHBondContact O-N 2.65Å |
| 113 | A | 88.8 | Confident | 86.2 | Confident | 63 Ų | 63 | 58.3 Ų | 58.3 | 52% | 0.521 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.5 | 131.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | A115 A169 A172 | A113-A115 VanDerWaalsContact C-N 3.25Å; A113-A115 PolarHBondContact O-N 2.92Å; A113-A169 HydrophobicContact CB-CB 4.07Å; A113-A172 HydrophobicContact CB-CB 4.39Å |
| 114 | G | 86.1 | Confident | 86.4 | Confident | 52 Ų | 52 | 59 Ų | 59 | 54% | 0.536 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 77.9 | -1.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | R112 V167 | R112-G114 PolarHBondContact O-N 3.32Å; G114-V167 PolarHBondContact N-O 2.88Å |
| 115 | A | 86.8 | Confident | 86.6 | Confident | 35 Ų | 35 | 57 Ų | 57 | 29% | 0.289 | 35% | 0.348 | S | S | . | . | P | Polyproline II helix | trans | -72.7 | 151.6 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.6 | R112 A113 K166 V167 | R112-A115 HydrophobicContact CB-CB 4.24Å; R112-A115 VanDerWaalsContact O-CB 3.23Å; R112-A115 WeakPolarHBondContact O-CB 3.48Å; R112-A115 PolarHBondContact O-N 2.65Å; A113-A115 VanDerWaalsContact C-N 3.25Å; A113-A115 PolarHBondContact O-N 2.92Å; A115-K166 WeakPolarHBondContact O-CA 3.04Å; A115-V167 WeakPolarHBondContact O-CG2 3.43Å; A115-V167 PolarHBondContact O-N 2.94Å |
| 116 | I | 89.1 | Confident | 86.9 | Confident | 113 Ų | 113 | 60.2 Ų | 60.2 | 58% | 0.579 | 36% | 0.362 | S | S | * | . | B | Isolated β-bridge | trans | -82.1 | 130.3 | 172.6 | -61.1 | 171.2 | 0 | 0 | 0 | 107.8 | P118 | I116-P118 VanDerWaalsContact O-CD 3.28Å; I116-P118 WeakPolarHBondContact O-CD 3.32Å |
| 117 | A | 87.6 | Confident | 87.2 | Confident | 2 Ų | 2 | 58.8 Ų | 58.8 | 2% | 0.017 | 36% | 0.358 | C | S | . | . | P | Polyproline II helix | trans | -72.6 | 120.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | I161 G164 D165 V167 F183 | A117-I161 HydrophobicContact CB-CG2 3.59Å; A117-G164 PolarHBondContact O-N 3.27Å; A117-D165 PolarHBondContact N-O 3.49Å; A117-V167 HydrophobicContact CB-CG2 4.46Å; A117-F183 HydrophobicContact CB-CE1 4.29Å; A117-F183 HydrophobicContact CB-CZ 3.83Å |
| 118 | P | 86.3 | Confident | 87.4 | Confident | 74 Ų | 74 | 57.3 Ų | 57.3 | 48% | 0.481 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -78.6 | -26.6 | 175.6 | 30.6 | -36 | 0 | 0 | 0 | 113.4 | I116 F183 | I116-P118 VanDerWaalsContact O-CD 3.28Å; I116-P118 WeakPolarHBondContact O-CD 3.32Å; P118-F183 HydrophobicContact CG-CD1 3.68Å; P118-F183 HydrophobicContact CG-CE1 4.06Å; P118-F183 HydrophobicContact CG-CG 4.03Å |
| 119 | C | 86.4 | Confident | 87.5 | Confident | 75 Ų | 75 | 56 Ų | 56 | 51% | 0.507 | 35% | 0.352 | S | S | . | . | S | Bend | trans | -134.4 | 160.9 | -178.9 | -59.5 | 0 | 0 | 0 | 0 | 109.9 | ||
| 120 | D | 90 | Very high | 87.8 | Confident | 80 Ų | 80 | 56.4 Ų | 56.4 | 43% | 0.428 | 35% | 0.351 | S | S | . | . | trans | -62 | 137.2 | 171.8 | -66.5 | -40.8 | 0 | 0 | 0 | 111.4 | M159 I161 K162 P163 | D120-M159 HydrophobicContact CB-CE 4.27Å; D120-I161 WeakPolarHBondContact CA-O 3.44Å; D120-K162 WeakPolarHBondContact OD1-CA 3.3Å; D120-P163 WeakPolarHBondContact OD1-CD 3.44Å; D120-P163 VanDerWaalsContact OD1-CG 3.28Å; D120-P163 WeakPolarHBondContact OD1-CG 3.18Å | ||
| 121 | V | 89 | Confident | 88 | Confident | 2 Ų | 2 | 56.5 Ų | 56.5 | 1% | 0.012 | 36% | 0.355 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 114.9 | 177.8 | -174.8 | 0 | 0 | 0 | 0 | 109.7 | L160 I161 L175 P182 F183 | V121-L160 PolarHBondContact O-N 2.91Å; V121-I161 HydrophobicContact CB-CB 4.17Å; V121-I161 HydrophobicContact CB-CG1 4.37Å; V121-I161 HydrophobicContact CG2-CB 4.24Å; V121-I161 HydrophobicContact CG2-CD1 4.44Å; V121-I161 PolarHBondContact N-O 3.44Å; V121-L175 HydrophobicContact CG1-CD1 3.85Å; V121-L175 HydrophobicContact CG1-CD2 3.77Å; V121-L175 HydrophobicContact CG1-CG 4.48Å; V121-P182 HydrophobicContact CB-CB 4.3Å; V121-P182 HydrophobicContact CG1-CB 3.77Å; V121-P182 HydrophobicContact CG1-CG 3.91Å; V121-P182 HydrophobicContact CG2-CB 3.75Å; V121-P182 HydrophobicContact CG2-CG 3.85Å; V121-F183 HydrophobicContact CG2-CE1 3.54Å; V121-F183 HydrophobicContact CG2-CZ 3.71Å |
| 122 | T | 89.1 | Confident | 88.1 | Confident | 74 Ų | 74 | 59.5 Ų | 59.5 | 45% | 0.454 | 37% | 0.374 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 143.9 | 176 | 60.5 | 0 | 0 | 0 | 0 | 110.7 | M159 | T122-M159 HydrophobicContact CG2-CB 4.33Å; T122-M159 HydrophobicContact CG2-CE 4.18Å; T122-M159 HydrophobicContact CG2-CG 3.83Å |
| 123 | V | 89.5 | Confident | 88.3 | Confident | 1 Ų | 1 | 60 Ų | 60 | 1% | 0.006 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.5 | 121.8 | 171.2 | 178.7 | 0 | 0 | 0 | 0 | 108.3 | I154 D157 V158 L160 L174 L175 L178 I180 | V123-I154 HydrophobicContact CG1-CD1 3.41Å; V123-I154 VanDerWaalsContact CG1-CD1 3.41Å; V123-D157 WeakPolarHBondContact O-CA 3.23Å; V123-V158 PolarHBondContact N-O 3.34Å; V123-V158 PolarHBondContact O-N 3.15Å; V123-L160 HydrophobicContact CG2-CD1 3.36Å; V123-L160 HydrophobicContact CG2-CG 3.9Å; V123-L174 HydrophobicContact CG2-CD2 4.35Å; V123-L175 HydrophobicContact CG2-CD2 4.04Å; V123-L178 HydrophobicContact CG1-CD1 3.72Å; V123-I180 HydrophobicContact CG1-CD1 4.28Å; V123-I180 HydrophobicContact CG2-CD1 4.48Å |
| 124 | P | 90.1 | Very high | 88.1 | Confident | 62 Ų | 62 | 61.3 Ų | 61.3 | 40% | 0.403 | 38% | 0.377 | S | S | . | . | trans | -76.3 | 154.7 | -179.6 | 31.1 | -34.6 | 0 | 0 | 0 | 112.2 | Q126 D157 | P124-Q126 PolarHBondContact O-N 3.17Å; P124-Q126 VanDerWaalsContact O-N 3.11Å; P124-D157 VanDerWaalsContact CA-OD1 3.29Å; P124-D157 WeakPolarHBondContact CA-OD1 3.3Å | ||
| 125 | A | 91.3 | Very high | 88.1 | Confident | 40 Ų | 40 | 60.4 Ų | 60.4 | 33% | 0.331 | 36% | 0.362 | S | S | . | . | S | Bend | trans | -65.5 | 104.7 | 169.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | I154 D157 | A125-I154 WeakPolarHBondContact CA-O 3.39Å; A125-D157 WeakPolarHBondContact CB-OD1 3.47Å; A125-D157 PolarHBondContact N-OD1 3.02Å |
| 126 | Q | 89.8 | Confident | 88.2 | Confident | 127 Ų | 127 | 62.4 Ų | 62.4 | 59% | 0.593 | 37% | 0.373 | S | S | * | . | trans | -155.2 | 154.1 | -177.1 | -172.7 | 56.4 | 41.8 | 0 | 0 | 110.5 | P124 T128 I154 | P124-Q126 PolarHBondContact O-N 3.17Å; P124-Q126 VanDerWaalsContact O-N 3.11Å; Q126-T128 PolarHBondContact O-N 3.4Å; Q126-I154 PolarHBondContact O-N 3.4Å | ||
| 127 | N | 90.4 | Very high | 88 | Confident | 65 Ų | 65 | 60.2 Ų | 60.2 | 35% | 0.348 | 36% | 0.36 | S | S | . | . | B | Isolated β-bridge | trans | -71 | 121.7 | 167.5 | -171.2 | -4.7 | 0 | 0 | 0 | 110 | G129 T151 I152 E153 | N127-G129 PolarHBondContact OD1-N 3.31Å; N127-T151 PolarHBondContact ND2-OG1 2.9Å; N127-T151 WeakPolarHBondContact OD1-CB 3.37Å; N127-T151 PolarHBondContact OD1-OG1 3.09Å; N127-I152 PolarHBondContact OD1-O 3.47Å; N127-I152 VanDerWaalsContact OD1-O 3.14Å; N127-E153 HydrophobicContact CB-CG 4.42Å |
| 128 | T | 86.6 | Confident | 88.1 | Confident | 29 Ų | 29 | 60.3 Ų | 60.3 | 18% | 0.178 | 36% | 0.36 | C | S | . | . | trans | -80.7 | -16.9 | -174.1 | 65.9 | 0 | 0 | 0 | 0 | 113.4 | Q126 L130 F138 I152 I154 L178 | Q126-T128 PolarHBondContact O-N 3.4Å; T128-L130 PolarHBondContact O-N 2.9Å; T128-L130 VanDerWaalsContact O-N 3.14Å; T128-L130 PolarHBondContact OG1-N 3.44Å; T128-F138 HydrophobicContact CG2-CE1 4.34Å; T128-F138 HydrophobicContact CG2-CZ 4.25Å; T128-I152 WeakPolarHBondContact CB-O 3.29Å; T128-I152 PolarHBondContact N-O 2.85Å; T128-I152 PolarHBondContact OG1-O 3.09Å; T128-I154 HydrophobicContact CG2-CD1 3.83Å; T128-I154 HydrophobicContact CG2-CG1 3.88Å; T128-L178 HydrophobicContact CG2-CD2 3.48Å; T128-L178 VanDerWaalsContact CG2-CD2 3.48Å | ||
| 129 | G | 86.8 | Confident | 88.1 | Confident | 57 Ų | 57 | 63.2 Ų | 63.2 | 59% | 0.588 | 37% | 0.367 | S | S | * | . | trans | 67.8 | 4.5 | -174.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | N127 | N127-G129 PolarHBondContact OD1-N 3.31Š| ||
| 130 | L | 88.2 | Confident | 88.2 | Confident | 32 Ų | 32 | 63.8 Ų | 63.8 | 17% | 0.168 | 38% | 0.377 | C | S | . | . | trans | -82.9 | 142.8 | 176.5 | -65.9 | 167.2 | 0 | 0 | 0 | 110.4 | T128 F138 T151 I152 M177 L178 | T128-L130 PolarHBondContact O-N 2.9Å; T128-L130 VanDerWaalsContact O-N 3.14Å; T128-L130 PolarHBondContact OG1-N 3.44Å; L130-F138 HydrophobicContact CD1-CE2 3.97Å; L130-F138 HydrophobicContact CD1-CZ 3.75Å; L130-T151 WeakPolarHBondContact O-CA 3.49Å; L130-I152 HydrophobicContact CB-CD1 4.35Å; L130-I152 PolarHBondContact O-N 3.04Å; L130-M177 HydrophobicContact CD1-CB 4.43Å; L130-L178 HydrophobicContact CD1-CD2 4.27Å | ||
| 131 | G | 88 | Confident | 88 | Confident | 36 Ų | 36 | 61.6 Ų | 61.6 | 37% | 0.371 | 37% | 0.365 | S | S | . | . | trans | -69.6 | 165.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E133 I152 | G131-E133 PolarHBondContact O-N 3.32Å; G131-E133 VanDerWaalsContact O-N 3.11Å; G131-I152 VanDerWaalsContact O-CD1 3.29Å; G131-I152 WeakPolarHBondContact O-CD1 3.49Å | ||
| 132 | P | 87.3 | Confident | 87.8 | Confident | 65 Ų | 65 | 64.2 Ų | 64.2 | 42% | 0.422 | 39% | 0.393 | S | S | . | . | G | 310 helix | trans | -67.7 | -14.3 | -171 | 27.9 | -35.6 | 0 | 0 | 0 | 114.4 | K134 T135 I147 | P132-K134 PolarHBondContact O-N 3.43Å; P132-T135 WeakPolarHBondContact O-CB 2.99Å; P132-T135 VanDerWaalsContact O-CG2 3.26Å; P132-T135 WeakPolarHBondContact O-CG2 3.33Å; P132-T135 PolarHBondContact O-N 2.93Å; P132-T135 PolarHBondContact O-OG1 3.31Å; P132-I147 HydrophobicContact CB-CD1 4.23Å |
| 133 | E | 87.8 | Confident | 87.9 | Confident | 177 Ų | 177 | 60.9 Ų | 60.9 | 83% | 0.827 | 37% | 0.372 | S | S | * | . | G | 310 helix | trans | -58.5 | -30.7 | -179.8 | -62.8 | -179.3 | 173.1 | 0 | 0 | 113.3 | G131 | G131-E133 PolarHBondContact O-N 3.32Å; G131-E133 VanDerWaalsContact O-N 3.11Å |
| 134 | K | 83.8 | Confident | 87.9 | Confident | 89 Ų | 89 | 64.3 Ų | 64.3 | 39% | 0.387 | 39% | 0.393 | S | S | . | . | G | 310 helix | trans | -98.2 | 10.3 | -174.2 | -62.8 | -176.2 | 178.9 | 179.9 | 0 | 113.8 | P132 S136 F137 F138 I152 M177 | P132-K134 PolarHBondContact O-N 3.43Å; K134-S136 VanDerWaalsContact C-N 3.3Å; K134-S136 PolarHBondContact O-N 3.18Å; K134-F137 VanDerWaalsContact O-CB 3.27Å; K134-F137 WeakPolarHBondContact O-CB 3.26Å; K134-F137 PolarHBondContact O-N 2.92Å; K134-F137 VanDerWaalsContact O-N 3.12Å; K134-F138 WeakPolarHBondContact O-CD2 3.46Å; K134-I152 HydrophobicContact CB-CD1 4.49Å; K134-M177 HydrophobicContact CD-SD 3.95Å; K134-M177 PolarHBondContact NZ-SD 3.36Å; K134-M177 VanDerWaalsContact NZ-SD 3.35Å |
| 135 | T | 86.6 | Confident | 87.9 | Confident | 34 Ų | 34 | 62.8 Ų | 62.8 | 21% | 0.209 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -60 | -36.4 | -179.1 | 46.2 | 0 | 0 | 0 | 0 | 113.4 | P132 F137 F138 Q139 I147 I152 | P132-T135 WeakPolarHBondContact O-CB 2.99Å; P132-T135 VanDerWaalsContact O-CG2 3.26Å; P132-T135 WeakPolarHBondContact O-CG2 3.33Å; P132-T135 PolarHBondContact O-N 2.93Å; P132-T135 PolarHBondContact O-OG1 3.31Å; T135-F137 PolarHBondContact O-N 3.36Å; T135-F138 PolarHBondContact O-N 2.94Å; T135-Q139 PolarHBondContact O-N 3.46Å; T135-I147 HydrophobicContact CG2-CD1 4.07Å; T135-I147 HydrophobicContact CG2-CG1 4.04Å; T135-I152 HydrophobicContact CG2-CD1 3.55Å; T135-I152 HydrophobicContact CG2-CG1 3.64Å |
| 136 | S | 88.7 | Confident | 87.9 | Confident | 76 Ų | 76 | 67.2 Ų | 67.2 | 53% | 0.531 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -59 | -29.6 | 176.8 | 57.3 | 0 | 0 | 0 | 0 | 112.9 | K134 A140 | K134-S136 VanDerWaalsContact C-N 3.3Å; K134-S136 PolarHBondContact O-N 3.18Å; S136-A140 WeakPolarHBondContact O-CB 3.5Å; S136-A140 PolarHBondContact O-N 3.34Å |
| 137 | F | 85.7 | Confident | 88 | Confident | 67 Ų | 67 | 65.7 Ų | 65.7 | 29% | 0.294 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -71 | -40.7 | -178.9 | -159.3 | -108.9 | 0 | 0 | 0 | 112.6 | K134 T135 A140 L141 S170 T173 L174 | K134-F137 VanDerWaalsContact O-CB 3.27Å; K134-F137 WeakPolarHBondContact O-CB 3.26Å; K134-F137 PolarHBondContact O-N 2.92Å; K134-F137 VanDerWaalsContact O-N 3.12Å; T135-F137 PolarHBondContact O-N 3.36Å; F137-A140 PolarHBondContact O-N 2.86Å; F137-L141 HydrophobicContact CD1-CD1 4.32Å; F137-L141 HydrophobicContact CE1-CD1 4.22Å; F137-L141 PolarHBondContact O-N 3.15Å; F137-S170 VanDerWaalsContact CE1-O 3.24Å; F137-S170 WeakPolarHBondContact CE1-O 3.14Å; F137-S170 VanDerWaalsContact CZ-O 3.31Å; F137-S170 WeakPolarHBondContact CZ-O 3.41Å; F137-T173 WeakPolarHBondContact CZ-OG1 3.34Å; F137-L174 HydrophobicContact CD1-CB 4.36Å; F137-L174 HydrophobicContact CD1-CD1 4.35Å; F137-L174 HydrophobicContact CE1-CB 3.88Å |
| 138 | F | 88.4 | Confident | 87.9 | Confident | 5 Ų | 5 | 63.9 Ų | 63.9 | 2% | 0.022 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -68.1 | -38.2 | 176.2 | -69.9 | -88 | 0 | 0 | 0 | 111.4 | T128 L130 K134 T135 L141 G142 I143 T145 I152 I154 L174 L178 | T128-F138 HydrophobicContact CG2-CE1 4.34Å; T128-F138 HydrophobicContact CG2-CZ 4.25Å; L130-F138 HydrophobicContact CD1-CE2 3.97Å; L130-F138 HydrophobicContact CD1-CZ 3.75Å; K134-F138 WeakPolarHBondContact O-CD2 3.46Å; T135-F138 PolarHBondContact O-N 2.94Å; F138-L141 PolarHBondContact O-N 2.97Å; F138-G142 PolarHBondContact O-N 3.29Å; F138-I143 HydrophobicContact CB-CB 4.43Å; F138-I143 HydrophobicContact CD1-CD1 4.08Å; F138-I143 HydrophobicContact CD1-CG2 4.47Å; F138-I143 PolarHBondContact O-N 3.35Å; F138-T145 HydrophobicContact CB-CG2 3.74Å; F138-T145 HydrophobicContact CD1-CG2 3.97Å; F138-T145 HydrophobicContact CG-CG2 3.92Å; F138-I152 HydrophobicContact CD2-CD1 4.04Å; F138-I152 HydrophobicContact CD2-CG2 4.28Å; F138-I152 HydrophobicContact CE2-CD1 3.93Å; F138-I152 HydrophobicContact CE2-CG2 4.43Å; F138-I154 HydrophobicContact CE1-CD1 4.4Å; F138-L174 HydrophobicContact CD1-CD1 3.67Å; F138-L174 HydrophobicContact CE1-CD1 3.59Å; F138-L174 HydrophobicContact CE1-CD2 4.45Å; F138-L174 HydrophobicContact CE1-CG 4.02Å; F138-L174 HydrophobicContact CG-CD1 4.43Å; F138-L174 HydrophobicContact CZ-CD1 4.3Å; F138-L174 HydrophobicContact CZ-CG 4.46Å; F138-L178 HydrophobicContact CE1-CD1 4.48Å; F138-L178 HydrophobicContact CE1-CD2 4.48Å; F138-L178 HydrophobicContact CZ-CD2 4.32Å |
| 139 | Q | 87.3 | Confident | 87.9 | Confident | 134 Ų | 134 | 74.7 Ų | 74.7 | 63% | 0.626 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -66.6 | -39.8 | 176.8 | -68.2 | 177.4 | -9.8 | 0 | 0 | 112.3 | T135 L141 G142 | T135-Q139 PolarHBondContact O-N 3.46Å; Q139-L141 PolarHBondContact O-N 2.98Å; Q139-G142 PolarHBondContact O-N 2.98Å |
| 140 | A | 87.6 | Confident | 87.9 | Confident | 87 Ų | 87 | 74.1 Ų | 74.1 | 72% | 0.719 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -62.2 | -27.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | S136 F137 G142 | S136-A140 WeakPolarHBondContact O-CB 3.5Å; S136-A140 PolarHBondContact O-N 3.34Å; F137-A140 PolarHBondContact O-N 2.86Å; A140-G142 VanDerWaalsContact C-N 3.35Å |
| 141 | L | 86.2 | Confident | 88 | Confident | 35 Ų | 35 | 74.2 Ų | 74.2 | 18% | 0.183 | 42% | 0.415 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | 5.7 | 176.6 | -67.6 | 171.5 | 0 | 0 | 0 | 113.1 | F137 F138 Q139 I143 E171 L174 | F137-L141 HydrophobicContact CD1-CD1 4.32Å; F137-L141 HydrophobicContact CE1-CD1 4.22Å; F137-L141 PolarHBondContact O-N 3.15Å; F138-L141 PolarHBondContact O-N 2.97Å; Q139-L141 PolarHBondContact O-N 2.98Å; L141-I143 VanDerWaalsContact C-N 3.26Å; L141-I143 HydrophobicContact CB-CD1 4.21Å; L141-I143 HydrophobicContact CB-CG1 4.21Å; L141-I143 PolarHBondContact O-N 2.98Å; L141-E171 HydrophobicContact CD2-CG 3.72Å; L141-L174 HydrophobicContact CD1-CB 4.13Å; L141-L174 HydrophobicContact CD1-CD1 3.43Å; L141-L174 VanDerWaalsContact CD1-CD1 3.43Å; L141-L174 HydrophobicContact CD1-CG 4.41Å |
| 142 | G | 85.9 | Confident | 88.1 | Confident | 57 Ų | 57 | 72.5 Ų | 72.5 | 59% | 0.588 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.2 | 16.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | F138 Q139 A140 | F138-G142 PolarHBondContact O-N 3.29Å; Q139-G142 PolarHBondContact O-N 2.98Å; A140-G142 VanDerWaalsContact C-N 3.35Å |
| 143 | I | 89.6 | Confident | 88.3 | Confident | 3 Ų | 3 | 73 Ų | 73 | 2% | 0.015 | 39% | 0.394 | C | S | . | . | trans | -87 | 119.3 | 178.7 | -53.6 | 171 | 0 | 0 | 0 | 109 | F138 L141 T145 I154 L160 L174 | F138-I143 HydrophobicContact CB-CB 4.43Å; F138-I143 HydrophobicContact CD1-CD1 4.08Å; F138-I143 HydrophobicContact CD1-CG2 4.47Å; F138-I143 PolarHBondContact O-N 3.35Å; L141-I143 VanDerWaalsContact C-N 3.26Å; L141-I143 HydrophobicContact CB-CD1 4.21Å; L141-I143 HydrophobicContact CB-CG1 4.21Å; L141-I143 PolarHBondContact O-N 2.98Å; I143-T145 HydrophobicContact CG2-CG2 4.06Å; I143-T145 PolarHBondContact O-N 3.01Å; I143-I154 HydrophobicContact CG2-CG1 4.36Å; I143-I154 HydrophobicContact CG2-CG2 3.93Å; I143-L160 HydrophobicContact CD1-CD1 4.43Å; I143-L160 HydrophobicContact CD1-CD2 3.77Å; I143-L160 HydrophobicContact CG1-CD2 3.86Å; I143-L174 HydrophobicContact CD1-CD1 3.59Å | ||
| 144 | T | 90.1 | Very high | 88.5 | Confident | 74 Ų | 74 | 64.8 Ų | 64.8 | 45% | 0.454 | 36% | 0.356 | S | S | . | . | trans | -72.3 | 111.9 | 176.6 | 52.1 | 0 | 0 | 0 | 0 | 110.7 | L155 | T144-L155 PolarHBondContact O-N 3.35Š| ||
| 145 | T | 90.4 | Very high | 88.8 | Confident | 30 Ų | 30 | 65.5 Ų | 65.5 | 18% | 0.184 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.3 | 150.5 | -178.8 | 51.9 | 0 | 0 | 0 | 0 | 111.7 | F138 I143 I152 E153 I154 | F138-T145 HydrophobicContact CB-CG2 3.74Å; F138-T145 HydrophobicContact CD1-CG2 3.97Å; F138-T145 HydrophobicContact CG-CG2 3.92Å; I143-T145 HydrophobicContact CG2-CG2 4.06Å; I143-T145 PolarHBondContact O-N 3.01Å; T145-I152 HydrophobicContact CG2-CG2 3.77Å; T145-E153 CarbonylContact C-O 3.53Å; T145-E153 VanDerWaalsContact CA-O 3.24Å; T145-E153 WeakPolarHBondContact CA-O 3.21Å; T145-I154 HydrophobicContact CG2-CG1 3.96Å |
| 146 | K | 90.6 | Very high | 88.9 | Confident | 133 Ų | 133 | 66.5 Ų | 66.5 | 58% | 0.578 | 37% | 0.372 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -127.3 | 143 | 175 | -173 | 176.4 | 179.9 | -179.5 | 0 | 109.3 | S148 E153 L155 | K146-S148 PolarHBondContact O-N 3.1Å; K146-E153 PolarHBondContact N-O 3.43Å; K146-E153 PolarHBondContact O-N 2.92Å; K146-L155 HydrophobicContact CB-CD1 4.39Å; K146-L155 HydrophobicContact CB-CD2 4Å; K146-L155 HydrophobicContact CB-CG 4.27Å; K146-L155 HydrophobicContact CD-CD2 4.44Å |
| 147 | I | 91.4 | Very high | 89 | Confident | 94 Ų | 94 | 68.3 Ų | 68.3 | 48% | 0.482 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 113.4 | 173.7 | -56.1 | 171.3 | 0 | 0 | 0 | 107.7 | P132 T135 T151 | P132-I147 HydrophobicContact CB-CD1 4.23Å; T135-I147 HydrophobicContact CG2-CD1 4.07Å; T135-I147 HydrophobicContact CG2-CG1 4.04Å; I147-T151 WeakPolarHBondContact CA-O 3.38Å |
| 148 | S | 88.3 | Confident | 89.1 | Confident | 27 Ų | 27 | 66.9 Ų | 66.9 | 19% | 0.189 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 125.3 | 172.9 | 63.1 | 0 | 0 | 0 | 0 | 109 | K146 G150 T151 E153 | K146-S148 PolarHBondContact O-N 3.1Å; S148-G150 PolarHBondContact O-N 3.1Å; S148-T151 PolarHBondContact N-O 3.38Å; S148-T151 PolarHBondContact O-N 3.37Å; S148-T151 VanDerWaalsContact O-O 3.05Å; S148-T151 PolarHBondContact O-OG1 3.4Å; S148-E153 WeakPolarHBondContact CB-OE2 3.21Å; S148-E153 PolarHBondContact OG-OE2 3.5Å |
| 149 | R | 86.6 | Confident | 89.1 | Confident | 257 Ų | 257 | 72.3 Ų | 72.3 | 97% | 0.97 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.4 | 34 | 177 | -56.9 | -179.5 | 178.4 | 174 | 0.3 | 114.8 | T151 | R149-T151 VanDerWaalsContact C-N 3.33Š|
| 150 | G | 87.6 | Confident | 89 | Confident | 44 Ų | 44 | 67.3 Ų | 67.3 | 45% | 0.454 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 83.1 | 3 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | S148 | S148-G150 PolarHBondContact O-N 3.1Š|
| 151 | T | 90.4 | Very high | 89 | Confident | 35 Ų | 35 | 63.3 Ų | 63.3 | 22% | 0.215 | 34% | 0.343 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.7 | 154.1 | 174.6 | 48.6 | 0 | 0 | 0 | 0 | 111.5 | N127 L130 I147 S148 R149 | N127-T151 PolarHBondContact ND2-OG1 2.9Å; N127-T151 WeakPolarHBondContact OD1-CB 3.37Å; N127-T151 PolarHBondContact OD1-OG1 3.09Å; L130-T151 WeakPolarHBondContact O-CA 3.49Å; I147-T151 WeakPolarHBondContact CA-O 3.38Å; S148-T151 PolarHBondContact N-O 3.38Å; S148-T151 PolarHBondContact O-N 3.37Å; S148-T151 VanDerWaalsContact O-O 3.05Å; S148-T151 PolarHBondContact O-OG1 3.4Å; R149-T151 VanDerWaalsContact C-N 3.33Å |
| 152 | I | 90.4 | Very high | 89.2 | Confident | 0 Ų | 0 | 68.1 Ų | 68.1 | 0% | 0 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.2 | 124.9 | 178 | -54.2 | 172 | 0 | 0 | 0 | 110.1 | N127 T128 L130 G131 K134 T135 F138 T145 | N127-I152 PolarHBondContact OD1-O 3.47Å; N127-I152 VanDerWaalsContact OD1-O 3.14Å; T128-I152 WeakPolarHBondContact CB-O 3.29Å; T128-I152 PolarHBondContact N-O 2.85Å; T128-I152 PolarHBondContact OG1-O 3.09Å; L130-I152 HydrophobicContact CB-CD1 4.35Å; L130-I152 PolarHBondContact O-N 3.04Å; G131-I152 VanDerWaalsContact O-CD1 3.29Å; G131-I152 WeakPolarHBondContact O-CD1 3.49Å; K134-I152 HydrophobicContact CB-CD1 4.49Å; T135-I152 HydrophobicContact CG2-CD1 3.55Å; T135-I152 HydrophobicContact CG2-CG1 3.64Å; F138-I152 HydrophobicContact CD2-CD1 4.04Å; F138-I152 HydrophobicContact CD2-CG2 4.28Å; F138-I152 HydrophobicContact CE2-CD1 3.93Å; F138-I152 HydrophobicContact CE2-CG2 4.43Å; T145-I152 HydrophobicContact CG2-CG2 3.77Å |
| 153 | E | 90.7 | Very high | 89.4 | Confident | 74 Ų | 74 | 69 Ų | 69 | 35% | 0.346 | 36% | 0.358 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.2 | 132.5 | 176.8 | -173.5 | 174.1 | -169.3 | 0 | 0 | 111 | N127 T145 K146 S148 | N127-E153 HydrophobicContact CB-CG 4.42Å; T145-E153 CarbonylContact C-O 3.53Å; T145-E153 VanDerWaalsContact CA-O 3.24Å; T145-E153 WeakPolarHBondContact CA-O 3.21Å; K146-E153 PolarHBondContact N-O 3.43Å; K146-E153 PolarHBondContact O-N 2.92Å; S148-E153 WeakPolarHBondContact CB-OE2 3.21Å; S148-E153 PolarHBondContact OG-OE2 3.5Å |
| 154 | I | 91.6 | Very high | 89.3 | Confident | 5 Ų | 5 | 71.2 Ų | 71.2 | 3% | 0.026 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 126.2 | 176.7 | -58.9 | 174.2 | 0 | 0 | 0 | 108.2 | V123 A125 Q126 T128 F138 I143 T145 S156 L178 | V123-I154 HydrophobicContact CG1-CD1 3.41Å; V123-I154 VanDerWaalsContact CG1-CD1 3.41Å; A125-I154 WeakPolarHBondContact CA-O 3.39Å; Q126-I154 PolarHBondContact O-N 3.4Å; T128-I154 HydrophobicContact CG2-CD1 3.83Å; T128-I154 HydrophobicContact CG2-CG1 3.88Å; F138-I154 HydrophobicContact CE1-CD1 4.4Å; I143-I154 HydrophobicContact CG2-CG1 4.36Å; I143-I154 HydrophobicContact CG2-CG2 3.93Å; T145-I154 HydrophobicContact CG2-CG1 3.96Å; I154-S156 WeakPolarHBondContact CG2-O 3.26Å; I154-L178 HydrophobicContact CD1-CD1 4.23Å |
| 155 | L | 90.6 | Very high | 89.3 | Confident | 104 Ų | 104 | 72 Ų | 72 | 55% | 0.545 | 38% | 0.383 | S | S | . | . | trans | -79.6 | -34.7 | -173.3 | -68.2 | 175.1 | 0 | 0 | 0 | 113.9 | T144 K146 | T144-L155 PolarHBondContact O-N 3.35Å; K146-L155 HydrophobicContact CB-CD1 4.39Å; K146-L155 HydrophobicContact CB-CD2 4Å; K146-L155 HydrophobicContact CB-CG 4.27Å; K146-L155 HydrophobicContact CD-CD2 4.44Å | ||
| 156 | S | 89.8 | Confident | 89.3 | Confident | 56 Ų | 56 | 78.1 Ų | 78.1 | 39% | 0.392 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -146.1 | 153.9 | -174.6 | 60.1 | 0 | 0 | 0 | 0 | 111.1 | I154 V158 | I154-S156 WeakPolarHBondContact CG2-O 3.26Å; S156-V158 PolarHBondContact O-N 3.13Å |
| 157 | D | 90 | Very high | 89.3 | Confident | 114 Ų | 114 | 71.9 Ų | 71.9 | 61% | 0.61 | 38% | 0.38 | S | S | * | . | trans | -66.2 | 129.4 | 175.3 | -62.2 | 0.6 | 0 | 0 | 0 | 110.3 | V123 P124 A125 | V123-D157 WeakPolarHBondContact O-CA 3.23Å; P124-D157 VanDerWaalsContact CA-OD1 3.29Å; P124-D157 WeakPolarHBondContact CA-OD1 3.3Å; A125-D157 WeakPolarHBondContact CB-OD1 3.47Å; A125-D157 PolarHBondContact N-OD1 3.02Å | ||
| 158 | V | 87.5 | Confident | 89.3 | Confident | 37 Ų | 37 | 68.5 Ų | 68.5 | 22% | 0.224 | 37% | 0.369 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 132.1 | 178.7 | -178 | 0 | 0 | 0 | 0 | 109.8 | V123 S156 L160 | V123-V158 PolarHBondContact N-O 3.34Å; V123-V158 PolarHBondContact O-N 3.15Å; S156-V158 PolarHBondContact O-N 3.13Å; V158-L160 HydrophobicContact CG1-CD2 4.48Å; V158-L160 PolarHBondContact O-N 3.13Å |
| 159 | M | 87.8 | Confident | 89.4 | Confident | 118 Ų | 118 | 70.4 Ų | 70.4 | 58% | 0.581 | 39% | 0.386 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -79.3 | 115.1 | 171 | -51.4 | -176.3 | 90.9 | 0 | 0 | 108.5 | D120 T122 | D120-M159 HydrophobicContact CB-CE 4.27Å; T122-M159 HydrophobicContact CG2-CB 4.33Å; T122-M159 HydrophobicContact CG2-CE 4.18Å; T122-M159 HydrophobicContact CG2-CG 3.83Å |
| 160 | L | 85.3 | Confident | 89.6 | Confident | 29 Ų | 29 | 60.5 Ų | 60.5 | 15% | 0.152 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.2 | -42.3 | -178.9 | -67.8 | -176.3 | 0 | 0 | 0 | 112.2 | V121 V123 I143 V158 L174 L175 | V121-L160 PolarHBondContact O-N 2.91Å; V123-L160 HydrophobicContact CG2-CD1 3.36Å; V123-L160 HydrophobicContact CG2-CG 3.9Å; I143-L160 HydrophobicContact CD1-CD1 4.43Å; I143-L160 HydrophobicContact CD1-CD2 3.77Å; I143-L160 HydrophobicContact CG1-CD2 3.86Å; V158-L160 HydrophobicContact CG1-CD2 4.48Å; V158-L160 PolarHBondContact O-N 3.13Å; L160-L174 HydrophobicContact CD1-CD2 4.34Å; L160-L175 HydrophobicContact CD1-CD2 4.34Å |
| 161 | I | 88.6 | Confident | 89.6 | Confident | 4 Ų | 4 | 60.4 Ų | 60.4 | 2% | 0.021 | 34% | 0.344 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.1 | 132.4 | -169.2 | -44.8 | 178.9 | 0 | 0 | 0 | 109.2 | A117 D120 V121 D165 V167 E171 | A117-I161 HydrophobicContact CB-CG2 3.59Å; D120-I161 WeakPolarHBondContact CA-O 3.44Å; V121-I161 HydrophobicContact CB-CB 4.17Å; V121-I161 HydrophobicContact CB-CG1 4.37Å; V121-I161 HydrophobicContact CG2-CB 4.24Å; V121-I161 HydrophobicContact CG2-CD1 4.44Å; V121-I161 PolarHBondContact N-O 3.44Å; I161-D165 HydrophobicContact CG2-CB 4.03Å; I161-V167 HydrophobicContact CD1-CB 4.17Å; I161-V167 HydrophobicContact CD1-CG1 3.84Å; I161-V167 HydrophobicContact CD1-CG2 3.86Å; I161-E171 HydrophobicContact CD1-CB 4.21Å; I161-E171 WeakPolarHBondContact CD1-OE2 3.45Å |
| 162 | K | 89.8 | Confident | 89.6 | Confident | 135 Ų | 135 | 58.9 Ų | 58.9 | 59% | 0.587 | 34% | 0.335 | S | S | * | . | trans | -92.7 | 164.5 | 173.6 | -69.6 | -176.9 | -178.3 | 179.2 | 0 | 110.9 | D120 G164 D165 | D120-K162 WeakPolarHBondContact OD1-CA 3.3Å; K162-G164 PolarHBondContact O-N 2.85Å; K162-D165 PolarHBondContact O-N 2.81Å | ||
| 163 | P | 90.5 | Very high | 89.5 | Confident | 76 Ų | 76 | 61.8 Ų | 61.8 | 49% | 0.494 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | 133 | -177.8 | 2 | 18 | 0 | 0 | 0 | 108.4 | D120 | D120-P163 WeakPolarHBondContact OD1-CD 3.44Å; D120-P163 VanDerWaalsContact OD1-CG 3.28Å; D120-P163 WeakPolarHBondContact OD1-CG 3.18Å |
| 164 | G | 88.1 | Confident | 89.4 | Confident | 50 Ų | 50 | 58.3 Ų | 58.3 | 52% | 0.515 | 34% | 0.336 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 93 | -12.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | A117 K162 | A117-G164 PolarHBondContact O-N 3.27Å; K162-G164 PolarHBondContact O-N 2.85Å |
| 165 | D | 90.3 | Very high | 89.3 | Confident | 89 Ų | 89 | 58.1 Ų | 58.1 | 48% | 0.476 | 34% | 0.335 | S | S | . | . | P | Polyproline II helix | trans | -76.6 | 151.4 | 173.7 | -71.8 | -23.6 | 0 | 0 | 0 | 111.3 | A117 I161 K162 | A117-D165 PolarHBondContact N-O 3.49Å; I161-D165 HydrophobicContact CG2-CB 4.03Å; K162-D165 PolarHBondContact O-N 2.81Å |
| 166 | K | 90.3 | Very high | 89.2 | Confident | 159 Ų | 159 | 56.9 Ų | 56.9 | 69% | 0.691 | 33% | 0.329 | S | S | * | . | B | Isolated β-bridge | trans | -83.1 | 127.2 | 175 | -69.1 | -177.7 | -178.3 | 177.4 | 0 | 109.3 | A115 G168 | A115-K166 WeakPolarHBondContact O-CA 3.04Å; K166-G168 PolarHBondContact O-N 2.89Å |
| 167 | V | 90.3 | Very high | 89.1 | Confident | 3 Ų | 3 | 58 Ų | 58 | 2% | 0.018 | 33% | 0.329 | C | S | . | . | P | Polyproline II helix | trans | -64 | 122.8 | 177.7 | -178.8 | 0 | 0 | 0 | 0 | 110.1 | A111 G114 A115 A117 I161 E171 A172 F183 | A111-V167 HydrophobicContact CB-CG1 3.95Å; A111-V167 HydrophobicContact CB-CG2 4.28Å; G114-V167 PolarHBondContact N-O 2.88Å; A115-V167 WeakPolarHBondContact O-CG2 3.43Å; A115-V167 PolarHBondContact O-N 2.94Å; A117-V167 HydrophobicContact CB-CG2 4.46Å; I161-V167 HydrophobicContact CD1-CB 4.17Å; I161-V167 HydrophobicContact CD1-CG1 3.84Å; I161-V167 HydrophobicContact CD1-CG2 3.86Å; V167-E171 HydrophobicContact CG1-CB 4.43Å; V167-A172 HydrophobicContact CG1-CB 3.81Å; V167-F183 HydrophobicContact CG2-CE2 4.26Å; V167-F183 HydrophobicContact CG2-CZ 4.39Å |
| 168 | G | 90.9 | Very high | 88.9 | Confident | 23 Ų | 23 | 54 Ų | 54 | 24% | 0.237 | 31% | 0.307 | C | S | . | . | P | Polyproline II helix | trans | -66.6 | 152.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | K166 S170 E171 A172 | K166-G168 PolarHBondContact O-N 2.89Å; G168-S170 VanDerWaalsContact C-N 3.25Å; G168-S170 PolarHBondContact O-N 3.48Å; G168-E171 PolarHBondContact N-OE2 3.4Å; G168-E171 PolarHBondContact O-N 3.29Å; G168-A172 WeakPolarHBondContact O-CB 3.44Å; G168-A172 PolarHBondContact O-N 3.33Å |
| 169 | A | 90.9 | Very high | 88.9 | Confident | 67 Ų | 67 | 59.1 Ų | 59.1 | 55% | 0.554 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -63.4 | -34.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A113 T173 | A113-A169 HydrophobicContact CB-CB 4.07Å; A169-T173 WeakPolarHBondContact O-CG2 3.39Å; A169-T173 PolarHBondContact O-N 3.43Å; A169-T173 PolarHBondContact O-OG1 3.36Å |
| 170 | S | 89.4 | Confident | 89 | Confident | 48 Ų | 48 | 55.6 Ų | 55.6 | 34% | 0.336 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -69.2 | -43.8 | 175.8 | 41 | 0 | 0 | 0 | 0 | 112.4 | F137 G168 T173 L174 | F137-S170 VanDerWaalsContact CE1-O 3.24Å; F137-S170 WeakPolarHBondContact CE1-O 3.14Å; F137-S170 VanDerWaalsContact CZ-O 3.31Å; F137-S170 WeakPolarHBondContact CZ-O 3.41Å; G168-S170 VanDerWaalsContact C-N 3.25Å; G168-S170 PolarHBondContact O-N 3.48Å; S170-T173 PolarHBondContact O-N 3.29Å; S170-T173 PolarHBondContact O-OG1 3.07Å; S170-L174 WeakPolarHBondContact O-CB 3.29Å; S170-L174 PolarHBondContact O-N 3.3Å |
| 171 | E | 88.3 | Confident | 89.1 | Confident | 42 Ų | 42 | 56.7 Ų | 56.7 | 20% | 0.196 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -63.3 | -46.6 | 177.1 | -64.7 | 163.5 | -176.3 | 0 | 0 | 111.8 | L141 I161 V167 G168 T173 L174 L175 | L141-E171 HydrophobicContact CD2-CG 3.72Å; I161-E171 HydrophobicContact CD1-CB 4.21Å; I161-E171 WeakPolarHBondContact CD1-OE2 3.45Å; V167-E171 HydrophobicContact CG1-CB 4.43Å; G168-E171 PolarHBondContact N-OE2 3.4Å; G168-E171 PolarHBondContact O-N 3.29Å; E171-T173 VanDerWaalsContact C-N 3.33Å; E171-T173 PolarHBondContact O-N 3.5Å; E171-L174 PolarHBondContact O-N 2.95Å; E171-L175 VanDerWaalsContact O-CG 3.31Å; E171-L175 WeakPolarHBondContact O-CG 3.49Å; E171-L175 PolarHBondContact O-N 3.45Å |
| 172 | A | 89.4 | Confident | 88.8 | Confident | 4 Ų | 4 | 58.3 Ų | 58.3 | 3% | 0.033 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -59.8 | -42.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A111 A113 V167 G168 N176 | A111-A172 WeakPolarHBondContact O-CB 3.32Å; A113-A172 HydrophobicContact CB-CB 4.39Å; V167-A172 HydrophobicContact CG1-CB 3.81Å; G168-A172 WeakPolarHBondContact O-CB 3.44Å; G168-A172 PolarHBondContact O-N 3.33Å; A172-N176 WeakPolarHBondContact O-CB 3.45Å; A172-N176 VanDerWaalsContact O-CG 3.31Å; A172-N176 PolarHBondContact O-N 2.89Å; A172-N176 VanDerWaalsContact O-N 3.08Å; A172-N176 PolarHBondContact O-ND2 3.21Å |
| 173 | T | 89 | Confident | 88.7 | Confident | 60 Ų | 60 | 52.2 Ų | 52.2 | 37% | 0.368 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -70.8 | -35.7 | 179.5 | 47.2 | 0 | 0 | 0 | 0 | 111.9 | F137 A169 S170 E171 N176 M177 | F137-T173 WeakPolarHBondContact CZ-OG1 3.34Å; A169-T173 WeakPolarHBondContact O-CG2 3.39Å; A169-T173 PolarHBondContact O-N 3.43Å; A169-T173 PolarHBondContact O-OG1 3.36Å; S170-T173 PolarHBondContact O-N 3.29Å; S170-T173 PolarHBondContact O-OG1 3.07Å; E171-T173 VanDerWaalsContact C-N 3.33Å; E171-T173 PolarHBondContact O-N 3.5Å; T173-N176 PolarHBondContact O-N 2.84Å; T173-M177 WeakPolarHBondContact O-CG 3.45Å; T173-M177 PolarHBondContact O-N 2.97Å |
| 174 | L | 88.2 | Confident | 88.4 | Confident | 2 Ų | 2 | 51.9 Ų | 51.9 | 1% | 0.01 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -59.8 | -51.8 | 171.7 | -174.5 | 150.9 | 0 | 0 | 0 | 111.2 | V123 F137 F138 L141 I143 L160 S170 E171 N176 M177 L178 | V123-L174 HydrophobicContact CG2-CD2 4.35Å; F137-L174 HydrophobicContact CD1-CB 4.36Å; F137-L174 HydrophobicContact CD1-CD1 4.35Å; F137-L174 HydrophobicContact CE1-CB 3.88Å; F138-L174 HydrophobicContact CD1-CD1 3.67Å; F138-L174 HydrophobicContact CE1-CD1 3.59Å; F138-L174 HydrophobicContact CE1-CD2 4.45Å; F138-L174 HydrophobicContact CE1-CG 4.02Å; F138-L174 HydrophobicContact CG-CD1 4.43Å; F138-L174 HydrophobicContact CZ-CD1 4.3Å; F138-L174 HydrophobicContact CZ-CG 4.46Å; L141-L174 HydrophobicContact CD1-CB 4.13Å; L141-L174 HydrophobicContact CD1-CD1 3.43Å; L141-L174 VanDerWaalsContact CD1-CD1 3.43Å; L141-L174 HydrophobicContact CD1-CG 4.41Å; I143-L174 HydrophobicContact CD1-CD1 3.59Å; L160-L174 HydrophobicContact CD1-CD2 4.34Å; S170-L174 WeakPolarHBondContact O-CB 3.29Å; S170-L174 PolarHBondContact O-N 3.3Å; E171-L174 PolarHBondContact O-N 2.95Å; L174-N176 VanDerWaalsContact C-N 3.26Å; L174-N176 PolarHBondContact O-N 3.29Å; L174-M177 PolarHBondContact O-N 3.44Å; L174-L178 HydrophobicContact CD2-CD1 3.38Å; L174-L178 HydrophobicContact CD2-CG 3.95Å; L174-L178 HydrophobicContact CG-CD1 4.32Å; L174-L178 PolarHBondContact O-N 3.27Å |
| 175 | L | 89.2 | Confident | 88 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.8 | -39.7 | -178.5 | -69.9 | 166.7 | 0 | 0 | 0 | 111.5 | A111 V121 V123 L160 E171 L178 N179 I180 P182 | A111-L175 HydrophobicContact CB-CD1 3.94Å; V121-L175 HydrophobicContact CG1-CD1 3.85Å; V121-L175 HydrophobicContact CG1-CD2 3.77Å; V121-L175 HydrophobicContact CG1-CG 4.48Å; V123-L175 HydrophobicContact CG2-CD2 4.04Å; L160-L175 HydrophobicContact CD1-CD2 4.34Å; E171-L175 VanDerWaalsContact O-CG 3.31Å; E171-L175 WeakPolarHBondContact O-CG 3.49Å; E171-L175 PolarHBondContact O-N 3.45Å; L175-L178 PolarHBondContact O-N 3.43Å; L175-N179 PolarHBondContact O-N 3.39Å; L175-I180 HydrophobicContact CD2-CB 4.15Å; L175-I180 HydrophobicContact CD2-CG2 4.12Å; L175-I180 PolarHBondContact O-N 2.93Å; L175-P182 HydrophobicContact CD1-CG 4.32Å |
| 176 | N | 89.1 | Confident | 87.7 | Confident | 79 Ų | 79 | 48 Ų | 48 | 42% | 0.422 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -61.7 | -42.9 | 172.1 | -76.9 | -49.4 | 0 | 0 | 0 | 112.7 | A110 A172 T173 L174 L178 N179 | A110-N176 WeakPolarHBondContact CB-OD1 3.2Å; A172-N176 WeakPolarHBondContact O-CB 3.45Å; A172-N176 VanDerWaalsContact O-CG 3.31Å; A172-N176 PolarHBondContact O-N 2.89Å; A172-N176 VanDerWaalsContact O-N 3.08Å; A172-N176 PolarHBondContact O-ND2 3.21Å; T173-N176 PolarHBondContact O-N 2.84Å; L174-N176 VanDerWaalsContact C-N 3.26Å; L174-N176 PolarHBondContact O-N 3.29Å; N176-L178 VanDerWaalsContact C-N 3.34Å; N176-N179 PolarHBondContact O-N 2.91Å |
| 177 | M | 87.1 | Confident | 87.5 | Confident | 78 Ų | 78 | 40.6 Ų | 40.6 | 38% | 0.384 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -68 | -33.5 | 178.6 | -71.2 | -171.1 | -155.3 | 0 | 0 | 112.6 | L130 K134 T173 L174 N179 | L130-M177 HydrophobicContact CD1-CB 4.43Å; K134-M177 HydrophobicContact CD-SD 3.95Å; K134-M177 PolarHBondContact NZ-SD 3.36Å; K134-M177 VanDerWaalsContact NZ-SD 3.35Å; T173-M177 WeakPolarHBondContact O-CG 3.45Å; T173-M177 PolarHBondContact O-N 2.97Å; L174-M177 PolarHBondContact O-N 3.44Å; M177-N179 PolarHBondContact O-N 2.87Å |
| 178 | L | 87.5 | Confident | 87.4 | Confident | 30 Ų | 30 | 45.5 Ų | 45.5 | 16% | 0.157 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.3 | -1 | 174.9 | -63.1 | -174.1 | 0 | 0 | 0 | 113.2 | V123 T128 L130 F138 I154 L174 L175 N176 I180 | V123-L178 HydrophobicContact CG1-CD1 3.72Å; T128-L178 HydrophobicContact CG2-CD2 3.48Å; T128-L178 VanDerWaalsContact CG2-CD2 3.48Å; L130-L178 HydrophobicContact CD1-CD2 4.27Å; F138-L178 HydrophobicContact CE1-CD1 4.48Å; F138-L178 HydrophobicContact CE1-CD2 4.48Å; F138-L178 HydrophobicContact CZ-CD2 4.32Å; I154-L178 HydrophobicContact CD1-CD1 4.23Å; L174-L178 HydrophobicContact CD2-CD1 3.38Å; L174-L178 HydrophobicContact CD2-CG 3.95Å; L174-L178 HydrophobicContact CG-CD1 4.32Å; L174-L178 PolarHBondContact O-N 3.27Å; L175-L178 PolarHBondContact O-N 3.43Å; N176-L178 VanDerWaalsContact C-N 3.34Å; L178-I180 HydrophobicContact CB-CD1 3.85Å; L178-I180 HydrophobicContact CB-CG1 3.86Å; L178-I180 HydrophobicContact CD1-CD1 3.98Å; L178-I180 PolarHBondContact O-N 3.41Å |
| 179 | N | 87.1 | Confident | 87.4 | Confident | 146 Ų | 146 | 45.3 Ų | 45.3 | 78% | 0.781 | 27% | 0.265 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.3 | 28.6 | -171.9 | -58.1 | -59.7 | 0 | 0 | 0 | 113.3 | L175 N176 M177 | L175-N179 PolarHBondContact O-N 3.39Å; N176-N179 PolarHBondContact O-N 2.91Å; M177-N179 PolarHBondContact O-N 2.87Å |
| 180 | I | 88.6 | Confident | 87.4 | Confident | 43 Ų | 43 | 45.5 Ų | 45.5 | 22% | 0.221 | 25% | 0.254 | C | S | . | . | trans | -92.5 | 112.6 | 175.2 | -59.3 | 173.7 | 0 | 0 | 0 | 107.4 | V123 L175 L178 P182 | V123-I180 HydrophobicContact CG1-CD1 4.28Å; V123-I180 HydrophobicContact CG2-CD1 4.48Å; L175-I180 HydrophobicContact CD2-CB 4.15Å; L175-I180 HydrophobicContact CD2-CG2 4.12Å; L175-I180 PolarHBondContact O-N 2.93Å; L178-I180 HydrophobicContact CB-CD1 3.85Å; L178-I180 HydrophobicContact CB-CG1 3.86Å; L178-I180 HydrophobicContact CD1-CD1 3.98Å; L178-I180 PolarHBondContact O-N 3.41Å; I180-P182 VanDerWaalsContact O-CD 3.24Å; I180-P182 WeakPolarHBondContact O-CD 3.37Å | ||
| 181 | S | 87.6 | Confident | 87.4 | Confident | 53 Ų | 53 | 45 Ų | 45 | 37% | 0.371 | 25% | 0.246 | S | C | . | . | trans | -105.1 | 90.8 | 173.7 | 52.5 | 0 | 0 | 0 | 0 | 109.3 | P108 F183 | P108-S181 WeakPolarHBondContact CB-OG 3.32Å; S181-F183 VanDerWaalsContact C-N 3.33Å; S181-F183 PolarHBondContact O-N 3.14Å | ||
| 182 | P | 84 | Confident | 87.6 | Confident | 38 Ų | 38 | 43 Ų | 43 | 25% | 0.247 | 24% | 0.237 | C | C | . | . | trans | -77.4 | -18.3 | -168.2 | 31.3 | -37.7 | 0 | 0 | 0 | 113.8 | A111 V121 L175 I180 | A111-P182 HydrophobicContact CB-CG 4.25Å; V121-P182 HydrophobicContact CB-CB 4.3Å; V121-P182 HydrophobicContact CG1-CB 3.77Å; V121-P182 HydrophobicContact CG1-CG 3.91Å; V121-P182 HydrophobicContact CG2-CB 3.75Å; V121-P182 HydrophobicContact CG2-CG 3.85Å; L175-P182 HydrophobicContact CD1-CG 4.32Å; I180-P182 VanDerWaalsContact O-CD 3.24Å; I180-P182 WeakPolarHBondContact O-CD 3.37Å | ||
| 183 | F | 85.9 | Confident | 87.6 | Confident | 6 Ų | 6 | 43.3 Ų | 43.3 | 3% | 0.026 | 24% | 0.238 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 144.4 | -177 | -52.1 | -37.5 | 0 | 0 | 0 | 110 | A109 A111 A117 P118 V121 V167 S181 F185 | A109-F183 PolarHBondContact N-O 3.32Å; A109-F183 PolarHBondContact O-N 2.91Å; A109-F183 VanDerWaalsContact O-O 3.05Å; A111-F183 HydrophobicContact CB-CD2 4.09Å; A111-F183 HydrophobicContact CB-CE2 3.52Å; A111-F183 HydrophobicContact CB-CZ 4.25Å; A117-F183 HydrophobicContact CB-CE1 4.29Å; A117-F183 HydrophobicContact CB-CZ 3.83Å; P118-F183 HydrophobicContact CG-CD1 3.68Å; P118-F183 HydrophobicContact CG-CE1 4.06Å; P118-F183 HydrophobicContact CG-CG 4.03Å; V121-F183 HydrophobicContact CG2-CE1 3.54Å; V121-F183 HydrophobicContact CG2-CZ 3.71Å; V167-F183 HydrophobicContact CG2-CE2 4.26Å; V167-F183 HydrophobicContact CG2-CZ 4.39Å; S181-F183 VanDerWaalsContact C-N 3.33Å; S181-F183 PolarHBondContact O-N 3.14Å; F183-F185 HydrophobicContact CB-CE2 3.96Å; F183-F185 HydrophobicContact CB-CZ 4.03Å; F183-F185 HydrophobicContact CD2-CE2 4.49Å; F183-F185 HydrophobicContact CD2-CZ 4.37Å; F183-F185 HydrophobicContact CG-CZ 4.49Å |
| 184 | S | 84.4 | Confident | 87.6 | Confident | 70 Ų | 70 | 42.4 Ų | 42.4 | 49% | 0.49 | 23% | 0.23 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -114.4 | 116.5 | 169.3 | 66.3 | 0 | 0 | 0 | 0 | 108.3 | V107 | V107-S184 WeakPolarHBondContact O-CA 3.45Å |
| 185 | F | 81.4 | Confident | 87.3 | Confident | 51 Ų | 51 | 47.9 Ų | 47.9 | 22% | 0.224 | 26% | 0.26 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102 | 138.3 | 172.8 | -63.9 | -64.8 | 0 | 0 | 0 | 109.6 | N34 Q39 V107 A109 F183 | N34-F185 HydrophobicContact CB-CD1 4.17Å; N34-F185 HydrophobicContact CB-CD2 4.07Å; N34-F185 HydrophobicContact CB-CE1 4.45Å; N34-F185 HydrophobicContact CB-CE2 4.4Å; N34-F185 HydrophobicContact CB-CG 4Å; Q39-F185 PolarHBondContact NE2-O 3.45Å; V107-F185 PolarHBondContact N-O 2.94Å; V107-F185 PolarHBondContact O-N 2.87Å; A109-F185 HydrophobicContact CB-CD2 3.3Å; A109-F185 HydrophobicContact CB-CE2 3.77Å; A109-F185 HydrophobicContact CB-CG 4.36Å; F183-F185 HydrophobicContact CB-CE2 3.96Å; F183-F185 HydrophobicContact CB-CZ 4.03Å; F183-F185 HydrophobicContact CD2-CE2 4.49Å; F183-F185 HydrophobicContact CD2-CZ 4.37Å; F183-F185 HydrophobicContact CG-CZ 4.49Å |
| 186 | G | 83.2 | Confident | 87 | Confident | 7 Ų | 7 | 48.1 Ų | 48.1 | 7% | 0.072 | 26% | 0.262 | C | S | . | . | trans | -148.5 | -178.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | L188 | G186-L188 PolarHBondContact O-N 3.38Š| ||
| 187 | L | 86.8 | Confident | 86.9 | Confident | 3 Ų | 3 | 46.3 Ų | 46.3 | 2% | 0.016 | 26% | 0.256 | C | S | . | . | P | Polyproline II helix | trans | -69 | 117.4 | 167.9 | -72.7 | 167.6 | 0 | 0 | 0 | 108.4 | V30 A32 M40 I43 L102 | V30-L187 HydrophobicContact CB-CB 4.32Å; V30-L187 HydrophobicContact CB-CD2 4.16Å; V30-L187 HydrophobicContact CG1-CB 4.46Å; V30-L187 HydrophobicContact CG2-CD2 3.96Å; A32-L187 HydrophobicContact CB-CD2 3.89Å; M40-L187 HydrophobicContact SD-CD2 4.05Å; I43-L187 HydrophobicContact CD1-CD1 3.79Å; I43-L187 HydrophobicContact CD1-CG 3.97Å; I43-L187 HydrophobicContact CG2-CD1 3.7Å; L102-L187 HydrophobicContact CD2-CB 4.44Å; L102-L187 HydrophobicContact CD2-CD1 3.79Å |
| 188 | L | 88.3 | Confident | 86.9 | Confident | 106 Ų | 106 | 44.1 Ų | 44.1 | 56% | 0.555 | 25% | 0.247 | S | C | * | . | E | Extended strand (participates in β ladder) | trans | -87.9 | 122.8 | 175.2 | -65.7 | 177.1 | 0 | 0 | 0 | 108.6 | V30 G31 G186 Q190 | V30-L188 CarbonylContact C-O 3.52Å; V30-L188 WeakPolarHBondContact CA-O 3.39Å; G31-L188 PolarHBondContact N-O 3.11Å; G31-L188 PolarHBondContact O-N 2.86Å; G31-L188 VanDerWaalsContact O-N 3.11Å; G186-L188 PolarHBondContact O-N 3.38Å; L188-Q190 PolarHBondContact O-N 3.28Å |
| 189 | I | 90.4 | Very high | 86.9 | Confident | 19 Ų | 19 | 47.6 Ų | 47.6 | 10% | 0.097 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.5 | 116.1 | 175.6 | -59 | 163.6 | 0 | 0 | 0 | 107.3 | F28 V30 R99 L102 V192 P201 | F28-I189 HydrophobicContact CD1-CD1 4.37Å; F28-I189 HydrophobicContact CD1-CG1 4.46Å; F28-I189 HydrophobicContact CD1-CG2 3.74Å; F28-I189 HydrophobicContact CE1-CD1 4.46Å; F28-I189 HydrophobicContact CE1-CG2 4.4Å; V30-I189 HydrophobicContact CG1-CG1 4.33Å; R99-I189 HydrophobicContact CB-CD1 3.91Å; R99-I189 HydrophobicContact CG-CD1 3.68Å; L102-I189 HydrophobicContact CB-CD1 4.45Å; L102-I189 HydrophobicContact CD1-CD1 4.04Å; L102-I189 HydrophobicContact CD1-CG1 4.13Å; I189-V192 HydrophobicContact CG2-CG2 3.95Å; I189-P201 HydrophobicContact CB-CB 4.46Å; I189-P201 HydrophobicContact CG2-CB 4.2Å |
| 190 | Q | 90 | Very high | 86.9 | Confident | 70 Ų | 70 | 42.6 Ų | 42.6 | 33% | 0.327 | 24% | 0.235 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.9 | -45.5 | 178.2 | -70.1 | -174.5 | -10.9 | 0 | 0 | 111.3 | I29 L188 P201 | I29-Q190 HydrophobicContact CG2-CB 4.35Å; I29-Q190 PolarHBondContact O-N 3.39Å; L188-Q190 PolarHBondContact O-N 3.28Å; Q190-P201 WeakPolarHBondContact O-CD 3.47Å |
| 191 | Q | 90.7 | Very high | 86.7 | Confident | 38 Ų | 38 | 42 Ų | 42 | 18% | 0.178 | 23% | 0.234 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -150.9 | 155.9 | -177.6 | -65.3 | -64.5 | -38.6 | 0 | 0 | 109.6 | I29 H81 V198 Y199 | I29-Q191 HydrophobicContact CB-CB 4.18Å; I29-Q191 HydrophobicContact CD1-CB 4.18Å; I29-Q191 HydrophobicContact CG1-CB 4.41Å; I29-Q191 PolarHBondContact N-O 3.2Å; I29-Q191 PolarHBondContact O-N 2.93Å; H81-Q191 HydrophobicContact CB-CG 4.08Å; Q191-V198 HydrophobicContact CB-CG1 4.03Å; Q191-V198 HydrophobicContact CG-CG1 4.31Å; Q191-Y199 WeakPolarHBondContact CA-O 3.26Å; Q191-Y199 PolarHBondContact OE1-O 2.91Å |
| 192 | V | 91.5 | Very high | 86.6 | Confident | 1 Ų | 1 | 46.3 Ų | 46.3 | 1% | 0.006 | 25% | 0.248 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 136.9 | 178.5 | -169.2 | 0 | 0 | 0 | 0 | 108.3 | F28 L95 I189 V198 Y199 L204 | F28-V192 HydrophobicContact CD1-CB 4.25Å; F28-V192 HydrophobicContact CD1-CG1 3.91Å; F28-V192 HydrophobicContact CD1-CG2 3.7Å; F28-V192 HydrophobicContact CE1-CB 4.27Å; F28-V192 HydrophobicContact CE1-CG1 3.66Å; F28-V192 HydrophobicContact CE1-CG2 3.67Å; F28-V192 HydrophobicContact CZ-CG1 4.31Å; L95-V192 HydrophobicContact CD1-CG1 3.93Å; L95-V192 HydrophobicContact CD2-CG1 3.72Å; L95-V192 HydrophobicContact CG-CG1 4.36Å; I189-V192 HydrophobicContact CG2-CG2 3.95Å; V192-V198 CarbonylContact O-C 3.59Å; V192-V198 VanDerWaalsContact O-CA 3.26Å; V192-V198 WeakPolarHBondContact O-CA 3.26Å; V192-Y199 PolarHBondContact N-O 3.41Å; V192-Y199 PolarHBondContact O-N 3.34Å; V192-L204 HydrophobicContact CG1-CD1 4.38Å; V192-L204 HydrophobicContact CG2-CD1 3.77Å |
| 193 | Y | 89.5 | Confident | 86.6 | Confident | 10 Ų | 10 | 47.7 Ų | 47.7 | 4% | 0.039 | 26% | 0.256 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 128.9 | 174.2 | -179.6 | -102.4 | 0 | 0 | 0 | 109.5 | K26 C27 L75 L78 G196 S197 V198 | K26-Y193 WeakPolarHBondContact CA-O 3.23Å; C27-Y193 PolarHBondContact N-O 2.83Å; C27-Y193 WeakPolarHBondContact O-CB 3.24Å; C27-Y193 PolarHBondContact O-N 3.46Å; C27-Y193 WeakPolarHBondContact SG-CB 3.31Å; L75-Y193 HydrophobicContact CD2-CE1 4.18Å; L75-Y193 HydrophobicContact CD2-CE2 4.46Å; L78-Y193 HydrophobicContact CD1-CD1 4.49Å; L78-Y193 HydrophobicContact CD1-CD2 3.93Å; L78-Y193 HydrophobicContact CD1-CE2 4.12Å; L78-Y193 HydrophobicContact CD1-CG 4.09Å; L78-Y193 HydrophobicContact CD2-CD2 3.62Å; L78-Y193 HydrophobicContact CD2-CE2 4.45Å; L78-Y193 HydrophobicContact CD2-CG 3.89Å; L78-Y193 HydrophobicContact CG-CD2 3.89Å; L78-Y193 HydrophobicContact CG-CE2 4.25Å; L78-Y193 HydrophobicContact CG-CG 4.38Å; Y193-G196 VanDerWaalsContact CE2-CA 3.48Å; Y193-G196 VanDerWaalsContact CZ-N 3.32Å; Y193-G196 WeakPolarHBondContact OH-CA 3.49Å; Y193-G196 PolarHBondContact OH-N 3.07Å; Y193-S197 WeakPolarHBondContact CA-O 3.24Å; Y193-V198 HydrophobicContact CD2-CG2 3.87Å |
| 194 | D | 88.6 | Confident | 86.4 | Confident | 40 Ų | 40 | 49.7 Ų | 49.7 | 21% | 0.214 | 27% | 0.267 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.3 | 115.7 | 173.1 | -168.2 | -3.7 | 0 | 0 | 0 | 108.9 | L95 G196 S197 Y199 | L95-D194 HydrophobicContact CD1-CB 4.21Å; D194-G196 PolarHBondContact O-N 2.88Å; D194-S197 PolarHBondContact N-O 2.88Å; D194-S197 PolarHBondContact O-N 2.86Å; D194-Y199 HydrophobicContact CB-CE2 4.48Å |
| 195 | N | 83.3 | Confident | 86.2 | Confident | 118 Ų | 118 | 50.4 Ų | 50.4 | 63% | 0.631 | 27% | 0.265 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 44 | 40.6 | 171.5 | -68.5 | -55.6 | 0 | 0 | 0 | 115.1 | P25 | P25-N195 VanDerWaalsContact CB-OD1 3.31Å; P25-N195 WeakPolarHBondContact CB-OD1 3.49Å; P25-N195 PolarHBondContact O-N 3.27Å |
| 196 | G | 81.8 | Confident | 86.3 | Confident | 5 Ų | 5 | 52.6 Ų | 52.6 | 5% | 0.052 | 28% | 0.278 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 96.6 | 0.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | K77 Y193 D194 | K77-G196 PolarHBondContact NZ-O 3.46Å; Y193-G196 VanDerWaalsContact CE2-CA 3.48Å; Y193-G196 VanDerWaalsContact CZ-N 3.32Å; Y193-G196 WeakPolarHBondContact OH-CA 3.49Å; Y193-G196 PolarHBondContact OH-N 3.07Å; D194-G196 PolarHBondContact O-N 2.88Å |
| 197 | S | 86.6 | Confident | 86.4 | Confident | 41 Ų | 41 | 55.9 Ų | 55.9 | 29% | 0.287 | 30% | 0.297 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 139.8 | 171.1 | -64.8 | 0 | 0 | 0 | 0 | 110.5 | Y193 D194 Y199 | Y193-S197 WeakPolarHBondContact CA-O 3.24Å; D194-S197 PolarHBondContact N-O 2.88Å; D194-S197 PolarHBondContact O-N 2.86Å; S197-Y199 WeakPolarHBondContact CB-OH 3.36Å; S197-Y199 PolarHBondContact OG-OH 2.99Å |
| 198 | V | 87.3 | Confident | 86.4 | Confident | 32 Ų | 32 | 62.9 Ų | 62.9 | 19% | 0.194 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 126.7 | 175.8 | 180 | 0 | 0 | 0 | 0 | 107.9 | K77 L78 Q191 V192 Y193 | K77-V198 HydrophobicContact CB-CG2 3.7Å; L78-V198 HydrophobicContact CD2-CG2 3.73Å; L78-V198 HydrophobicContact CG-CG2 4.38Å; Q191-V198 HydrophobicContact CB-CG1 4.03Å; Q191-V198 HydrophobicContact CG-CG1 4.31Å; V192-V198 CarbonylContact O-C 3.59Å; V192-V198 VanDerWaalsContact O-CA 3.26Å; V192-V198 WeakPolarHBondContact O-CA 3.26Å; Y193-V198 HydrophobicContact CD2-CG2 3.87Å |
| 199 | Y | 87.4 | Confident | 86.5 | Confident | 102 Ų | 102 | 63.8 Ų | 63.8 | 40% | 0.4 | 34% | 0.335 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 147.3 | -178 | -53.7 | -73 | 0 | 0 | 0 | 111 | Q191 V192 D194 S197 V203 | Q191-Y199 WeakPolarHBondContact CA-O 3.26Å; Q191-Y199 PolarHBondContact OE1-O 2.91Å; V192-Y199 PolarHBondContact N-O 3.41Å; V192-Y199 PolarHBondContact O-N 3.34Å; D194-Y199 HydrophobicContact CB-CE2 4.48Å; S197-Y199 WeakPolarHBondContact CB-OH 3.36Å; S197-Y199 PolarHBondContact OG-OH 2.99Å; Y199-V203 HydrophobicContact CD1-CG1 4.44Å |
| 200 | S | 86.7 | Confident | 86.4 | Confident | 42 Ų | 42 | 65 Ų | 65 | 29% | 0.294 | 35% | 0.347 | S | S | . | . | trans | -68.3 | 152.2 | 165.3 | 57.2 | 0 | 0 | 0 | 0 | 110 | E202 V203 | S200-E202 PolarHBondContact O-N 3.29Å; S200-E202 VanDerWaalsContact O-N 3.13Å; S200-V203 PolarHBondContact O-N 2.95Å; S200-V203 VanDerWaalsContact O-N 3.13Å | ||
| 201 | P | 85.1 | Confident | 86.4 | Confident | 30 Ų | 30 | 66.5 Ų | 66.5 | 20% | 0.195 | 36% | 0.357 | C | S | . | . | G | 310 helix | trans | -59 | -24.9 | 179.1 | 24.7 | -36.4 | 0 | 0 | 0 | 113.4 | I189 Q190 V203 L204 | I189-P201 HydrophobicContact CB-CB 4.46Å; I189-P201 HydrophobicContact CG2-CB 4.2Å; Q190-P201 WeakPolarHBondContact O-CD 3.47Å; P201-V203 PolarHBondContact O-N 3.29Å; P201-L204 WeakPolarHBondContact O-CB 3.48Å; P201-L204 PolarHBondContact O-N 3.45Å; P201-L204 VanDerWaalsContact O-N 3.15Å |
| 202 | E | 85.3 | Confident | 86.6 | Confident | 144 Ų | 144 | 70.3 Ų | 70.3 | 67% | 0.673 | 38% | 0.375 | S | S | * | . | G | 310 helix | trans | -64 | -27.2 | 178.4 | -63.2 | 175.1 | 179.5 | 0 | 0 | 113 | S200 L204 D205 | S200-E202 PolarHBondContact O-N 3.29Å; S200-E202 VanDerWaalsContact O-N 3.13Å; E202-L204 PolarHBondContact O-N 3.26Å; E202-D205 WeakPolarHBondContact O-CB 3.45Å; E202-D205 PolarHBondContact O-N 3.49Å; E202-D205 VanDerWaalsContact O-N 3.09Å |
| 203 | V | 84.8 | Confident | 86.7 | Confident | 66 Ų | 66 | 73 Ų | 73 | 40% | 0.4 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -66.6 | -28.9 | 177.1 | -179 | 0 | 0 | 0 | 0 | 111 | Y199 S200 P201 D205 I206 | Y199-V203 HydrophobicContact CD1-CG1 4.44Å; S200-V203 PolarHBondContact O-N 2.95Å; S200-V203 VanDerWaalsContact O-N 3.13Å; P201-V203 PolarHBondContact O-N 3.29Å; V203-D205 VanDerWaalsContact C-N 3.28Å; V203-D205 PolarHBondContact O-N 2.96Å; V203-I206 HydrophobicContact CG1-CD1 4.36Å; V203-I206 WeakPolarHBondContact O-CG1 3.39Å |
| 204 | L | 81 | Confident | 86.9 | Confident | 49 Ų | 49 | 80.9 Ų | 80.9 | 26% | 0.257 | 43% | 0.427 | S | S | . | . | G | 310 helix | trans | -77.4 | -12.6 | 175.4 | -64.5 | 175.7 | 0 | 0 | 0 | 113.1 | F28 L95 V192 P201 E202 I206 | F28-L204 HydrophobicContact CE1-CD1 4.11Å; L95-L204 HydrophobicContact CB-CD1 4.16Å; L95-L204 HydrophobicContact CB-CD2 3.92Å; L95-L204 HydrophobicContact CD1-CD2 4.19Å; V192-L204 HydrophobicContact CG1-CD1 4.38Å; V192-L204 HydrophobicContact CG2-CD1 3.77Å; P201-L204 WeakPolarHBondContact O-CB 3.48Å; P201-L204 PolarHBondContact O-N 3.45Å; P201-L204 VanDerWaalsContact O-N 3.15Å; E202-L204 PolarHBondContact O-N 3.26Å; L204-I206 VanDerWaalsContact C-N 3.26Å |
| 205 | D | 81.4 | Confident | 87.2 | Confident | 84 Ų | 84 | 85.8 Ų | 85.8 | 45% | 0.449 | 45% | 0.446 | S | S | . | . | G | 310 helix | trans | -82.7 | -2.7 | 176.2 | -73.1 | -56 | 0 | 0 | 0 | 113.2 | R99 E202 V203 T207 | R99-D205 IonicContact CZ-OD1 3.54Å; R99-D205 IonicContact CZ-OD2 2.66Å; R99-D205 IonicContact NH1-OD1 3.94Å; R99-D205 PolarHBondContact NH1-OD1 3.4Å; R99-D205 IonicContact NH1-OD2 2.64Å; R99-D205 IonicContact NH2-OD1 3.9Å; R99-D205 PolarHBondContact NH2-OD1 2.84Å; R99-D205 IonicContact NH2-OD2 3Å; R99-D205 PolarHBondContact NH2-OD2 2.73Å; E202-D205 WeakPolarHBondContact O-CB 3.45Å; E202-D205 PolarHBondContact O-N 3.49Å; E202-D205 VanDerWaalsContact O-N 3.09Å; V203-D205 VanDerWaalsContact C-N 3.28Å; V203-D205 PolarHBondContact O-N 2.96Å; D205-T207 PolarHBondContact O-N 2.94Å; D205-T207 VanDerWaalsContact O-N 3.09Å |
| 206 | I | 82.6 | Confident | 87.6 | Confident | 97 Ų | 97 | 84.4 Ų | 84.4 | 50% | 0.497 | 44% | 0.439 | S | S | . | . | trans | -72.5 | 107.2 | 178.8 | -58.3 | 173.2 | 0 | 0 | 0 | 108.5 | V203 L204 L211 | V203-I206 HydrophobicContact CG1-CD1 4.36Å; V203-I206 WeakPolarHBondContact O-CG1 3.39Å; L204-I206 VanDerWaalsContact C-N 3.26Å; I206-L211 HydrophobicContact CG2-CD1 4.42Å; I206-L211 HydrophobicContact CG2-CD2 3.92Å; I206-L211 HydrophobicContact CG2-CG 3.96Å | ||
| 207 | T | 85.6 | Confident | 88.2 | Confident | 77 Ų | 77 | 88.3 Ų | 88.3 | 47% | 0.472 | 46% | 0.456 | S | S | . | . | trans | -76.3 | 151.4 | 176.8 | 59.3 | 0 | 0 | 0 | 0 | 111.6 | D205 D209 A210 L211 | D205-T207 PolarHBondContact O-N 2.94Å; D205-T207 VanDerWaalsContact O-N 3.09Å; T207-D209 PolarHBondContact O-N 2.77Å; T207-A210 WeakPolarHBondContact O-CB 3.28Å; T207-A210 PolarHBondContact O-N 3.39Å; T207-A210 VanDerWaalsContact O-N 3.1Å; T207-A210 PolarHBondContact OG1-N 2.97Å; T207-L211 PolarHBondContact O-N 2.84Å | ||
| 208 | E | 86.4 | Confident | 88.5 | Confident | 149 Ų | 149 | 87.7 Ų | 87.7 | 70% | 0.696 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -58.9 | -35.5 | 174 | -66.7 | -177.3 | 175 | 0 | 0 | 111.6 | A210 L211 H212 | E208-A210 VanDerWaalsContact C-N 3.31Å; E208-A210 PolarHBondContact O-N 3.3Å; E208-L211 WeakPolarHBondContact O-CB 3.25Å; E208-L211 PolarHBondContact O-N 3Å; E208-L211 VanDerWaalsContact O-N 3.11Å; E208-H212 PolarHBondContact O-N 2.84Å |
| 209 | D | 89.8 | Confident | 88.6 | Confident | 125 Ų | 125 | 89 Ų | 89 | 67% | 0.668 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -60.6 | -39.3 | 175.6 | -65.4 | -31.7 | 0 | 0 | 0 | 112.4 | T207 L211 H212 A213 | T207-D209 PolarHBondContact O-N 2.77Å; D209-L211 VanDerWaalsContact C-N 3.33Å; D209-H212 PolarHBondContact O-N 2.8Å; D209-A213 WeakPolarHBondContact O-CB 3.42Å; D209-A213 PolarHBondContact O-N 2.85Å |
| 210 | A | 89.2 | Confident | 88.7 | Confident | 44 Ų | 44 | 92.8 Ų | 92.8 | 36% | 0.364 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.7 | -39 | 176 | 0 | 0 | 0 | 0 | 0 | 111.1 | T207 E208 R214 | T207-A210 WeakPolarHBondContact O-CB 3.28Å; T207-A210 PolarHBondContact O-N 3.39Å; T207-A210 VanDerWaalsContact O-N 3.1Å; T207-A210 PolarHBondContact OG1-N 2.97Å; E208-A210 VanDerWaalsContact C-N 3.31Å; E208-A210 PolarHBondContact O-N 3.3Å; A210-R214 VanDerWaalsContact O-CG 3.28Å; A210-R214 WeakPolarHBondContact O-CG 3.42Å; A210-R214 PolarHBondContact O-N 3.1Å; A210-R214 VanDerWaalsContact O-N 3.1Å |
| 211 | L | 90.7 | Very high | 88.9 | Confident | 103 Ų | 103 | 95 Ų | 95 | 54% | 0.539 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -66.2 | -43.7 | 175.5 | -65.1 | 176.2 | 0 | 0 | 0 | 111.6 | I206 T207 E208 D209 R214 F215 | I206-L211 HydrophobicContact CG2-CD1 4.42Å; I206-L211 HydrophobicContact CG2-CD2 3.92Å; I206-L211 HydrophobicContact CG2-CG 3.96Å; T207-L211 PolarHBondContact O-N 2.84Å; E208-L211 WeakPolarHBondContact O-CB 3.25Å; E208-L211 PolarHBondContact O-N 3Å; E208-L211 VanDerWaalsContact O-N 3.11Å; D209-L211 VanDerWaalsContact C-N 3.33Å; L211-R214 PolarHBondContact O-N 3.28Å; L211-F215 WeakPolarHBondContact O-CB 3.36Å; L211-F215 PolarHBondContact O-N 3.4Å |
| 212 | H | 93.3 | Very high | 89.1 | Confident | 117 Ų | 117 | 98.6 Ų | 98.6 | 54% | 0.542 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.3 | -44.9 | 175.7 | -74.5 | 177.4 | 0 | 0 | 0 | 112 | E208 D209 R214 F215 L216 | E208-H212 PolarHBondContact O-N 2.84Å; D209-H212 PolarHBondContact O-N 2.8Å; H212-R214 PolarHBondContact O-N 3.08Å; H212-F215 PolarHBondContact O-N 3.46Å; H212-L216 WeakPolarHBondContact O-CB 3.5Å; H212-L216 VanDerWaalsContact O-CG 3.3Å; H212-L216 WeakPolarHBondContact O-CG 3.38Å; H212-L216 PolarHBondContact O-N 2.89Å |
| 213 | A | 94.5 | Very high | 89.2 | Confident | 58 Ų | 58 | 92.2 Ų | 92.2 | 48% | 0.479 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.3 | -45.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | D209 L216 E217 | D209-A213 WeakPolarHBondContact O-CB 3.42Å; D209-A213 PolarHBondContact O-N 2.85Å; A213-L216 PolarHBondContact O-N 3.45Å; A213-E217 WeakPolarHBondContact O-CB 3.31Å; A213-E217 PolarHBondContact O-N 3.44Å |
| 214 | R | 93.6 | Very high | 89.3 | Confident | 175 Ų | 175 | 91.6 Ų | 91.6 | 66% | 0.66 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -67.3 | -37.8 | 177.5 | -68.2 | -61.8 | -173.2 | -178.3 | 3 | 112.9 | A210 L211 H212 E217 G218 | A210-R214 VanDerWaalsContact O-CG 3.28Å; A210-R214 WeakPolarHBondContact O-CG 3.42Å; A210-R214 PolarHBondContact O-N 3.1Å; A210-R214 VanDerWaalsContact O-N 3.1Å; L211-R214 PolarHBondContact O-N 3.28Å; H212-R214 PolarHBondContact O-N 3.08Å; R214-E217 WeakPolarHBondContact CD-OE2 3.3Å; R214-E217 IonicContact CZ-OE2 2.85Å; R214-E217 IonicContact NH1-OE1 3.81Å; R214-E217 IonicContact NH1-OE2 3.48Å; R214-E217 PolarHBondContact NH1-OE2 3.09Å; R214-E217 PolarHBondContact O-N 3.14Å; R214-G218 PolarHBondContact O-N 3.47Å |
| 215 | F | 94.4 | Very high | 89.8 | Confident | 143 Ų | 143 | 92.8 Ų | 92.8 | 63% | 0.627 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.4 | -47.6 | 175.2 | -177.8 | -99.6 | 0 | 0 | 0 | 111 | L211 H212 E217 G218 V219 | L211-F215 WeakPolarHBondContact O-CB 3.36Å; L211-F215 PolarHBondContact O-N 3.4Å; H212-F215 PolarHBondContact O-N 3.46Å; F215-E217 VanDerWaalsContact C-N 3.32Å; F215-E217 PolarHBondContact O-N 3.31Å; F215-G218 PolarHBondContact O-N 3.01Å; F215-G218 VanDerWaalsContact O-N 3.14Å; F215-V219 HydrophobicContact CD1-CG2 4.2Å; F215-V219 HydrophobicContact CE1-CG2 3.83Å; F215-V219 HydrophobicContact CZ-CG2 4.09Å; F215-V219 WeakPolarHBondContact O-CG2 3.44Å; F215-V219 PolarHBondContact O-N 3.4Å |
| 216 | L | 91.9 | Very high | 90.1 | Very high | 90 Ų | 90 | 89.7 Ų | 89.7 | 47% | 0.471 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.4 | -36.9 | 176.6 | -69.7 | 174.7 | 0 | 0 | 0 | 112.4 | H212 A213 V219 R220 | H212-L216 WeakPolarHBondContact O-CB 3.5Å; H212-L216 VanDerWaalsContact O-CG 3.3Å; H212-L216 WeakPolarHBondContact O-CG 3.38Å; H212-L216 PolarHBondContact O-N 2.89Å; A213-L216 PolarHBondContact O-N 3.45Å; L216-V219 PolarHBondContact O-N 3.12Å; L216-R220 WeakPolarHBondContact O-CB 3.33Å; L216-R220 VanDerWaalsContact O-CG 3.23Å; L216-R220 WeakPolarHBondContact O-CG 3.34Å; L216-R220 PolarHBondContact O-N 2.92Å |
| 217 | E | 94.5 | Very high | 90.2 | Very high | 86 Ų | 86 | 87.5 Ų | 87.5 | 40% | 0.402 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -59.8 | -45.8 | 171.7 | -173.4 | 178.4 | -166 | 0 | 0 | 111.2 | A213 R214 F215 V219 R220 N221 | A213-E217 WeakPolarHBondContact O-CB 3.31Å; A213-E217 PolarHBondContact O-N 3.44Å; R214-E217 WeakPolarHBondContact CD-OE2 3.3Å; R214-E217 IonicContact CZ-OE2 2.85Å; R214-E217 IonicContact NH1-OE1 3.81Å; R214-E217 IonicContact NH1-OE2 3.48Å; R214-E217 PolarHBondContact NH1-OE2 3.09Å; R214-E217 PolarHBondContact O-N 3.14Å; F215-E217 VanDerWaalsContact C-N 3.32Å; F215-E217 PolarHBondContact O-N 3.31Å; E217-V219 PolarHBondContact O-N 2.95Å; E217-R220 PolarHBondContact O-N 3.19Å; E217-N221 PolarHBondContact O-N 2.9Å; E217-N221 PolarHBondContact O-ND2 3.46Å; E217-N221 PolarHBondContact O-OD1 3.03Å |
| 218 | G | 92.8 | Very high | 90.3 | Very high | 29 Ų | 29 | 91.8 Ų | 91.8 | 30% | 0.299 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -60.2 | -45.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | R214 F215 R220 N221 I222 | R214-G218 PolarHBondContact O-N 3.47Å; F215-G218 PolarHBondContact O-N 3.01Å; F215-G218 VanDerWaalsContact O-N 3.14Å; G218-R220 VanDerWaalsContact C-N 3.33Å; G218-R220 PolarHBondContact O-N 3.06Å; G218-N221 PolarHBondContact O-N 3.36Å; G218-I222 WeakPolarHBondContact O-CG1 3.1Å; G218-I222 PolarHBondContact O-N 2.93Å |
| 219 | V | 90.3 | Very high | 90.3 | Very high | 60 Ų | 60 | 90.7 Ų | 90.7 | 36% | 0.364 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -61.1 | -42.3 | 175.8 | 174 | 0 | 0 | 0 | 0 | 111.2 | F215 L216 E217 I222 A223 | F215-V219 HydrophobicContact CD1-CG2 4.2Å; F215-V219 HydrophobicContact CE1-CG2 3.83Å; F215-V219 HydrophobicContact CZ-CG2 4.09Å; F215-V219 WeakPolarHBondContact O-CG2 3.44Å; F215-V219 PolarHBondContact O-N 3.4Å; L216-V219 PolarHBondContact O-N 3.12Å; E217-V219 PolarHBondContact O-N 2.95Å; V219-I222 PolarHBondContact O-N 3.34Å; V219-A223 VanDerWaalsContact O-CB 3.31Å; V219-A223 WeakPolarHBondContact O-CB 3.37Å; V219-A223 PolarHBondContact O-N 3.09Å |
| 220 | R | 89 | Confident | 89.9 | Confident | 180 Ų | 180 | 87.4 Ų | 87.4 | 68% | 0.679 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -62.4 | -43.3 | 176.6 | -74.8 | 170.7 | -176.8 | 177.5 | 2.6 | 112 | L216 E217 G218 A223 S224 | L216-R220 WeakPolarHBondContact O-CB 3.33Å; L216-R220 VanDerWaalsContact O-CG 3.23Å; L216-R220 WeakPolarHBondContact O-CG 3.34Å; L216-R220 PolarHBondContact O-N 2.92Å; E217-R220 PolarHBondContact O-N 3.19Å; G218-R220 VanDerWaalsContact C-N 3.33Å; G218-R220 PolarHBondContact O-N 3.06Å; R220-A223 PolarHBondContact O-N 3.3Å; R220-S224 PolarHBondContact O-N 3.23Å; R220-S224 PolarHBondContact O-OG 3.37Å |
| 221 | N | 91.3 | Very high | 89.7 | Confident | 90 Ų | 90 | 92.9 Ų | 92.9 | 48% | 0.481 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -65.4 | -40.7 | 178.8 | -67.2 | -16 | 0 | 0 | 0 | 111.8 | E217 G218 S224 V225 | E217-N221 PolarHBondContact O-N 2.9Å; E217-N221 PolarHBondContact O-ND2 3.46Å; E217-N221 PolarHBondContact O-OD1 3.03Å; G218-N221 PolarHBondContact O-N 3.36Å; N221-S224 PolarHBondContact O-OG 3.25Å; N221-V225 VanDerWaalsContact O-CG2 3.26Å; N221-V225 WeakPolarHBondContact O-CG2 3.03Å; N221-V225 PolarHBondContact O-N 3.47Å; N221-V225 VanDerWaalsContact O-N 3.1Å |
| 222 | I | 89 | Confident | 89.4 | Confident | 105 Ų | 105 | 92.2 Ų | 92.2 | 54% | 0.538 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -65.3 | -44.7 | 174.5 | -67 | 167.3 | 0 | 0 | 0 | 110 | G218 V219 S224 V225 C226 | G218-I222 WeakPolarHBondContact O-CG1 3.1Å; G218-I222 PolarHBondContact O-N 2.93Å; V219-I222 PolarHBondContact O-N 3.34Å; I222-S224 PolarHBondContact O-N 2.87Å; I222-V225 PolarHBondContact O-N 3.1Å; I222-C226 WeakPolarHBondContact O-CB 3.21Å; I222-C226 PolarHBondContact O-N 3.36Å; I222-C226 PolarHBondContact O-SG 3.37Å |
| 223 | A | 86.8 | Confident | 89 | Confident | 9 Ų | 9 | 88.5 Ų | 88.5 | 7% | 0.074 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | V219 R220 C226 L227 | V219-A223 VanDerWaalsContact O-CB 3.31Å; V219-A223 WeakPolarHBondContact O-CB 3.37Å; V219-A223 PolarHBondContact O-N 3.09Å; R220-A223 PolarHBondContact O-N 3.3Å; A223-C226 PolarHBondContact O-N 3.07Å; A223-L227 WeakPolarHBondContact O-CB 3.47Å; A223-L227 WeakPolarHBondContact O-CG 3.46Å; A223-L227 PolarHBondContact O-N 2.95Å |
| 224 | S | 87.4 | Confident | 88.3 | Confident | 54 Ų | 54 | 93.8 Ų | 93.8 | 38% | 0.378 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.4 | -44.6 | 177.7 | 62.7 | 0 | 0 | 0 | 0 | 111.9 | R220 N221 I222 L227 E228 | R220-S224 PolarHBondContact O-N 3.23Å; R220-S224 PolarHBondContact O-OG 3.37Å; N221-S224 PolarHBondContact O-OG 3.25Å; I222-S224 PolarHBondContact O-N 2.87Å; S224-L227 PolarHBondContact O-N 2.99Å; S224-E228 PolarHBondContact O-N 3.01Å |
| 225 | V | 90.9 | Very high | 87.6 | Confident | 74 Ų | 74 | 87.2 Ų | 87.2 | 45% | 0.448 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.5 | -44.5 | 177.5 | 172 | 0 | 0 | 0 | 0 | 111.3 | N221 I222 L227 E228 I229 | N221-V225 VanDerWaalsContact O-CG2 3.26Å; N221-V225 WeakPolarHBondContact O-CG2 3.03Å; N221-V225 PolarHBondContact O-N 3.47Å; N221-V225 VanDerWaalsContact O-N 3.1Å; I222-V225 PolarHBondContact O-N 3.1Å; V225-L227 VanDerWaalsContact C-N 3.28Å; V225-L227 PolarHBondContact O-N 2.93Å; V225-E228 PolarHBondContact O-N 3.04Å; V225-I229 HydrophobicContact CG1-CD1 3.58Å; V225-I229 HydrophobicContact CG1-CG1 4.39Å; V225-I229 VanDerWaalsContact O-CG1 3.3Å; V225-I229 WeakPolarHBondContact O-CG1 3.35Å; V225-I229 PolarHBondContact O-N 3.4Å |
| 226 | C | 87.8 | Confident | 87.1 | Confident | 18 Ų | 18 | 80.4 Ų | 80.4 | 12% | 0.122 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -63.3 | -34.6 | 177.4 | -69.7 | 0 | 0 | 0 | 0 | 112.7 | I222 A223 G230 Y231 T233 | I222-C226 WeakPolarHBondContact O-CB 3.21Å; I222-C226 PolarHBondContact O-N 3.36Å; I222-C226 PolarHBondContact O-SG 3.37Å; A223-C226 PolarHBondContact O-N 3.07Å; C226-G230 PolarHBondContact O-N 2.88Å; C226-G230 VanDerWaalsContact O-N 3.07Å; C226-Y231 PolarHBondContact O-N 2.91Å; C226-Y231 VanDerWaalsContact O-N 3.09Å; C226-T233 HydrophobicContact CB-CG2 4.39Å; C226-T233 VanDerWaalsContact SG-CG2 3.57Å |
| 227 | L | 85.9 | Confident | 86.7 | Confident | 51 Ų | 51 | 79 Ų | 79 | 27% | 0.267 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -68.4 | -40.8 | 176.1 | -74.8 | 169.1 | 0 | 0 | 0 | 112.5 | A223 S224 V225 G230 H239 T240 | A223-L227 WeakPolarHBondContact O-CB 3.47Å; A223-L227 WeakPolarHBondContact O-CG 3.46Å; A223-L227 PolarHBondContact O-N 2.95Å; S224-L227 PolarHBondContact O-N 2.99Å; V225-L227 VanDerWaalsContact C-N 3.28Å; V225-L227 PolarHBondContact O-N 2.93Å; L227-G230 PolarHBondContact O-N 3.14Å; L227-H239 HydrophobicContact CD1-CB 3.69Å; L227-H239 HydrophobicContact CD2-CB 3.76Å; L227-H239 HydrophobicContact CG-CB 4.25Å; L227-T240 VanDerWaalsContact CD2-OG1 3.28Å; L227-T240 WeakPolarHBondContact CD2-OG1 3.32Å |
| 228 | E | 86.3 | Confident | 86.2 | Confident | 168 Ų | 168 | 78 Ų | 78 | 79% | 0.785 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -68 | -41 | 177.6 | -73.1 | -179.4 | 179.2 | 0 | 0 | 112.4 | S224 V225 G230 | S224-E228 PolarHBondContact O-N 3.01Å; V225-E228 PolarHBondContact O-N 3.04Å; E228-G230 PolarHBondContact O-N 3.03Å |
| 229 | I | 87.6 | Confident | 85.8 | Confident | 126 Ų | 126 | 81 Ų | 81 | 65% | 0.646 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -72.6 | -19.8 | 177.8 | -62.4 | 171.9 | 0 | 0 | 0 | 111.2 | V225 Y231 | V225-I229 HydrophobicContact CG1-CD1 3.58Å; V225-I229 HydrophobicContact CG1-CG1 4.39Å; V225-I229 VanDerWaalsContact O-CG1 3.3Å; V225-I229 WeakPolarHBondContact O-CG1 3.35Å; V225-I229 PolarHBondContact O-N 3.4Å; I229-Y231 VanDerWaalsContact C-N 3.27Å |
| 230 | G | 81.7 | Confident | 85.6 | Confident | 56 Ų | 56 | 81.3 Ų | 81.3 | 58% | 0.577 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 72.3 | 21.2 | -175 | 0 | 0 | 0 | 0 | 0 | 113.1 | C226 L227 E228 | C226-G230 PolarHBondContact O-N 2.88Å; C226-G230 VanDerWaalsContact O-N 3.07Å; L227-G230 PolarHBondContact O-N 3.14Å; E228-G230 PolarHBondContact O-N 3.03Å |
| 231 | Y | 84.4 | Confident | 85.5 | Confident | 158 Ų | 158 | 78.4 Ų | 78.4 | 62% | 0.62 | 44% | 0.437 | S | S | * | . | trans | -90.8 | 118.3 | 178.6 | -166.8 | -99.8 | 0 | 0 | 0 | 110.3 | C226 I229 T233 S236 | C226-Y231 PolarHBondContact O-N 2.91Å; C226-Y231 VanDerWaalsContact O-N 3.09Å; I229-Y231 VanDerWaalsContact C-N 3.27Å; Y231-T233 HydrophobicContact CD1-CG2 3.78Å; Y231-T233 HydrophobicContact CE1-CG2 4.17Å; Y231-T233 PolarHBondContact O-N 3.29Å; Y231-T233 VanDerWaalsContact O-N 3.17Å; Y231-S236 PolarHBondContact O-OG 2.94Å | ||
| 232 | P | 83.4 | Confident | 85.2 | Confident | 89 Ų | 89 | 78 Ų | 78 | 58% | 0.578 | 43% | 0.434 | S | S | * | . | trans | -76.1 | 107.3 | -177.2 | 29.1 | -32.1 | 0 | 0 | 0 | 110.8 | V237 | P232-V237 HydrophobicContact CB-CG2 3.73Š| ||
| 233 | T | 84.9 | Confident | 85.1 | Confident | 40 Ų | 40 | 76 Ų | 76 | 25% | 0.245 | 43% | 0.425 | C | S | . | . | trans | -108.1 | 162.3 | 167.2 | 62.2 | 0 | 0 | 0 | 0 | 109.3 | C226 Y231 A235 S236 V237 | C226-T233 HydrophobicContact CB-CG2 4.39Å; C226-T233 VanDerWaalsContact SG-CG2 3.57Å; Y231-T233 HydrophobicContact CD1-CG2 3.78Å; Y231-T233 HydrophobicContact CE1-CG2 4.17Å; Y231-T233 PolarHBondContact O-N 3.29Å; Y231-T233 VanDerWaalsContact O-N 3.17Å; T233-A235 PolarHBondContact O-N 2.95Å; T233-A235 VanDerWaalsContact O-N 3.09Å; T233-S236 PolarHBondContact N-OG 3.31Å; T233-S236 PolarHBondContact O-N 3.38Å; T233-S236 PolarHBondContact O-OG 3.17Å; T233-S236 PolarHBondContact OG1-N 3.27Å; T233-S236 PolarHBondContact OG1-OG 3.04Å; T233-V237 VanDerWaalsContact O-CG2 3.29Å; T233-V237 WeakPolarHBondContact O-CG2 3.41Å; T233-V237 PolarHBondContact O-N 3.38Å | ||
| 234 | L | 80.6 | Confident | 85 | Confident | 169 Ų | 169 | 77.3 Ų | 77.3 | 89% | 0.885 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.8 | -33.6 | 179.9 | -165.6 | 150.4 | 0 | 0 | 0 | 112.2 | ||
| 235 | A | 78 | Confident | 84.9 | Confident | 37 Ų | 37 | 78.9 Ų | 78.9 | 31% | 0.306 | 44% | 0.437 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.5 | -32.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | T233 H239 | T233-A235 PolarHBondContact O-N 2.95Å; T233-A235 VanDerWaalsContact O-N 3.09Å; A235-H239 PolarHBondContact O-CD2 3.49Å; A235-H239 VanDerWaalsContact O-CD2 3.27Å |
| 236 | S | 83.9 | Confident | 84.6 | Confident | 0 Ų | 0 | 81.3 Ų | 81.3 | 0% | 0 | 44% | 0.442 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | -29.8 | -175.8 | 71.3 | 0 | 0 | 0 | 0 | 114 | Y231 T233 H239 T240 | Y231-S236 PolarHBondContact O-OG 2.94Å; T233-S236 PolarHBondContact N-OG 3.31Å; T233-S236 PolarHBondContact O-N 3.38Å; T233-S236 PolarHBondContact O-OG 3.17Å; T233-S236 PolarHBondContact OG1-N 3.27Å; T233-S236 PolarHBondContact OG1-OG 3.04Å; S236-H239 PolarHBondContact O-N 3.31Å; S236-T240 PolarHBondContact O-N 2.92Å; S236-T240 PolarHBondContact O-OG1 3.42Å; S236-T240 VanDerWaalsContact O-OG1 3.06Å |
| 237 | V | 84.6 | Confident | 84.5 | Confident | 60 Ų | 60 | 89.8 Ų | 89.8 | 36% | 0.364 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -52.4 | -47.8 | -175.5 | 168.3 | 0 | 0 | 0 | 0 | 113.7 | P232 T233 H239 T240 I241 | P232-V237 HydrophobicContact CB-CG2 3.73Å; T233-V237 VanDerWaalsContact O-CG2 3.29Å; T233-V237 WeakPolarHBondContact O-CG2 3.41Å; T233-V237 PolarHBondContact O-N 3.38Å; V237-H239 VanDerWaalsContact C-N 3.29Å; V237-H239 PolarHBondContact O-N 3.24Å; V237-T240 PolarHBondContact O-N 2.83Å; V237-I241 HydrophobicContact CG1-CD1 4.02Å; V237-I241 WeakPolarHBondContact O-CG1 3.44Å; V237-I241 PolarHBondContact O-N 2.96Å |
| 238 | P | 83.1 | Confident | 84.4 | Confident | 65 Ų | 65 | 91.7 Ų | 91.7 | 42% | 0.422 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.5 | -41.3 | 178.4 | -21.1 | 32.6 | 0 | 0 | 0 | 111.9 | I242 | P238-I242 WeakPolarHBondContact O-CB 3.31Å; P238-I242 WeakPolarHBondContact O-CD1 3.41Å; P238-I242 WeakPolarHBondContact O-CG1 3.44Å; P238-I242 PolarHBondContact O-N 3Å; P238-I242 VanDerWaalsContact O-N 3.09Å |
| 239 | H | 85.4 | Confident | 84.2 | Confident | 91 Ų | 91 | 84.5 Ų | 84.5 | 42% | 0.421 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -70.5 | -35.9 | -179.6 | -64.5 | -59 | 0 | 0 | 0 | 112.3 | L227 A235 S236 V237 I242 N243 | L227-H239 HydrophobicContact CD1-CB 3.69Å; L227-H239 HydrophobicContact CD2-CB 3.76Å; L227-H239 HydrophobicContact CG-CB 4.25Å; A235-H239 PolarHBondContact O-CD2 3.49Å; A235-H239 VanDerWaalsContact O-CD2 3.27Å; S236-H239 PolarHBondContact O-N 3.31Å; V237-H239 VanDerWaalsContact C-N 3.29Å; V237-H239 PolarHBondContact O-N 3.24Å; H239-I242 PolarHBondContact O-N 3.4Å; H239-N243 VanDerWaalsContact O-CB 3.26Å; H239-N243 WeakPolarHBondContact O-CB 3.4Å; H239-N243 PolarHBondContact O-N 3.26Å; H239-N243 PolarHBondContact O-ND2 3.07Å |
| 240 | T | 85.8 | Confident | 83.9 | Confident | 67 Ų | 67 | 80.9 Ų | 80.9 | 41% | 0.411 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62.9 | -45 | 176.1 | -53.2 | 0 | 0 | 0 | 0 | 111.5 | L227 S236 V237 N243 G244 | L227-T240 VanDerWaalsContact CD2-OG1 3.28Å; L227-T240 WeakPolarHBondContact CD2-OG1 3.32Å; S236-T240 PolarHBondContact O-N 2.92Å; S236-T240 PolarHBondContact O-OG1 3.42Å; S236-T240 VanDerWaalsContact O-OG1 3.06Å; V237-T240 PolarHBondContact O-N 2.83Å; T240-N243 PolarHBondContact O-N 3.17Å; T240-G244 PolarHBondContact O-N 3.14Å |
| 241 | I | 85.8 | Confident | 83.9 | Confident | 119 Ų | 119 | 82.2 Ų | 82.2 | 61% | 0.61 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -65.6 | -45.7 | 178.8 | -63.7 | 168.8 | 0 | 0 | 0 | 110.4 | V237 N243 G244 Y245 | V237-I241 HydrophobicContact CG1-CD1 4.02Å; V237-I241 WeakPolarHBondContact O-CG1 3.44Å; V237-I241 PolarHBondContact O-N 2.96Å; I241-N243 PolarHBondContact O-N 2.86Å; I241-G244 PolarHBondContact O-N 3.09Å; I241-Y245 WeakPolarHBondContact O-CB 3.41Å; I241-Y245 PolarHBondContact O-N 3.18Å |
| 242 | I | 86.1 | Confident | 83.8 | Confident | 82 Ų | 82 | 75 Ų | 75 | 42% | 0.421 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -63.1 | -41.4 | 178.2 | -68 | 165.3 | 0 | 0 | 0 | 111.1 | P238 H239 Y245 K246 | P238-I242 WeakPolarHBondContact O-CB 3.31Å; P238-I242 WeakPolarHBondContact O-CD1 3.41Å; P238-I242 WeakPolarHBondContact O-CG1 3.44Å; P238-I242 PolarHBondContact O-N 3Å; P238-I242 VanDerWaalsContact O-N 3.09Å; H239-I242 PolarHBondContact O-N 3.4Å; I242-Y245 PolarHBondContact O-N 2.97Å; I242-K246 HydrophobicContact CG2-CD 4.2Å; I242-K246 HydrophobicContact CG2-CG 4.4Å; I242-K246 WeakPolarHBondContact O-CG 3.29Å; I242-K246 PolarHBondContact O-N 3.13Å |
| 243 | N | 86.3 | Confident | 83.5 | Confident | 64 Ų | 64 | 73.3 Ų | 73.3 | 34% | 0.342 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -67 | -38.9 | 178.1 | -74.5 | -16 | 0 | 0 | 0 | 111.9 | H239 T240 I241 Y245 K246 R247 | H239-N243 VanDerWaalsContact O-CB 3.26Å; H239-N243 WeakPolarHBondContact O-CB 3.4Å; H239-N243 PolarHBondContact O-N 3.26Å; H239-N243 PolarHBondContact O-ND2 3.07Å; T240-N243 PolarHBondContact O-N 3.17Å; I241-N243 PolarHBondContact O-N 2.86Å; N243-Y245 VanDerWaalsContact C-N 3.34Å; N243-K246 PolarHBondContact O-N 3.25Å; N243-R247 WeakPolarHBondContact O-CG 3.31Å; N243-R247 PolarHBondContact O-N 3.41Å |
| 244 | G | 84.9 | Confident | 83.3 | Confident | 36 Ų | 36 | 79.2 Ų | 79.2 | 37% | 0.371 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -58.6 | -46.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | T240 I241 K246 R247 V248 | T240-G244 PolarHBondContact O-N 3.14Å; I241-G244 PolarHBondContact O-N 3.09Å; G244-K246 PolarHBondContact O-N 3.01Å; G244-R247 PolarHBondContact O-N 3.11Å; G244-V248 PolarHBondContact O-N 3.15Å |
| 245 | Y | 85.3 | Confident | 83.2 | Confident | 86 Ų | 86 | 75.3 Ų | 75.3 | 34% | 0.337 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -61.9 | -43.2 | 176.2 | -176.6 | -110.4 | 0 | 0 | 0 | 112.7 | I241 I242 N243 R247 V248 L249 F259 L261 | I241-Y245 WeakPolarHBondContact O-CB 3.41Å; I241-Y245 PolarHBondContact O-N 3.18Å; I242-Y245 PolarHBondContact O-N 2.97Å; N243-Y245 VanDerWaalsContact C-N 3.34Å; Y245-R247 VanDerWaalsContact C-N 3.35Å; Y245-R247 PolarHBondContact O-N 3.36Å; Y245-V248 PolarHBondContact O-N 2.96Å; Y245-L249 HydrophobicContact CD1-CD1 3.63Å; Y245-L249 HydrophobicContact CD1-CG 4.3Å; Y245-L249 HydrophobicContact CE1-CD1 3.18Å; Y245-L249 HydrophobicContact CE1-CG 3.93Å; Y245-L249 HydrophobicContact CE2-CD1 4.44Å; Y245-L249 HydrophobicContact CE2-CG 4.31Å; Y245-L249 HydrophobicContact CG-CD1 4.42Å; Y245-L249 WeakPolarHBondContact O-CB 3.41Å; Y245-L249 WeakPolarHBondContact O-CG 3.41Å; Y245-L249 PolarHBondContact O-N 3.09Å; Y245-F259 HydrophobicContact CE2-CE2 4.37Å; Y245-F259 HydrophobicContact CE2-CZ 4.11Å; Y245-L261 HydrophobicContact CE2-CB 4.29Å; Y245-L261 HydrophobicContact CE2-CD1 3.98Å; Y245-L261 WeakPolarHBondContact OH-CB 3.03Å; Y245-L261 PolarHBondContact OH-O 2.93Å |
| 246 | K | 85.3 | Confident | 82.8 | Confident | 125 Ų | 125 | 80 Ų | 80 | 54% | 0.543 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -60.6 | -39 | 175.1 | -76.2 | 177.8 | 178.5 | -178.5 | 0 | 112.9 | I242 N243 G244 L249 A250 | I242-K246 HydrophobicContact CG2-CD 4.2Å; I242-K246 HydrophobicContact CG2-CG 4.4Å; I242-K246 WeakPolarHBondContact O-CG 3.29Å; I242-K246 PolarHBondContact O-N 3.13Å; N243-K246 PolarHBondContact O-N 3.25Å; G244-K246 PolarHBondContact O-N 3.01Å; K246-L249 PolarHBondContact O-N 3.34Å; K246-A250 WeakPolarHBondContact O-CB 2.88Å; K246-A250 PolarHBondContact O-N 3.22Å |
| 247 | R | 85.5 | Confident | 82.2 | Confident | 196 Ų | 196 | 88 Ų | 88 | 74% | 0.74 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -65.1 | -42.8 | 177.4 | -73.8 | 176.2 | 179.6 | 178.5 | 0.7 | 112 | N243 G244 Y245 A250 V251 | N243-R247 WeakPolarHBondContact O-CG 3.31Å; N243-R247 PolarHBondContact O-N 3.41Å; G244-R247 PolarHBondContact O-N 3.11Å; Y245-R247 VanDerWaalsContact C-N 3.35Å; Y245-R247 PolarHBondContact O-N 3.36Å; R247-A250 PolarHBondContact O-N 3.17Å; R247-V251 PolarHBondContact O-N 3.42Å |
| 248 | V | 84.2 | Confident | 81.3 | Confident | 91 Ų | 91 | 89 Ų | 89 | 55% | 0.552 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -66.8 | -41.4 | 176 | 176.9 | 0 | 0 | 0 | 0 | 111 | G244 Y245 V251 A252 | G244-V248 PolarHBondContact O-N 3.15Å; Y245-V248 PolarHBondContact O-N 2.96Å; V248-V251 PolarHBondContact O-N 2.85Å; V248-A252 WeakPolarHBondContact O-CB 3.18Å; V248-A252 PolarHBondContact O-N 2.98Å |
| 249 | L | 81 | Confident | 81 | Confident | 18 Ų | 18 | 88.1 Ų | 88.1 | 9% | 0.094 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -61.1 | -43.4 | 174.6 | -79.8 | 176.1 | 0 | 0 | 0 | 112.6 | Y245 K246 V251 A252 V253 F259 A262 V265 | Y245-L249 HydrophobicContact CD1-CD1 3.63Å; Y245-L249 HydrophobicContact CD1-CG 4.3Å; Y245-L249 HydrophobicContact CE1-CD1 3.18Å; Y245-L249 HydrophobicContact CE1-CG 3.93Å; Y245-L249 HydrophobicContact CE2-CD1 4.44Å; Y245-L249 HydrophobicContact CE2-CG 4.31Å; Y245-L249 HydrophobicContact CG-CD1 4.42Å; Y245-L249 WeakPolarHBondContact O-CB 3.41Å; Y245-L249 WeakPolarHBondContact O-CG 3.41Å; Y245-L249 PolarHBondContact O-N 3.09Å; K246-L249 PolarHBondContact O-N 3.34Å; L249-V251 VanDerWaalsContact C-N 3.31Å; L249-V251 PolarHBondContact O-N 3.41Å; L249-A252 PolarHBondContact O-N 3.06Å; L249-V253 VanDerWaalsContact O-CG2 3.31Å; L249-V253 WeakPolarHBondContact O-CG2 3.38Å; L249-V253 PolarHBondContact O-N 3.28Å; L249-F259 HydrophobicContact CD2-CE1 3.75Å; L249-F259 HydrophobicContact CD2-CZ 3.58Å; L249-F259 HydrophobicContact CG-CZ 4.39Å; L249-A262 HydrophobicContact CD2-CB 4.03Å; L249-V265 HydrophobicContact CD1-CG2 4.04Å; L249-V265 HydrophobicContact CD2-CB 4.32Å; L249-V265 HydrophobicContact CD2-CG2 4.2Å |
| 250 | A | 82.3 | Confident | 80.4 | Confident | 49 Ų | 49 | 88.6 Ų | 88.6 | 41% | 0.405 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -57.1 | -46 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | K246 R247 A252 V253 E254 | K246-A250 WeakPolarHBondContact O-CB 2.88Å; K246-A250 PolarHBondContact O-N 3.22Å; R247-A250 PolarHBondContact O-N 3.17Å; A250-A252 PolarHBondContact O-N 3.36Å; A250-V253 PolarHBondContact O-N 3.16Å; A250-E254 PolarHBondContact O-N 2.94Å |
| 251 | V | 82.3 | Confident | 79.6 | Confident | 85 Ų | 85 | 89.6 Ų | 89.6 | 52% | 0.515 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.7 | -42.7 | 176.1 | 177.2 | 0 | 0 | 0 | 0 | 111.6 | R247 V248 L249 V253 E254 T255 | R247-V251 PolarHBondContact O-N 3.42Å; V248-V251 PolarHBondContact O-N 2.85Å; L249-V251 VanDerWaalsContact C-N 3.31Å; L249-V251 PolarHBondContact O-N 3.41Å; V251-V253 VanDerWaalsContact C-N 3.3Å; V251-V253 PolarHBondContact O-N 3.1Å; V251-E254 PolarHBondContact O-N 3.39Å; V251-T255 HydrophobicContact CG1-CG2 4.28Å; V251-T255 WeakPolarHBondContact O-CB 3.34Å; V251-T255 WeakPolarHBondContact O-CG2 3.39Å; V251-T255 PolarHBondContact O-N 2.94Å; V251-T255 PolarHBondContact O-OG1 3.41Å |
| 252 | A | 81 | Confident | 78.6 | Confident | 7 Ų | 7 | 84 Ų | 84 | 6% | 0.058 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -67.1 | -30.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | V248 L249 A250 D256 Y257 F259 A262 K266 | V248-A252 WeakPolarHBondContact O-CB 3.18Å; V248-A252 PolarHBondContact O-N 2.98Å; L249-A252 PolarHBondContact O-N 3.06Å; A250-A252 PolarHBondContact O-N 3.36Å; A252-D256 PolarHBondContact O-N 3.25Å; A252-Y257 PolarHBondContact O-N 2.88Å; A252-F259 HydrophobicContact CB-CD1 4.11Å; A252-F259 HydrophobicContact CB-CE1 4.02Å; A252-A262 HydrophobicContact CB-CB 4.2Å; A252-K266 WeakPolarHBondContact O-CE 3.44Å; A252-K266 PolarHBondContact O-NZ 3.09Å |
| 253 | V | 77.7 | Confident | 77.6 | Confident | 53 Ų | 53 | 83.4 Ų | 83.4 | 32% | 0.321 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -72.1 | -44.7 | 173.7 | 172 | 0 | 0 | 0 | 0 | 110.9 | L249 A250 V251 K266 L269 | L249-V253 VanDerWaalsContact O-CG2 3.31Å; L249-V253 WeakPolarHBondContact O-CG2 3.38Å; L249-V253 PolarHBondContact O-N 3.28Å; A250-V253 PolarHBondContact O-N 3.16Å; V251-V253 VanDerWaalsContact C-N 3.3Å; V251-V253 PolarHBondContact O-N 3.1Å; V253-K266 HydrophobicContact CG2-CG 4.28Å; V253-L269 HydrophobicContact CG2-CD1 4.3Å |
| 254 | E | 79.9 | Confident | 76.7 | Confident | 163 Ų | 163 | 86.9 Ų | 86.9 | 76% | 0.762 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -71.2 | -29.3 | -179.8 | -71.9 | 176.9 | 178 | 0 | 0 | 113.9 | A250 V251 | A250-E254 PolarHBondContact O-N 2.94Å; V251-E254 PolarHBondContact O-N 3.39Å |
| 255 | T | 78.4 | Confident | 75.8 | Confident | 87 Ų | 87 | 87.2 Ų | 87.2 | 53% | 0.534 | 45% | 0.446 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.1 | 6 | -177 | 58.6 | 0 | 0 | 0 | 0 | 113.8 | V251 Y257 | V251-T255 HydrophobicContact CG1-CG2 4.28Å; V251-T255 WeakPolarHBondContact O-CB 3.34Å; V251-T255 WeakPolarHBondContact O-CG2 3.39Å; V251-T255 PolarHBondContact O-N 2.94Å; V251-T255 PolarHBondContact O-OG1 3.41Å; T255-Y257 PolarHBondContact O-N 3.4Å |
| 256 | D | 69.6 | Low | 74.8 | Confident | 136 Ų | 136 | 85.4 Ų | 85.4 | 73% | 0.727 | 44% | 0.44 | S | S | * | . | trans | 53.8 | 14 | -175.5 | -70 | -39.8 | 0 | 0 | 0 | 115.6 | A252 S258 K266 | A252-D256 PolarHBondContact O-N 3.25Å; D256-S258 PolarHBondContact O-N 3.49Å; D256-K266 PolarHBondContact O-NZ 3.39Å | ||
| 257 | Y | 72.8 | Confident | 73.9 | Confident | 168 Ų | 168 | 81.9 Ų | 81.9 | 66% | 0.659 | 43% | 0.434 | S | S | * | . | trans | -68.5 | 127.6 | 179.7 | -161.5 | -96.9 | 0 | 0 | 0 | 111.4 | A252 T255 K266 | A252-Y257 PolarHBondContact O-N 2.88Å; T255-Y257 PolarHBondContact O-N 3.4Å; Y257-K266 PolarHBondContact O-NZ 3.44Å | ||
| 258 | S | 65.8 | Low | 72.9 | Confident | 82 Ų | 82 | 78.4 Ų | 78.4 | 57% | 0.573 | 42% | 0.422 | S | S | * | . | trans | -89.7 | 130.5 | -177.4 | 60.5 | 0 | 0 | 0 | 0 | 111.5 | D256 D263 | D256-S258 PolarHBondContact O-N 3.49Å; S258-D263 WeakPolarHBondContact CA-OD1 3.4Å; S258-D263 WeakPolarHBondContact CB-OD1 3.36Å | ||
| 259 | F | 75.1 | Confident | 71.9 | Confident | 45 Ų | 45 | 79.6 Ų | 79.6 | 20% | 0.197 | 43% | 0.425 | C | S | . | . | trans | -146.3 | 152.4 | 167.2 | 85.6 | -98.8 | 0 | 0 | 0 | 109.9 | Y245 L249 A252 L261 A262 D263 | Y245-F259 HydrophobicContact CE2-CE2 4.37Å; Y245-F259 HydrophobicContact CE2-CZ 4.11Å; L249-F259 HydrophobicContact CD2-CE1 3.75Å; L249-F259 HydrophobicContact CD2-CZ 3.58Å; L249-F259 HydrophobicContact CG-CZ 4.39Å; A252-F259 HydrophobicContact CB-CD1 4.11Å; A252-F259 HydrophobicContact CB-CE1 4.02Å; F259-L261 HydrophobicContact CD2-CB 4Å; F259-L261 HydrophobicContact CD2-CG 4.35Å; F259-L261 VanDerWaalsContact CD2-N 3.28Å; F259-L261 HydrophobicContact CE2-CB 3.32Å; F259-L261 HydrophobicContact CE2-CD1 4.06Å; F259-L261 HydrophobicContact CE2-CG 3.86Å; F259-L261 HydrophobicContact CZ-CB 4.04Å; F259-L261 PolarHBondContact O-N 2.89Å; F259-A262 HydrophobicContact CD1-CB 3.08Å; F259-A262 HydrophobicContact CD2-CB 4.45Å; F259-A262 HydrophobicContact CE1-CB 3.11Å; F259-A262 HydrophobicContact CE2-CB 4.49Å; F259-A262 VanDerWaalsContact CE2-N 3.29Å; F259-A262 HydrophobicContact CG-CB 3.8Å; F259-A262 HydrophobicContact CZ-CB 3.85Å; F259-A262 WeakPolarHBondContact O-CA 3.34Å; F259-A262 PolarHBondContact O-N 3.01Å; F259-D263 PolarHBondContact N-OD1 3.01Å; F259-D263 PolarHBondContact O-N 3.29Å | ||
| 260 | P | 73.2 | Confident | 71.3 | Confident | 101 Ų | 101 | 82.1 Ų | 82.1 | 66% | 0.656 | 45% | 0.448 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.8 | -24.9 | -167.3 | -26.2 | 32.3 | 0 | 0 | 0 | 116.1 | ||
| 261 | L | 68.6 | Low | 70 | Confident | 89 Ų | 89 | 84.6 Ų | 84.6 | 47% | 0.466 | 46% | 0.455 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | -19.8 | 175 | -36 | 162.2 | 0 | 0 | 0 | 113.6 | Y245 F259 V265 | Y245-L261 HydrophobicContact CE2-CB 4.29Å; Y245-L261 HydrophobicContact CE2-CD1 3.98Å; Y245-L261 WeakPolarHBondContact OH-CB 3.03Å; Y245-L261 PolarHBondContact OH-O 2.93Å; F259-L261 HydrophobicContact CD2-CB 4Å; F259-L261 HydrophobicContact CD2-CG 4.35Å; F259-L261 VanDerWaalsContact CD2-N 3.28Å; F259-L261 HydrophobicContact CE2-CB 3.32Å; F259-L261 HydrophobicContact CE2-CD1 4.06Å; F259-L261 HydrophobicContact CE2-CG 3.86Å; F259-L261 HydrophobicContact CZ-CB 4.04Å; F259-L261 PolarHBondContact O-N 2.89Å; L261-V265 WeakPolarHBondContact O-CG2 3.13Å |
| 262 | A | 65.4 | Low | 68.7 | Low | 0 Ų | 0 | 85.2 Ų | 85.2 | 0% | 0 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -71.4 | -39 | 165.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | L249 A252 F259 K264 V265 K266 | L249-A262 HydrophobicContact CD2-CB 4.03Å; A252-A262 HydrophobicContact CB-CB 4.2Å; F259-A262 HydrophobicContact CD1-CB 3.08Å; F259-A262 HydrophobicContact CD2-CB 4.45Å; F259-A262 HydrophobicContact CE1-CB 3.11Å; F259-A262 HydrophobicContact CE2-CB 4.49Å; F259-A262 VanDerWaalsContact CE2-N 3.29Å; F259-A262 HydrophobicContact CG-CB 3.8Å; F259-A262 HydrophobicContact CZ-CB 3.85Å; F259-A262 WeakPolarHBondContact O-CA 3.34Å; F259-A262 PolarHBondContact O-N 3.01Å; A262-K264 PolarHBondContact O-N 2.93Å; A262-V265 CarbonylContact O-C 3.53Å; A262-V265 WeakPolarHBondContact O-CA 3.37Å; A262-V265 PolarHBondContact O-N 3.28Å; A262-K266 WeakPolarHBondContact O-CB 3.36Å; A262-K266 WeakPolarHBondContact O-CG 3.12Å; A262-K266 PolarHBondContact O-N 3.2Å |
| 263 | D | 64.8 | Low | 67.5 | Low | 71 Ų | 71 | 90.4 Ų | 90.4 | 38% | 0.38 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.9 | -34.6 | -174.1 | -57 | -23.8 | 0 | 0 | 0 | 110.7 | S258 F259 A267 | S258-D263 WeakPolarHBondContact CA-OD1 3.4Å; S258-D263 WeakPolarHBondContact CB-OD1 3.36Å; F259-D263 PolarHBondContact N-OD1 3.01Å; F259-D263 PolarHBondContact O-N 3.29Å; D263-A267 WeakPolarHBondContact O-CB 3.34Å; D263-A267 PolarHBondContact O-N 3.22Å |
| 264 | K | 68.8 | Low | 66.5 | Low | 137 Ų | 137 | 90.9 Ų | 90.9 | 60% | 0.596 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.3 | -44.7 | 170.3 | -66.4 | -177.4 | -178.5 | -177.6 | 0 | 111.8 | A262 A267 Y268 | A262-K264 PolarHBondContact O-N 2.93Å; K264-A267 PolarHBondContact O-N 3.46Å; K264-Y268 WeakPolarHBondContact O-CD2 3.48Å; K264-Y268 PolarHBondContact O-N 3.4Å |
| 265 | V | 65.3 | Low | 65.1 | Low | 42 Ų | 42 | 89.3 Ų | 89.3 | 26% | 0.255 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -73.4 | -35.4 | -179.2 | 178.9 | 0 | 0 | 0 | 0 | 111.9 | L249 L261 A262 A267 Y268 L269 | L249-V265 HydrophobicContact CD1-CG2 4.04Å; L249-V265 HydrophobicContact CD2-CB 4.32Å; L249-V265 HydrophobicContact CD2-CG2 4.2Å; L261-V265 WeakPolarHBondContact O-CG2 3.13Å; A262-V265 CarbonylContact O-C 3.53Å; A262-V265 WeakPolarHBondContact O-CA 3.37Å; A262-V265 PolarHBondContact O-N 3.28Å; V265-A267 VanDerWaalsContact C-N 3.33Å; V265-Y268 WeakPolarHBondContact O-CB 3.4Å; V265-Y268 PolarHBondContact O-N 3.23Å; V265-L269 HydrophobicContact CG1-CD1 4.18Å; V265-L269 HydrophobicContact CG1-CG 4.46Å; V265-L269 WeakPolarHBondContact O-CG 3.41Å; V265-L269 PolarHBondContact O-N 3.18Å |
| 266 | K | 64.8 | Low | 63.4 | Low | 48 Ų | 48 | 88.7 Ų | 88.7 | 21% | 0.209 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -62.7 | -40.1 | 171.4 | -73.5 | 177.7 | 173 | 179.7 | 0 | 111 | A252 V253 D256 Y257 A262 L269 A270 | A252-K266 WeakPolarHBondContact O-CE 3.44Å; A252-K266 PolarHBondContact O-NZ 3.09Å; V253-K266 HydrophobicContact CG2-CG 4.28Å; D256-K266 PolarHBondContact O-NZ 3.39Å; Y257-K266 PolarHBondContact O-NZ 3.44Å; A262-K266 WeakPolarHBondContact O-CB 3.36Å; A262-K266 WeakPolarHBondContact O-CG 3.12Å; A262-K266 PolarHBondContact O-N 3.2Å; K266-L269 PolarHBondContact O-N 3.36Å; K266-A270 WeakPolarHBondContact O-CB 3.05Å; K266-A270 PolarHBondContact O-N 3.17Å |
| 267 | A | 65.9 | Low | 62.2 | Low | 51 Ų | 51 | 89 Ų | 89 | 42% | 0.421 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 171.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | D263 K264 V265 L269 A270 D271 | D263-A267 WeakPolarHBondContact O-CB 3.34Å; D263-A267 PolarHBondContact O-N 3.22Å; K264-A267 PolarHBondContact O-N 3.46Å; V265-A267 VanDerWaalsContact C-N 3.33Å; A267-L269 PolarHBondContact O-N 3.23Å; A267-A270 PolarHBondContact O-N 3.1Å; A267-D271 PolarHBondContact O-N 3.31Å; A267-D271 VanDerWaalsContact O-N 3.11Å |
| 268 | Y | 64.6 | Low | 60.6 | Low | 123 Ų | 123 | 85.7 Ų | 85.7 | 48% | 0.482 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.5 | -35.3 | 173.4 | -83.9 | -70.6 | 0 | 0 | 0 | 113.7 | K264 V265 F275 | K264-Y268 WeakPolarHBondContact O-CD2 3.48Å; K264-Y268 PolarHBondContact O-N 3.4Å; V265-Y268 WeakPolarHBondContact O-CB 3.4Å; V265-Y268 PolarHBondContact O-N 3.23Å; Y268-F275 HydrophobicContact CD1-CB 4.42Å; Y268-F275 AromaticContact CD1-CD2 3.82Å; Y268-F275 HydrophobicContact CD1-CD2 3.82Å; Y268-F275 HydrophobicContact CD1-CE2 4.43Å; Y268-F275 HydrophobicContact CD1-CG 4.26Å; Y268-F275 HydrophobicContact CE1-CB 3.79Å; Y268-F275 HydrophobicContact CE1-CD1 4.2Å; Y268-F275 AromaticContact CE1-CD2 3.49Å; Y268-F275 HydrophobicContact CE1-CD2 3.49Å; Y268-F275 VanDerWaalsContact CE1-CD2 3.49Å; Y268-F275 HydrophobicContact CE1-CE2 4.1Å; Y268-F275 AromaticContact CE1-CG 3.55Å; Y268-F275 HydrophobicContact CE1-CG 3.55Å |
| 269 | L | 63.5 | Low | 58.8 | Low | 117 Ų | 117 | 85.4 Ų | 85.4 | 61% | 0.613 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -79.1 | -30 | 178.7 | -70.9 | 171.6 | 0 | 0 | 0 | 112.5 | V253 V265 K266 A267 | V253-L269 HydrophobicContact CG2-CD1 4.3Å; V265-L269 HydrophobicContact CG1-CD1 4.18Å; V265-L269 HydrophobicContact CG1-CG 4.46Å; V265-L269 WeakPolarHBondContact O-CG 3.41Å; V265-L269 PolarHBondContact O-N 3.18Å; K266-L269 PolarHBondContact O-N 3.36Å; A267-L269 PolarHBondContact O-N 3.23Å |
| 270 | A | 67.9 | Low | 56.8 | Low | 71 Ų | 71 | 89.4 Ų | 89.4 | 59% | 0.587 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -73.5 | -38.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | K266 A267 | K266-A270 WeakPolarHBondContact O-CB 3.05Å; K266-A270 PolarHBondContact O-N 3.17Å; A267-A270 PolarHBondContact O-N 3.1Å |
| 271 | D | 54.3 | Low | 54.7 | Low | 100 Ų | 100 | 91 Ų | 91 | 54% | 0.535 | 55% | 0.55 | S | S | . | * | trans | -129.7 | 81.7 | -178 | -71.3 | -42.7 | 0 | 0 | 0 | 112.7 | A267 T273 A274 | A267-D271 PolarHBondContact O-N 3.31Å; A267-D271 VanDerWaalsContact O-N 3.11Å; D271-T273 PolarHBondContact O-N 3.24Å; D271-A274 HydrophobicContact CB-CB 4.37Å | ||
| 272 | P | 55.8 | Low | 52.7 | Low | 99 Ų | 99 | 91.1 Ų | 91.1 | 64% | 0.643 | 56% | 0.564 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.7 | -12.7 | -179.1 | 25.5 | -32.8 | 0 | 0 | 0 | 114.5 | ||
| 273 | T | 56.3 | Low | 50.8 | Low | 116 Ų | 116 | 95.6 Ų | 95.6 | 71% | 0.712 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.6 | -16.2 | -178.1 | 49 | 0 | 0 | 0 | 0 | 114.4 | D271 F275 | D271-T273 PolarHBondContact O-N 3.24Å; T273-F275 VanDerWaalsContact C-N 3.27Å; T273-F275 PolarHBondContact O-N 3.46Å |
| 274 | A | 55.8 | Low | 48.9 | Very low | 63 Ų | 63 | 96.6 Ų | 96.6 | 52% | 0.521 | 62% | 0.619 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74 | -15 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114 | D271 | D271-A274 HydrophobicContact CB-CB 4.37Š|
| 275 | F | 50.4 | Low | 46.7 | Very low | 130 Ų | 130 | 96.1 Ų | 96.1 | 57% | 0.57 | 63% | 0.627 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -127.6 | 9.3 | -175 | -63.9 | -80.1 | 0 | 0 | 0 | 114.5 | Y268 T273 V277 | Y268-F275 HydrophobicContact CD1-CB 4.42Å; Y268-F275 AromaticContact CD1-CD2 3.82Å; Y268-F275 HydrophobicContact CD1-CD2 3.82Å; Y268-F275 HydrophobicContact CD1-CE2 4.43Å; Y268-F275 HydrophobicContact CD1-CG 4.26Å; Y268-F275 HydrophobicContact CE1-CB 3.79Å; Y268-F275 HydrophobicContact CE1-CD1 4.2Å; Y268-F275 AromaticContact CE1-CD2 3.49Å; Y268-F275 HydrophobicContact CE1-CD2 3.49Å; Y268-F275 VanDerWaalsContact CE1-CD2 3.49Å; Y268-F275 HydrophobicContact CE1-CE2 4.1Å; Y268-F275 AromaticContact CE1-CG 3.55Å; Y268-F275 HydrophobicContact CE1-CG 3.55Å; T273-F275 VanDerWaalsContact C-N 3.27Å; T273-F275 PolarHBondContact O-N 3.46Å; F275-V277 PolarHBondContact O-N 3.4Å |
| 276 | A | 42.6 | Very low | 44.7 | Very low | 74 Ų | 74 | 100.4 Ų | 100.4 | 61% | 0.612 | 65% | 0.654 | S | S | * | * | G | 310 helix | trans | -76.5 | 5.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | A278 | A276-A278 VanDerWaalsContact C-N 3.34Å; A276-A278 PolarHBondContact O-N 3.23Å |
| 277 | V | 45.3 | Very low | 42.8 | Very low | 143 Ų | 143 | 102.9 Ų | 102.9 | 87% | 0.867 | 68% | 0.683 | S | S | * | * | G | 310 helix | trans | -87.5 | 8.6 | -173.3 | -174.6 | 0 | 0 | 0 | 0 | 113.8 | F275 | F275-V277 PolarHBondContact O-N 3.4Š|
| 278 | A | 39.3 | Very low | 40.8 | Very low | 98 Ų | 98 | 105.3 Ų | 105.3 | 81% | 0.81 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -123 | 35.6 | -178.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | A276 | A276-A278 VanDerWaalsContact C-N 3.34Å; A276-A278 PolarHBondContact O-N 3.23Å |
| 279 | A | 28 | Very low | 39.1 | Very low | 75 Ų | 75 | 104.1 Ų | 104.1 | 62% | 0.62 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -112.5 | 121.8 | 161.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | V281 | A279-V281 PolarHBondContact O-N 3.18Å; A279-V281 VanDerWaalsContact O-N 3.12Å |
| 280 | P | 31.7 | Very low | 37.3 | Very low | 130 Ų | 130 | 104.8 Ų | 104.8 | 84% | 0.844 | 73% | 0.73 | S | S | * | * | trans | -75 | 109.5 | -176.1 | 30.5 | -30.2 | 0 | 0 | 0 | 108.7 | A282 | P280-A282 PolarHBondContact O-N 3.31Š| ||
| 281 | V | 28.7 | Very low | 35.2 | Very low | 135 Ų | 135 | 105.9 Ų | 105.9 | 82% | 0.818 | 74% | 0.74 | S | S | * | * | trans | -77.5 | 99.1 | 164.7 | -173.4 | 0 | 0 | 0 | 0 | 106.9 | A279 | A279-V281 PolarHBondContact O-N 3.18Å; A279-V281 VanDerWaalsContact O-N 3.12Å | ||
| 282 | A | 28.2 | Very low | 33.9 | Very low | 90 Ų | 90 | 106 Ų | 106 | 74% | 0.744 | 76% | 0.755 | S | S | * | * | trans | -67.9 | 135.3 | 161.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | P280 | P280-A282 PolarHBondContact O-N 3.31Š| ||
| 283 | A | 24.7 | Very low | 32.4 | Very low | 95 Ų | 95 | 105.7 Ų | 105.7 | 79% | 0.785 | 76% | 0.76 | S | S | * | * | trans | 75.2 | 104.2 | 166.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 284 | A | 24.5 | Very low | 31 | Very low | 92 Ų | 92 | 108.7 Ų | 108.7 | 76% | 0.76 | 76% | 0.763 | S | S | * | * | 178.7 | 114.5 | 93.4 | 0 | 0 | 0 | 0 | 0 | 113 | |||||
| 285 | V | 23.5 | Very low | 29.6 | Very low | 127 Ų | 127 | 112.7 Ų | 112.7 | 77% | 0.77 | 77% | 0.771 | S | S | * | * | trans | 38.6 | 118.7 | 135.3 | -146.6 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 286 | T | 23.1 | Very low | 28.5 | Very low | 131 Ų | 131 | 116.4 Ų | 116.4 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | 164.4 | 122 | 104.6 | 37 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 287 | A | 25 | Very low | 27.8 | Very low | 100 Ų | 100 | 117.2 Ų | 117.2 | 83% | 0.826 | 80% | 0.797 | S | S | * | * | trans | 25.3 | 135.4 | 140.3 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 288 | A | 24.6 | Very low | 27 | Very low | 103 Ų | 103 | 118.7 Ų | 118.7 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | 114.7 | 125 | 132.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 289 | A | 27.1 | Very low | 26.4 | Very low | 98 Ų | 98 | 121.5 Ų | 121.5 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | trans | -63.1 | 173.4 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 290 | P | 27 | Very low | 26.3 | Very low | 130 Ų | 130 | 126.4 Ų | 126.4 | 84% | 0.844 | 80% | 0.798 | S | S | * | * | trans | -124.5 | 140 | 134.8 | 33.5 | -21.9 | 0 | 0 | 0 | 112.8 | ||||
| 291 | A | 23.8 | Very low | 26.1 | Very low | 95 Ų | 95 | 126 Ų | 126 | 79% | 0.785 | 80% | 0.798 | S | S | * | * | trans | -87.6 | 143.9 | 168 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 292 | A | 25.9 | Very low | 25.9 | Very low | 103 Ų | 103 | 128.2 Ų | 128.2 | 85% | 0.851 | 80% | 0.8 | S | S | * | * | trans | 53.6 | 118.7 | 138 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 293 | A | 25.7 | Very low | 25.9 | Very low | 92 Ų | 92 | 133.2 Ų | 133.2 | 76% | 0.76 | 81% | 0.808 | S | S | * | * | trans | -164 | 108.4 | 130.5 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 294 | K | 27 | Very low | 25.9 | Very low | 178 Ų | 178 | 131.9 Ų | 131.9 | 77% | 0.774 | 80% | 0.803 | S | S | * | * | 61.8 | 136.8 | 96.9 | -90.3 | -166 | 170.9 | -119.4 | 0 | 113.3 | |||||
| 295 | E | 25.1 | Very low | 26 | Very low | 148 Ų | 148 | 133.4 Ų | 133.4 | 69% | 0.692 | 81% | 0.808 | S | S | * | * | cis | 177.4 | 129.2 | -5.1 | -146 | 169 | -163.5 | 0 | 0 | 102.6 | ||||
| 296 | E | 27.6 | Very low | 26.2 | Very low | 208 Ų | 208 | 134.6 Ų | 134.6 | 97% | 0.972 | 81% | 0.81 | S | S | * | * | trans | -156 | 128.4 | 154.4 | -118.9 | 176.2 | -156.3 | 0 | 0 | 108.9 | ||||
| 297 | A | 28.6 | Very low | 26.5 | Very low | 90 Ų | 90 | 135.7 Ų | 135.7 | 74% | 0.744 | 81% | 0.811 | S | S | * | * | trans | -115.9 | 149.2 | -164.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 298 | K | 27.3 | Very low | 26.9 | Very low | 175 Ų | 175 | 137.2 Ų | 137.2 | 76% | 0.761 | 81% | 0.805 | S | S | * | * | trans | 164.7 | 116.5 | 132.6 | -95.3 | -176.5 | 168.6 | -172.8 | 0 | 109.7 | ||||
| 299 | E | 26.9 | Very low | 27.6 | Very low | 157 Ų | 157 | 140.4 Ų | 140.4 | 73% | 0.734 | 81% | 0.805 | S | S | * | * | 66.2 | 125.1 | 101.1 | -74.8 | 173.7 | 168.5 | 0 | 0 | 110.9 | |||||
| 300 | E | 25.9 | Very low | 28 | Very low | 178 Ų | 178 | 138.8 Ų | 138.8 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | cis | -175.1 | 150.9 | 40.8 | -130.4 | 171.9 | -168.2 | 0 | 0 | 108.2 | ||||
| 301 | S | 27.2 | Very low | 28.3 | Very low | 121 Ų | 121 | 140.9 Ų | 140.9 | 85% | 0.846 | 79% | 0.794 | S | S | * | * | trans | 148.4 | 134.8 | 133.6 | 73.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 302 | E | 25.8 | Very low | 29.1 | Very low | 181 Ų | 181 | 140 Ų | 140 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | trans | -94.2 | -174.2 | -156.8 | -59.5 | 176.2 | 124.2 | 0 | 0 | 115 | ||||
| 303 | E | 26.8 | Very low | 30 | Very low | 196 Ų | 196 | 142.1 Ų | 142.1 | 92% | 0.916 | 79% | 0.791 | S | S | * | * | trans | 81.8 | 127.8 | 163.7 | -57.1 | -178.1 | 161.5 | 0 | 0 | 116.3 | ||||
| 304 | G | 24.4 | Very low | 30.7 | Very low | 67 Ų | 67 | 148 Ų | 148 | 69% | 0.691 | 80% | 0.8 | S | S | * | * | cis | 166.2 | 160 | 5.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 305 | S | 26.8 | Very low | 31.6 | Very low | 124 Ų | 124 | 150.6 Ų | 150.6 | 87% | 0.867 | 82% | 0.822 | S | S | * | * | trans | 72 | 107 | 165.9 | 69.7 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 306 | D | 27.6 | Very low | 31.9 | Very low | 152 Ų | 152 | 150.8 Ų | 150.8 | 81% | 0.813 | 83% | 0.829 | S | S | * | * | trans | -33.9 | 137.6 | 136.1 | -94.9 | -37.1 | 0 | 0 | 0 | 113.4 | ||||
| 307 | D | 30.5 | Very low | 32.1 | Very low | 154 Ų | 154 | 147.7 Ų | 147.7 | 82% | 0.824 | 82% | 0.821 | S | S | * | * | -175.9 | 117.5 | 116.3 | -95.6 | -24.1 | 0 | 0 | 0 | 111.5 | |||||
| 308 | D | 33.1 | Very low | 32.3 | Very low | 131 Ų | 131 | 150.9 Ų | 150.9 | 70% | 0.701 | 83% | 0.825 | S | S | * | * | 42 | 103.9 | 128.8 | -162.4 | 23.2 | 0 | 0 | 0 | 119.3 | |||||
| 309 | M | 38.5 | Very low | 32.6 | Very low | 170 Ų | 170 | 149.5 Ų | 149.5 | 84% | 0.837 | 83% | 0.829 | S | S | * | * | trans | -154.1 | 84.6 | 141.9 | -82.6 | -51.7 | 155.3 | 0 | 0 | 110.2 | ||||
| 310 | G | 37.2 | Very low | 33 | Very low | 65 Ų | 65 | 149.1 Ų | 149.1 | 67% | 0.67 | 84% | 0.835 | S | S | * | * | trans | -66.5 | 126.8 | 158.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 311 | F | 32.7 | Very low | 33.4 | Very low | 173 Ų | 173 | 147.1 Ų | 147.1 | 76% | 0.759 | 84% | 0.835 | S | S | * | * | trans | -138.7 | 87.4 | 163.2 | -113.7 | -89.6 | 0 | 0 | 0 | 109.7 | ||||
| 312 | G | 40.2 | Very low | 33.9 | Very low | 78 Ų | 78 | 149 Ų | 149 | 80% | 0.804 | 84% | 0.835 | S | S | * | * | trans | -81.2 | 125.1 | 152.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 313 | L | 44.4 | Very low | 34.5 | Very low | 147 Ų | 147 | 146.5 Ų | 146.5 | 77% | 0.77 | 83% | 0.834 | S | S | * | * | trans | -140 | 111.3 | 169 | -159.7 | 69.3 | 0 | 0 | 0 | 108.7 | D315 | L313-D315 PolarHBondContact O-N 3.45Š| ||
| 314 | F | 42.2 | Very low | 35.1 | Very low | 216 Ų | 216 | 142.4 Ų | 142.4 | 95% | 0.947 | 83% | 0.827 | S | S | * | * | trans | -53.1 | 116.2 | 162.3 | -98.5 | -102.8 | 0 | 0 | 0 | 109.9 | ||||
| 315 | D | 44.3 | Very low | 36.1 | Very low | 232 Ų | 232 | 149.3 Ų | 149.3 | 100% | 1.241 | 84% | 0.839 | S | S | * | * | -145.7 | 0 | 120.7 | -164.8 | 25.7 | 0 | 0 | 0 | 107.7 | L313 | L313-D315 PolarHBondContact O-N 3.45Š|
Retrieved 315 of 315 residues in 176.6 ms
(Link to these results)