| 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 | 32 | Very low | 36.8 | Very low | 247 Ų | 247 | 162.7 Ų | 162.7 | 100% | 1.217 | 86% | 0.861 | S | S | * | * | 0 | 100.4 | 0 | -87.9 | 170.1 | 180 | 0 | 0 | 107.8 | |||||
| 2 | C | 30.6 | Very low | 37.3 | Very low | 123 Ų | 123 | 158 Ų | 158 | 83% | 0.831 | 85% | 0.847 | S | S | * | * | trans | -132.7 | 112.1 | 166.4 | -82.8 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 3 | E | 36.1 | Very low | 37.9 | Very low | 197 Ų | 197 | 159.7 Ų | 159.7 | 92% | 0.921 | 84% | 0.842 | S | S | * | * | trans | -129.2 | 109.2 | 159.4 | -84.1 | -176.4 | 161.6 | 0 | 0 | 106.9 | ||||
| 4 | I | 39.4 | Very low | 38.5 | Very low | 147 Ų | 147 | 156.8 Ų | 156.8 | 75% | 0.754 | 83% | 0.834 | S | S | * | * | trans | -96.2 | 116.4 | 173.1 | -64.3 | 170.3 | 0 | 0 | 0 | 105.1 | E6 | I4-E6 HydrophobicContact CG2-CG 4.35Š| ||
| 5 | N | 36.8 | Very low | 39.2 | Very low | 166 Ų | 166 | 152.7 Ų | 152.7 | 89% | 0.888 | 81% | 0.812 | S | S | * | * | trans | -101.3 | 104.8 | 171.6 | -105.9 | -15 | 0 | 0 | 0 | 109.2 | ||||
| 6 | E | 36.7 | Very low | 40.2 | Very low | 160 Ų | 160 | 154.6 Ų | 154.6 | 75% | 0.748 | 81% | 0.805 | S | S | * | * | trans | -89.6 | 158.9 | 168.8 | -85.9 | -174.3 | 151 | 0 | 0 | 111.7 | I4 | I4-E6 HydrophobicContact CG2-CG 4.35Š| ||
| 7 | T | 36.1 | Very low | 41.3 | Very low | 124 Ų | 124 | 149.4 Ų | 149.4 | 76% | 0.761 | 79% | 0.785 | S | S | * | * | trans | 89.5 | 108.1 | 154 | 71.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 8 | R | 39.8 | Very low | 42.5 | Very low | 258 Ų | 258 | 143.4 Ų | 143.4 | 97% | 0.974 | 76% | 0.76 | S | S | * | * | trans | -155.3 | 74.4 | 131.3 | -100.7 | -178.7 | -163.6 | -174.1 | 4.6 | 109.2 | ||||
| 9 | G | 39.5 | Very low | 43.5 | Very low | 68 Ų | 68 | 139.4 Ų | 139.4 | 70% | 0.701 | 74% | 0.742 | S | S | * | * | trans | -98.7 | 107.1 | 163.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | I11 | G9-I11 PolarHBondContact O-N 3.42Š| ||
| 10 | T | 37.7 | Very low | 44.3 | Very low | 142 Ų | 142 | 138.3 Ų | 138.3 | 87% | 0.871 | 73% | 0.732 | S | S | * | * | trans | -63.5 | 111.9 | 173.6 | 36.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 11 | I | 40 | Very low | 45 | Very low | 158 Ų | 158 | 134.1 Ų | 134.1 | 81% | 0.81 | 71% | 0.714 | S | S | * | * | trans | -67.2 | 130.1 | 170.2 | -60.8 | 172.3 | 0 | 0 | 0 | 107.7 | G9 F13 | G9-I11 PolarHBondContact O-N 3.42Å; I11-F13 PolarHBondContact O-N 3.22Å | ||
| 12 | P | 43.1 | Very low | 46.8 | Very low | 106 Ų | 106 | 128.4 Ų | 128.4 | 69% | 0.688 | 68% | 0.684 | S | S | * | * | trans | -66.5 | 133.2 | -176.7 | 25.6 | -31.2 | 0 | 0 | 0 | 110.5 | V14 | P12-V14 PolarHBondContact O-N 2.89Š| ||
| 13 | F | 44.5 | Very low | 48.8 | Very low | 180 Ų | 180 | 126.2 Ų | 126.2 | 79% | 0.789 | 67% | 0.667 | S | S | * | * | trans | -60.3 | 94 | 173.6 | -156.7 | -95.6 | 0 | 0 | 0 | 108.3 | I11 D15 | I11-F13 PolarHBondContact O-N 3.22Å; F13-D15 PolarHBondContact O-N 2.8Å; F13-D15 VanDerWaalsContact O-N 3.1Å | ||
| 14 | V | 46.8 | Very low | 50.5 | Low | 119 Ų | 119 | 121.4 Ų | 121.4 | 72% | 0.721 | 65% | 0.648 | S | S | * | * | trans | -61.9 | 115.1 | 169 | 174.8 | 0 | 0 | 0 | 0 | 106.4 | P12 R16 | P12-V14 PolarHBondContact O-N 2.89Å; V14-R16 PolarHBondContact O-N 3.3Å | ||
| 15 | D | 49.2 | Very low | 52.1 | Low | 95 Ų | 95 | 120.8 Ų | 120.8 | 51% | 0.508 | 64% | 0.642 | S | S | . | * | trans | -57 | 109.1 | -172.1 | -126.3 | -39.1 | 0 | 0 | 0 | 110.7 | F13 S17 A18 T19 | F13-D15 PolarHBondContact O-N 2.8Å; F13-D15 VanDerWaalsContact O-N 3.1Å; D15-S17 PolarHBondContact O-N 3.13Å; D15-S17 PolarHBondContact OD1-OG 3.07Å; D15-A18 HydrophobicContact CB-CB 4.07Å; D15-A18 PolarHBondContact O-N 3.22Å; D15-A18 VanDerWaalsContact O-N 3.13Å; D15-T19 PolarHBondContact O-N 3.06Å; D15-T19 PolarHBondContact O-OG1 3.11Å; D15-T19 VanDerWaalsContact O-OG1 3.11Å | ||
| 16 | R | 55.6 | Low | 54.1 | Low | 184 Ų | 184 | 117.1 Ų | 117.1 | 69% | 0.694 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -55.2 | -33.6 | 172.4 | -86.8 | -174 | -172.5 | 162.5 | 2.6 | 111.5 | V14 A18 T19 E20 | V14-R16 PolarHBondContact O-N 3.3Å; R16-A18 VanDerWaalsContact C-N 3.34Å; R16-A18 PolarHBondContact O-N 3.33Å; R16-T19 WeakPolarHBondContact CA-OG1 3.35Å; R16-T19 PolarHBondContact O-N 2.9Å; R16-T19 PolarHBondContact O-OG1 2.85Å; R16-E20 WeakPolarHBondContact O-CB 3.18Å; R16-E20 WeakPolarHBondContact O-CG 3.38Å; R16-E20 PolarHBondContact O-N 3.15Å |
| 17 | S | 58.9 | Low | 56.2 | Low | 66 Ų | 66 | 113.4 Ų | 113.4 | 46% | 0.462 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -58.5 | -43.9 | 177.7 | 62.6 | 0 | 0 | 0 | 0 | 112.1 | D15 S21 | D15-S17 PolarHBondContact O-N 3.13Å; D15-S17 PolarHBondContact OD1-OG 3.07Å; S17-S21 WeakPolarHBondContact O-CB 3.38Å; S17-S21 PolarHBondContact O-N 3.1Å; S17-S21 PolarHBondContact O-OG 3.46Å |
| 18 | A | 61.8 | Low | 58.3 | Low | 41 Ų | 41 | 112.7 Ų | 112.7 | 34% | 0.339 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -71.5 | -34.1 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | D15 R16 S21 Q22 | D15-A18 HydrophobicContact CB-CB 4.07Å; D15-A18 PolarHBondContact O-N 3.22Å; D15-A18 VanDerWaalsContact O-N 3.13Å; R16-A18 VanDerWaalsContact C-N 3.34Å; R16-A18 PolarHBondContact O-N 3.33Å; A18-S21 PolarHBondContact O-OG 3.43Å; A18-S21 VanDerWaalsContact O-OG 3.07Å; A18-Q22 WeakPolarHBondContact O-CB 3.39Å; A18-Q22 WeakPolarHBondContact O-CG 3.34Å; A18-Q22 PolarHBondContact O-N 3.13Å; A18-Q22 VanDerWaalsContact O-N 3.13Å |
| 19 | T | 62.1 | Low | 60.4 | Low | 68 Ų | 68 | 103 Ų | 103 | 42% | 0.417 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -72.2 | -44 | 175.1 | 17.9 | 0 | 0 | 0 | 0 | 111.2 | D15 R16 Q22 T23 | D15-T19 PolarHBondContact O-N 3.06Å; D15-T19 PolarHBondContact O-OG1 3.11Å; D15-T19 VanDerWaalsContact O-OG1 3.11Å; R16-T19 WeakPolarHBondContact CA-OG1 3.35Å; R16-T19 PolarHBondContact O-N 2.9Å; R16-T19 PolarHBondContact O-OG1 2.85Å; T19-Q22 PolarHBondContact O-N 2.92Å; T19-T23 VanDerWaalsContact O-CG2 3.3Å; T19-T23 WeakPolarHBondContact O-CG2 3.38Å; T19-T23 PolarHBondContact O-N 3.42Å; T19-T23 PolarHBondContact O-OG1 2.77Å |
| 20 | E | 59.5 | Low | 62.7 | Low | 117 Ų | 117 | 102.1 Ų | 102.1 | 55% | 0.547 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.6 | -45.7 | 175 | -76.4 | 175.3 | -169.1 | 0 | 0 | 111.6 | R16 Q22 T23 N24 | R16-E20 WeakPolarHBondContact O-CB 3.18Å; R16-E20 WeakPolarHBondContact O-CG 3.38Å; R16-E20 PolarHBondContact O-N 3.15Å; E20-Q22 PolarHBondContact O-N 3.28Å; E20-T23 WeakPolarHBondContact CA-OG1 3.36Å; E20-T23 PolarHBondContact O-N 2.92Å; E20-T23 PolarHBondContact O-OG1 3.19Å; E20-N24 WeakPolarHBondContact O-CB 3.49Å; E20-N24 VanDerWaalsContact O-CG 3.28Å; E20-N24 PolarHBondContact O-N 3.24Å; E20-N24 PolarHBondContact O-ND2 3.05Å |
| 21 | S | 59.6 | Low | 65.1 | Low | 51 Ų | 51 | 100.8 Ų | 100.8 | 36% | 0.357 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61 | -45.6 | 177.8 | 73 | 0 | 0 | 0 | 0 | 111.8 | S17 A18 T23 N24 E25 | S17-S21 WeakPolarHBondContact O-CB 3.38Å; S17-S21 PolarHBondContact O-N 3.1Å; S17-S21 PolarHBondContact O-OG 3.46Å; A18-S21 PolarHBondContact O-OG 3.43Å; A18-S21 VanDerWaalsContact O-OG 3.07Å; S21-T23 VanDerWaalsContact C-N 3.34Å; S21-T23 PolarHBondContact O-N 3.28Å; S21-N24 PolarHBondContact O-N 3.44Å; S21-E25 WeakPolarHBondContact O-CB 3.3Å; S21-E25 WeakPolarHBondContact O-CG 3.34Å; S21-E25 PolarHBondContact O-N 3.38Å |
| 22 | Q | 69 | Low | 67.6 | Low | 127 Ų | 127 | 99.8 Ų | 99.8 | 59% | 0.593 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.8 | -40.3 | 176.4 | -76.3 | 177.2 | 4 | 0 | 0 | 112.3 | A18 T19 E20 L26 | A18-Q22 WeakPolarHBondContact O-CB 3.39Å; A18-Q22 WeakPolarHBondContact O-CG 3.34Å; A18-Q22 PolarHBondContact O-N 3.13Å; A18-Q22 VanDerWaalsContact O-N 3.13Å; T19-Q22 PolarHBondContact O-N 2.92Å; E20-Q22 PolarHBondContact O-N 3.28Å; Q22-L26 VanDerWaalsContact O-CB 3.31Å; Q22-L26 WeakPolarHBondContact O-CB 3.45Å; Q22-L26 PolarHBondContact O-N 2.86Å |
| 23 | T | 72.4 | Confident | 69.8 | Low | 77 Ų | 77 | 96.2 Ų | 96.2 | 47% | 0.472 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.2 | -37.4 | 177.4 | 56.5 | 0 | 0 | 0 | 0 | 112.7 | T19 E20 S21 T27 | T19-T23 VanDerWaalsContact O-CG2 3.3Å; T19-T23 WeakPolarHBondContact O-CG2 3.38Å; T19-T23 PolarHBondContact O-N 3.42Å; T19-T23 PolarHBondContact O-OG1 2.77Å; E20-T23 WeakPolarHBondContact CA-OG1 3.36Å; E20-T23 PolarHBondContact O-N 2.92Å; E20-T23 PolarHBondContact O-OG1 3.19Å; S21-T23 VanDerWaalsContact C-N 3.34Å; S21-T23 PolarHBondContact O-N 3.28Å; T23-T27 WeakPolarHBondContact O-CB 3.47Å; T23-T27 PolarHBondContact O-N 2.74Å; T23-T27 PolarHBondContact O-OG1 3.37Å |
| 24 | N | 72.1 | Confident | 72.1 | Confident | 95 Ų | 95 | 91.5 Ų | 91.5 | 51% | 0.508 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -68.8 | -48.2 | 177.3 | -71.8 | -21.6 | 0 | 0 | 0 | 111 | E20 S21 L26 T27 D28 | E20-N24 WeakPolarHBondContact O-CB 3.49Å; E20-N24 VanDerWaalsContact O-CG 3.28Å; E20-N24 PolarHBondContact O-N 3.24Å; E20-N24 PolarHBondContact O-ND2 3.05Å; S21-N24 PolarHBondContact O-N 3.44Å; N24-L26 VanDerWaalsContact C-N 3.32Å; N24-L26 PolarHBondContact O-N 3.06Å; N24-T27 PolarHBondContact O-N 2.97Å; N24-D28 PolarHBondContact O-N 3.36Å |
| 25 | E | 73.3 | Confident | 74.3 | Confident | 135 Ų | 135 | 89.1 Ų | 89.1 | 63% | 0.631 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -59.2 | -41.3 | 176.5 | -73.8 | 179.8 | -177.6 | 0 | 0 | 112.4 | S21 T27 S29 | S21-E25 WeakPolarHBondContact O-CB 3.3Å; S21-E25 WeakPolarHBondContact O-CG 3.34Å; S21-E25 PolarHBondContact O-N 3.38Å; E25-T27 VanDerWaalsContact C-N 3.34Å; E25-S29 WeakPolarHBondContact O-CB 3.31Å; E25-S29 PolarHBondContact O-N 2.98Å; E25-S29 PolarHBondContact O-OG 2.88Å |
| 26 | L | 79.2 | Confident | 76.5 | Confident | 88 Ų | 88 | 88.4 Ų | 88.4 | 46% | 0.461 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -65 | -39.7 | 175.1 | -177.4 | 63.3 | 0 | 0 | 0 | 111.5 | Q22 N24 S29 L30 T293 | Q22-L26 VanDerWaalsContact O-CB 3.31Å; Q22-L26 WeakPolarHBondContact O-CB 3.45Å; Q22-L26 PolarHBondContact O-N 2.86Å; N24-L26 VanDerWaalsContact C-N 3.32Å; N24-L26 PolarHBondContact O-N 3.06Å; L26-S29 WeakPolarHBondContact CA-OG 3.37Å; L26-S29 PolarHBondContact O-OG 2.87Å; L26-L30 HydrophobicContact CD1-CD1 3.75Å; L26-L30 HydrophobicContact CG-CD1 4.3Å; L26-L30 WeakPolarHBondContact O-CB 3.43Å; L26-L30 VanDerWaalsContact O-CD1 3.28Å; L26-L30 WeakPolarHBondContact O-CD1 3.48Å; L26-L30 PolarHBondContact O-N 3.02Å; L26-L30 VanDerWaalsContact O-N 3.09Å; L26-T293 HydrophobicContact CD1-CG2 4.4Å |
| 27 | T | 80.7 | Confident | 78.4 | Confident | 82 Ų | 82 | 80.1 Ų | 80.1 | 50% | 0.503 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -67.8 | -43.7 | 179.3 | -59.6 | 0 | 0 | 0 | 0 | 111.5 | T23 N24 E25 L30 H31 | T23-T27 WeakPolarHBondContact O-CB 3.47Å; T23-T27 PolarHBondContact O-N 2.74Å; T23-T27 PolarHBondContact O-OG1 3.37Å; N24-T27 PolarHBondContact O-N 2.97Å; E25-T27 VanDerWaalsContact C-N 3.34Å; T27-L30 PolarHBondContact O-N 3.01Å; T27-H31 WeakPolarHBondContact O-CB 3.28Å; T27-H31 PolarHBondContact O-N 3.19Å |
| 28 | D | 80.7 | Confident | 80.1 | Confident | 110 Ų | 110 | 77.4 Ų | 77.4 | 59% | 0.588 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -66.4 | -44.3 | 179.3 | -74.7 | -18.1 | 0 | 0 | 0 | 111.8 | N24 L30 H31 F32 | N24-D28 PolarHBondContact O-N 3.36Å; D28-L30 PolarHBondContact O-N 2.88Å; D28-H31 PolarHBondContact O-N 2.9Å; D28-F32 WeakPolarHBondContact O-CB 3.4Å; D28-F32 PolarHBondContact O-N 2.96Å |
| 29 | S | 83.8 | Confident | 81.8 | Confident | 55 Ų | 55 | 79 Ų | 79 | 39% | 0.385 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -62 | -42.1 | 175.4 | 58.2 | 0 | 0 | 0 | 0 | 111.9 | E25 L26 H31 F32 V33 | E25-S29 WeakPolarHBondContact O-CB 3.31Å; E25-S29 PolarHBondContact O-N 2.98Å; E25-S29 PolarHBondContact O-OG 2.88Å; L26-S29 WeakPolarHBondContact CA-OG 3.37Å; L26-S29 PolarHBondContact O-OG 2.87Å; S29-H31 VanDerWaalsContact C-N 3.35Å; S29-H31 PolarHBondContact O-N 3.19Å; S29-F32 PolarHBondContact O-N 3.49Å; S29-V33 VanDerWaalsContact O-CG2 3.28Å; S29-V33 WeakPolarHBondContact O-CG2 3.32Å; S29-V33 PolarHBondContact O-N 3.09Å |
| 30 | L | 86.3 | Confident | 83.5 | Confident | 49 Ų | 49 | 78.5 Ų | 78.5 | 26% | 0.257 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -63.6 | -39.6 | 173.7 | -98.8 | 65.5 | 0 | 0 | 0 | 112.2 | L26 T27 D28 R34 T293 | L26-L30 HydrophobicContact CD1-CD1 3.75Å; L26-L30 HydrophobicContact CG-CD1 4.3Å; L26-L30 WeakPolarHBondContact O-CB 3.43Å; L26-L30 VanDerWaalsContact O-CD1 3.28Å; L26-L30 WeakPolarHBondContact O-CD1 3.48Å; L26-L30 PolarHBondContact O-N 3.02Å; L26-L30 VanDerWaalsContact O-N 3.09Å; T27-L30 PolarHBondContact O-N 3.01Å; D28-L30 PolarHBondContact O-N 2.88Å; L30-R34 VanDerWaalsContact O-CG 3.24Å; L30-R34 WeakPolarHBondContact O-CG 3.45Å; L30-R34 PolarHBondContact O-N 3.35Å; L30-T293 HydrophobicContact CD1-CG2 3.72Å |
| 31 | H | 89.1 | Confident | 85.3 | Confident | 113 Ų | 113 | 73.1 Ų | 73.1 | 52% | 0.523 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -64.3 | -48 | 176.8 | -177.5 | -91.6 | 0 | 0 | 0 | 111.3 | T27 D28 S29 V33 R34 V35 | T27-H31 WeakPolarHBondContact O-CB 3.28Å; T27-H31 PolarHBondContact O-N 3.19Å; D28-H31 PolarHBondContact O-N 2.9Å; S29-H31 VanDerWaalsContact C-N 3.35Å; S29-H31 PolarHBondContact O-N 3.19Å; H31-V33 PolarHBondContact O-N 2.94Å; H31-R34 WeakPolarHBondContact O-CB 3.41Å; H31-R34 PolarHBondContact O-N 2.99Å; H31-R34 VanDerWaalsContact O-N 3.16Å; H31-V35 WeakPolarHBondContact O-CG2 3.45Å; H31-V35 PolarHBondContact O-N 2.91Å |
| 32 | F | 91.1 | Very high | 87.1 | Confident | 137 Ų | 137 | 72.9 Ų | 72.9 | 60% | 0.601 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -55.9 | -48.6 | 175.6 | 175.4 | -98.8 | 0 | 0 | 0 | 111.8 | D28 S29 R34 V35 L36 | D28-F32 WeakPolarHBondContact O-CB 3.4Å; D28-F32 PolarHBondContact O-N 2.96Å; S29-F32 PolarHBondContact O-N 3.49Å; F32-R34 VanDerWaalsContact C-N 3.31Å; F32-R34 PolarHBondContact O-N 2.85Å; F32-V35 PolarHBondContact O-N 3.46Å; F32-L36 HydrophobicContact CE1-CD2 4.18Å; F32-L36 WeakPolarHBondContact O-CB 3.28Å; F32-L36 PolarHBondContact O-N 3.4Å |
| 33 | V | 91.2 | Very high | 88.5 | Confident | 32 Ų | 32 | 71.2 Ų | 71.2 | 19% | 0.194 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -59.6 | -41.8 | 178 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | S29 H31 L36 L37 I297 | S29-V33 VanDerWaalsContact O-CG2 3.28Å; S29-V33 WeakPolarHBondContact O-CG2 3.32Å; S29-V33 PolarHBondContact O-N 3.09Å; H31-V33 PolarHBondContact O-N 2.94Å; V33-L36 PolarHBondContact O-N 3.03Å; V33-L37 HydrophobicContact CG1-CD1 3.95Å; V33-L37 HydrophobicContact CG1-CG 4.31Å; V33-L37 WeakPolarHBondContact O-CG 3.33Å; V33-L37 PolarHBondContact O-N 3.2Å; V33-I297 HydrophobicContact CG1-CG1 4.24Å; V33-I297 HydrophobicContact CG1-CG2 4.11Å; V33-I297 HydrophobicContact CG2-CD1 4.26Å |
| 34 | R | 91.4 | Very high | 89.7 | Confident | 81 Ų | 81 | 68 Ų | 68 | 31% | 0.306 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.3 | -46.5 | 177.4 | -73.1 | 169.2 | -174 | 156.2 | 2.9 | 112.3 | L30 H31 F32 L36 L37 A38 R96 | L30-R34 VanDerWaalsContact O-CG 3.24Å; L30-R34 WeakPolarHBondContact O-CG 3.45Å; L30-R34 PolarHBondContact O-N 3.35Å; H31-R34 WeakPolarHBondContact O-CB 3.41Å; H31-R34 PolarHBondContact O-N 2.99Å; H31-R34 VanDerWaalsContact O-N 3.16Å; F32-R34 VanDerWaalsContact C-N 3.31Å; F32-R34 PolarHBondContact O-N 2.85Å; R34-L36 VanDerWaalsContact C-N 3.34Å; R34-L37 PolarHBondContact O-N 3.19Å; R34-A38 WeakPolarHBondContact O-CB 3.38Å; R34-A38 PolarHBondContact O-N 3.15Å; R34-R96 VanDerWaalsContact NH1-CD 3.26Å |
| 35 | V | 93.9 | Very high | 90.8 | Very high | 68 Ų | 68 | 66 Ų | 66 | 41% | 0.412 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 177.9 | 174.8 | 0 | 0 | 0 | 0 | 110.3 | H31 F32 L37 A38 V39 | H31-V35 WeakPolarHBondContact O-CG2 3.45Å; H31-V35 PolarHBondContact O-N 2.91Å; F32-V35 PolarHBondContact O-N 3.46Å; V35-L37 PolarHBondContact O-N 3.41Å; V35-A38 WeakPolarHBondContact O-CB 3.46Å; V35-A38 PolarHBondContact O-N 3.22Å; V35-V39 HydrophobicContact CG1-CG2 4.49Å; V35-V39 WeakPolarHBondContact O-CG2 3.48Å; V35-V39 PolarHBondContact O-N 3.16Å |
| 36 | L | 95.1 | Very high | 91.9 | Very high | 81 Ų | 81 | 62.5 Ų | 62.5 | 42% | 0.424 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -59.3 | -47.2 | 176.7 | 179.2 | 61.8 | 0 | 0 | 0 | 112 | F32 V33 R34 A38 V39 I40 | F32-L36 HydrophobicContact CE1-CD2 4.18Å; F32-L36 WeakPolarHBondContact O-CB 3.28Å; F32-L36 PolarHBondContact O-N 3.4Å; V33-L36 PolarHBondContact O-N 3.03Å; R34-L36 VanDerWaalsContact C-N 3.34Å; L36-A38 VanDerWaalsContact C-N 3.33Å; L36-A38 PolarHBondContact O-N 2.85Å; L36-V39 PolarHBondContact O-N 3.17Å; L36-I40 HydrophobicContact CD1-CD1 4.3Å; L36-I40 HydrophobicContact CG-CD1 4.09Å; L36-I40 WeakPolarHBondContact O-CG1 3.49Å; L36-I40 PolarHBondContact O-N 3.04Å |
| 37 | L | 94.4 | Very high | 92.6 | Very high | 10 Ų | 10 | 62 Ų | 62 | 5% | 0.052 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -60.9 | -42.3 | 176.6 | -67.1 | 170.2 | 0 | 0 | 0 | 111.4 | V33 R34 V35 V39 I40 Y41 N300 V301 I304 | V33-L37 HydrophobicContact CG1-CD1 3.95Å; V33-L37 HydrophobicContact CG1-CG 4.31Å; V33-L37 WeakPolarHBondContact O-CG 3.33Å; V33-L37 PolarHBondContact O-N 3.2Å; R34-L37 PolarHBondContact O-N 3.19Å; V35-L37 PolarHBondContact O-N 3.41Å; L37-V39 PolarHBondContact O-N 2.8Å; L37-I40 PolarHBondContact O-N 3.48Å; L37-Y41 HydrophobicContact CB-CE2 4.38Å; L37-Y41 WeakPolarHBondContact O-CD2 3.24Å; L37-Y41 PolarHBondContact O-N 2.88Å; L37-N300 HydrophobicContact CD1-CB 3.97Å; L37-V301 HydrophobicContact CD2-CG2 4.16Å; L37-I304 HydrophobicContact CD2-CD1 3.39Å |
| 38 | A | 96.2 | Very high | 93.2 | Very high | 8 Ų | 8 | 58 Ų | 58 | 7% | 0.066 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | R34 V35 L36 Y41 A42 I90 I94 | R34-A38 WeakPolarHBondContact O-CB 3.38Å; R34-A38 PolarHBondContact O-N 3.15Å; V35-A38 WeakPolarHBondContact O-CB 3.46Å; V35-A38 PolarHBondContact O-N 3.22Å; L36-A38 VanDerWaalsContact C-N 3.33Å; L36-A38 PolarHBondContact O-N 2.85Å; A38-Y41 PolarHBondContact O-N 3.1Å; A38-A42 PolarHBondContact O-N 2.74Å; A38-I90 HydrophobicContact CB-CG2 4.31Å; A38-I94 HydrophobicContact CB-CD1 4.34Å; A38-I94 HydrophobicContact CB-CG1 4.08Å |
| 39 | V | 97.3 | Very high | 93.8 | Very high | 75 Ų | 75 | 56.1 Ų | 56.1 | 46% | 0.455 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63.2 | -43 | 174.8 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | V35 L36 L37 Y41 A42 I43 | V35-V39 HydrophobicContact CG1-CG2 4.49Å; V35-V39 WeakPolarHBondContact O-CG2 3.48Å; V35-V39 PolarHBondContact O-N 3.16Å; L36-V39 PolarHBondContact O-N 3.17Å; L37-V39 PolarHBondContact O-N 2.8Å; V39-Y41 PolarHBondContact O-N 3.25Å; V39-A42 WeakPolarHBondContact O-CB 3.43Å; V39-A42 PolarHBondContact O-N 2.75Å; V39-A42 VanDerWaalsContact O-N 3.16Å; V39-I43 HydrophobicContact CG1-CD1 4.03Å; V39-I43 WeakPolarHBondContact O-CG1 3.46Å; V39-I43 PolarHBondContact O-N 2.86Å |
| 40 | I | 97.4 | Very high | 94.1 | Very high | 57 Ų | 57 | 55.2 Ų | 55.2 | 29% | 0.292 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.9 | -46 | 176.7 | -67.5 | 165 | 0 | 0 | 0 | 110.7 | L36 L37 A42 I43 L44 I304 | L36-I40 HydrophobicContact CD1-CD1 4.3Å; L36-I40 HydrophobicContact CG-CD1 4.09Å; L36-I40 WeakPolarHBondContact O-CG1 3.49Å; L36-I40 PolarHBondContact O-N 3.04Å; L37-I40 PolarHBondContact O-N 3.48Å; I40-A42 VanDerWaalsContact C-N 3.3Å; I40-A42 PolarHBondContact O-N 3.16Å; I40-I43 PolarHBondContact O-N 2.99Å; I40-L44 HydrophobicContact CG2-CD1 3.9Å; I40-L44 HydrophobicContact CG2-CG 4.43Å; I40-L44 VanDerWaalsContact O-CG 3.29Å; I40-L44 WeakPolarHBondContact O-CG 3.36Å; I40-L44 PolarHBondContact O-N 3.05Å; I40-I304 HydrophobicContact CG2-CD1 4.05Å; I40-I304 HydrophobicContact CG2-CG2 3.87Å |
| 41 | Y | 97.5 | Very high | 94.3 | Very high | 5 Ų | 5 | 53 Ų | 53 | 2% | 0.02 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -61.1 | -37.7 | 175.1 | -71.9 | -56.9 | 0 | 0 | 0 | 112.4 | L37 A38 V39 L44 F45 L86 V89 I90 R93 I304 Y307 | L37-Y41 HydrophobicContact CB-CE2 4.38Å; L37-Y41 WeakPolarHBondContact O-CD2 3.24Å; L37-Y41 PolarHBondContact O-N 2.88Å; A38-Y41 PolarHBondContact O-N 3.1Å; V39-Y41 PolarHBondContact O-N 3.25Å; Y41-L44 PolarHBondContact O-N 3.27Å; Y41-F45 WeakPolarHBondContact O-CB 3.48Å; Y41-F45 PolarHBondContact O-N 3.37Å; Y41-L86 HydrophobicContact CD1-CD2 3.5Å; Y41-L86 HydrophobicContact CE1-CD2 4.09Å; Y41-L86 HydrophobicContact CG-CD2 4.25Å; Y41-V89 HydrophobicContact CD2-CG1 4.03Å; Y41-V89 HydrophobicContact CE1-CG1 4.29Å; Y41-V89 HydrophobicContact CE2-CG1 3.77Å; Y41-V89 HydrophobicContact CG-CG1 4.43Å; Y41-I90 HydrophobicContact CG-CG1 4.49Å; Y41-R93 HydrophobicContact CE2-CG 4.25Å; Y41-I304 HydrophobicContact CD1-CG1 4.47Å; Y41-I304 HydrophobicContact CE1-CD1 4.41Å; Y41-I304 HydrophobicContact CE1-CG1 3.67Å; Y41-I304 HydrophobicContact CE2-CD1 4.48Å; Y41-I304 HydrophobicContact CE2-CG1 4.44Å; Y41-Y307 HydrophobicContact CE1-CD2 4.23Å; Y41-Y307 HydrophobicContact CE1-CE2 4.22Å |
| 42 | A | 98 | Very high | 94.4 | Very high | 45 Ų | 45 | 49.4 Ų | 49.4 | 37% | 0.372 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -65.1 | -41.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A38 V39 I40 F45 A46 I90 | A38-A42 PolarHBondContact O-N 2.74Å; V39-A42 WeakPolarHBondContact O-CB 3.43Å; V39-A42 PolarHBondContact O-N 2.75Å; V39-A42 VanDerWaalsContact O-N 3.16Å; I40-A42 VanDerWaalsContact C-N 3.3Å; I40-A42 PolarHBondContact O-N 3.16Å; A42-F45 PolarHBondContact O-N 3.07Å; A42-A46 PolarHBondContact O-N 3.42Å; A42-I90 HydrophobicContact CB-CD1 4.04Å |
| 43 | I | 97.5 | Very high | 94.4 | Very high | 93 Ų | 93 | 48.5 Ų | 48.5 | 48% | 0.477 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62.2 | -45.4 | 174.1 | -67.4 | 166.4 | 0 | 0 | 0 | 110.4 | V39 I40 F45 A46 L47 | V39-I43 HydrophobicContact CG1-CD1 4.03Å; V39-I43 WeakPolarHBondContact O-CG1 3.46Å; V39-I43 PolarHBondContact O-N 2.86Å; I40-I43 PolarHBondContact O-N 2.99Å; I43-F45 VanDerWaalsContact C-N 3.34Å; I43-F45 PolarHBondContact O-N 3.44Å; I43-A46 PolarHBondContact O-N 3.01Å; I43-L47 HydrophobicContact CG2-CD1 3.96Å; I43-L47 HydrophobicContact CG2-CG 4.31Å; I43-L47 WeakPolarHBondContact O-CG 3.32Å; I43-L47 PolarHBondContact O-N 2.89Å |
| 44 | L | 96.8 | Very high | 94.2 | Very high | 10 Ų | 10 | 47.5 Ų | 47.5 | 5% | 0.052 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63 | -40.9 | 178.2 | -69.8 | 168.7 | 0 | 0 | 0 | 111.9 | I40 Y41 L47 G48 L86 I304 V308 V311 | I40-L44 HydrophobicContact CG2-CD1 3.9Å; I40-L44 HydrophobicContact CG2-CG 4.43Å; I40-L44 VanDerWaalsContact O-CG 3.29Å; I40-L44 WeakPolarHBondContact O-CG 3.36Å; I40-L44 PolarHBondContact O-N 3.05Å; Y41-L44 PolarHBondContact O-N 3.27Å; L44-L47 PolarHBondContact O-N 2.86Å; L44-G48 WeakPolarHBondContact O-CA 3.39Å; L44-G48 PolarHBondContact O-N 3.09Å; L44-L86 HydrophobicContact CB-CD1 4.03Å; L44-I304 HydrophobicContact CD1-CG2 3.48Å; L44-I304 VanDerWaalsContact CD1-CG2 3.48Å; L44-V308 HydrophobicContact CD1-CG2 4.5Å; L44-V308 HydrophobicContact CD2-CG2 4.05Å; L44-V311 HydrophobicContact CD2-CG1 4.4Å; L44-V311 HydrophobicContact CD2-CG2 3.71Å; L44-V311 WeakPolarHBondContact O-CG1 3.43Å |
| 45 | F | 97.1 | Very high | 94.1 | Very high | 53 Ų | 53 | 44.1 Ų | 44.1 | 23% | 0.232 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -58.2 | -50.1 | 173.2 | 179.6 | -104.5 | 0 | 0 | 0 | 111.1 | Y41 A42 I43 L47 G48 L49 I83 M84 L86 P87 | Y41-F45 WeakPolarHBondContact O-CB 3.48Å; Y41-F45 PolarHBondContact O-N 3.37Å; A42-F45 PolarHBondContact O-N 3.07Å; I43-F45 VanDerWaalsContact C-N 3.34Å; I43-F45 PolarHBondContact O-N 3.44Å; F45-L47 PolarHBondContact O-N 2.97Å; F45-G48 PolarHBondContact O-N 3.12Å; F45-L49 HydrophobicContact CE1-CD1 4.5Å; F45-L49 HydrophobicContact CE1-CD2 4.3Å; F45-L49 HydrophobicContact CZ-CD2 4.08Å; F45-L49 WeakPolarHBondContact O-CG 3.05Å; F45-L49 PolarHBondContact O-N 2.88Å; F45-I83 WeakPolarHBondContact CD2-O 3.27Å; F45-M84 HydrophobicContact CE2-SD 4.26Å; F45-L86 HydrophobicContact CB-CB 4.21Å; F45-L86 HydrophobicContact CB-CD1 4.04Å; F45-L86 HydrophobicContact CD2-CB 4.26Å; F45-P87 HydrophobicContact CD2-CG 4.13Å; F45-P87 HydrophobicContact CE2-CG 3.86Å; F45-P87 HydrophobicContact CZ-CG 4.1Å |
| 46 | A | 95.7 | Very high | 93.9 | Very high | 60 Ų | 60 | 45.2 Ų | 45.2 | 50% | 0.496 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.9 | -44.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113 | A42 I43 G48 L49 | A42-A46 PolarHBondContact O-N 3.42Å; I43-A46 PolarHBondContact O-N 3.01Å; A46-G48 VanDerWaalsContact C-N 3.31Å; A46-G48 PolarHBondContact O-N 2.89Å; A46-L49 WeakPolarHBondContact O-CB 3.4Å; A46-L49 PolarHBondContact O-N 3.3Å |
| 47 | L | 93.9 | Very high | 93.5 | Very high | 77 Ų | 77 | 44.3 Ų | 44.3 | 40% | 0.403 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -63.7 | -40.4 | 175.1 | -69.1 | 175.8 | 0 | 0 | 0 | 111.4 | I43 L44 F45 L49 S50 V311 | I43-L47 HydrophobicContact CG2-CD1 3.96Å; I43-L47 HydrophobicContact CG2-CG 4.31Å; I43-L47 WeakPolarHBondContact O-CG 3.32Å; I43-L47 PolarHBondContact O-N 2.89Å; L44-L47 PolarHBondContact O-N 2.86Å; F45-L47 PolarHBondContact O-N 2.97Å; L47-L49 VanDerWaalsContact C-N 3.26Å; L47-L49 PolarHBondContact O-N 3.18Å; L47-S50 WeakPolarHBondContact O-CB 3.43Å; L47-S50 PolarHBondContact O-N 3.4Å; L47-S50 PolarHBondContact O-OG 3.32Å; L47-V311 HydrophobicContact CB-CB 4.08Å; L47-V311 HydrophobicContact CB-CG1 4.47Å; L47-V311 HydrophobicContact CB-CG2 4.35Å; L47-V311 HydrophobicContact CD1-CG2 4.45Å |
| 48 | G | 93.2 | Very high | 92.9 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -64.8 | -25.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | L44 F45 A46 S50 N51 I83 | L44-G48 WeakPolarHBondContact O-CA 3.39Å; L44-G48 PolarHBondContact O-N 3.09Å; F45-G48 PolarHBondContact O-N 3.12Å; A46-G48 VanDerWaalsContact C-N 3.31Å; A46-G48 PolarHBondContact O-N 2.89Å; G48-S50 PolarHBondContact O-N 3.35Å; G48-N51 VanDerWaalsContact O-CB 3.27Å; G48-N51 WeakPolarHBondContact O-CB 3.39Å; G48-N51 PolarHBondContact O-N 3.07Å; G48-I83 WeakPolarHBondContact O-CD1 3.5Å |
| 49 | L | 93 | Very high | 92.4 | Very high | 70 Ų | 70 | 47.7 Ų | 47.7 | 37% | 0.366 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -54.8 | -25.6 | 173.9 | -67 | 176.7 | 0 | 0 | 0 | 112.1 | F45 A46 L47 N51 V52 L53 | F45-L49 HydrophobicContact CE1-CD1 4.5Å; F45-L49 HydrophobicContact CE1-CD2 4.3Å; F45-L49 HydrophobicContact CZ-CD2 4.08Å; F45-L49 WeakPolarHBondContact O-CG 3.05Å; F45-L49 PolarHBondContact O-N 2.88Å; A46-L49 WeakPolarHBondContact O-CB 3.4Å; A46-L49 PolarHBondContact O-N 3.3Å; L47-L49 VanDerWaalsContact C-N 3.26Å; L47-L49 PolarHBondContact O-N 3.18Å; L49-N51 PolarHBondContact O-N 3.46Å; L49-V52 HydrophobicContact CD2-CG2 4.29Å; L49-V52 VanDerWaalsContact O-CB 3.27Å; L49-V52 WeakPolarHBondContact O-CB 3.39Å; L49-V52 PolarHBondContact O-N 2.79Å; L49-L53 WeakPolarHBondContact O-CD1 3.19Å; L49-L53 PolarHBondContact O-N 2.85Å |
| 50 | S | 90 | Very high | 91.9 | Very high | 36 Ų | 36 | 50.4 Ų | 50.4 | 25% | 0.252 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -57 | -31.1 | 171.6 | 67 | 0 | 0 | 0 | 0 | 113.9 | L47 G48 L53 I54 P314 | L47-S50 WeakPolarHBondContact O-CB 3.43Å; L47-S50 PolarHBondContact O-N 3.4Å; L47-S50 PolarHBondContact O-OG 3.32Å; G48-S50 PolarHBondContact O-N 3.35Å; S50-L53 PolarHBondContact O-N 2.92Å; S50-I54 WeakPolarHBondContact O-CG1 3.32Å; S50-I54 PolarHBondContact O-N 2.96Å; S50-I54 VanDerWaalsContact O-N 3.14Å; S50-P314 WeakPolarHBondContact OG-CB 3.36Å; S50-P314 WeakPolarHBondContact OG-CG 3.39Å |
| 51 | N | 91.5 | Very high | 91.3 | Very high | 3 Ų | 3 | 53.3 Ų | 53.3 | 2% | 0.016 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -64.6 | -41.5 | 172.2 | -76.4 | -53.3 | 0 | 0 | 0 | 111.5 | G48 L49 L53 I54 T55 D79 T80 C310 P314 | G48-N51 VanDerWaalsContact O-CB 3.27Å; G48-N51 WeakPolarHBondContact O-CB 3.39Å; G48-N51 PolarHBondContact O-N 3.07Å; L49-N51 PolarHBondContact O-N 3.46Å; N51-L53 VanDerWaalsContact C-N 3.32Å; N51-L53 PolarHBondContact O-N 2.86Å; N51-I54 WeakPolarHBondContact O-CB 3.33Å; N51-I54 PolarHBondContact O-N 3.26Å; N51-I54 VanDerWaalsContact O-N 3.12Å; N51-T55 PolarHBondContact O-N 3.39Å; N51-T55 PolarHBondContact O-OG1 3.22Å; N51-D79 HydrophobicContact CB-CB 4.32Å; N51-D79 WeakPolarHBondContact ND2-CB 3.39Å; N51-T80 WeakPolarHBondContact CB-OG1 3.4Å; N51-C310 PolarHBondContact ND2-O 3.44Å; N51-P314 HydrophobicContact CB-CG 4.44Å; N51-P314 VanDerWaalsContact CG-CG 3.46Å; N51-P314 WeakPolarHBondContact OD1-CD 3.24Å; N51-P314 WeakPolarHBondContact OD1-CG 3.48Å |
| 52 | V | 91.3 | Very high | 90.6 | Very high | 37 Ų | 37 | 60.9 Ų | 60.9 | 22% | 0.224 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -57.9 | -47 | 175.9 | -177.7 | 0 | 0 | 0 | 0 | 110.2 | L49 I54 T55 L56 T80 | L49-V52 HydrophobicContact CD2-CG2 4.29Å; L49-V52 VanDerWaalsContact O-CB 3.27Å; L49-V52 WeakPolarHBondContact O-CB 3.39Å; L49-V52 PolarHBondContact O-N 2.79Å; V52-I54 VanDerWaalsContact C-N 3.29Å; V52-I54 PolarHBondContact O-N 3.44Å; V52-T55 PolarHBondContact O-N 2.94Å; V52-L56 HydrophobicContact CG1-CD1 3.9Å; V52-L56 HydrophobicContact CG1-CG 4.24Å; V52-L56 WeakPolarHBondContact O-CB 3.25Å; V52-L56 WeakPolarHBondContact O-CG 3.34Å; V52-L56 PolarHBondContact O-N 2.77Å; V52-T80 HydrophobicContact CG2-CG2 3.6Å; V52-T80 PolarHBondContact N-OG1 3.49Å |
| 53 | L | 89.7 | Confident | 89.7 | Confident | 117 Ų | 117 | 60.7 Ų | 60.7 | 61% | 0.613 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -59.8 | -40.9 | 178.2 | -78.9 | 80.3 | 0 | 0 | 0 | 111.5 | L49 S50 N51 F57 | L49-L53 WeakPolarHBondContact O-CD1 3.19Å; L49-L53 PolarHBondContact O-N 2.85Å; S50-L53 PolarHBondContact O-N 2.92Å; N51-L53 VanDerWaalsContact C-N 3.32Å; N51-L53 PolarHBondContact O-N 2.86Å; L53-F57 WeakPolarHBondContact O-CB 3.35Å; L53-F57 PolarHBondContact O-N 3.03Å |
| 54 | I | 87.9 | Confident | 88.8 | Confident | 12 Ų | 12 | 60.2 Ų | 60.2 | 6% | 0.062 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -66.3 | -47.8 | 177.3 | -71.5 | 165.5 | 0 | 0 | 0 | 111.2 | S50 N51 V52 F57 I58 I72 P314 F324 | S50-I54 WeakPolarHBondContact O-CG1 3.32Å; S50-I54 PolarHBondContact O-N 2.96Å; S50-I54 VanDerWaalsContact O-N 3.14Å; N51-I54 WeakPolarHBondContact O-CB 3.33Å; N51-I54 PolarHBondContact O-N 3.26Å; N51-I54 VanDerWaalsContact O-N 3.12Å; V52-I54 VanDerWaalsContact C-N 3.29Å; V52-I54 PolarHBondContact O-N 3.44Å; I54-F57 PolarHBondContact O-N 3.12Å; I54-I58 HydrophobicContact CG2-CD1 3.87Å; I54-I58 WeakPolarHBondContact O-CG1 3.37Å; I54-I58 PolarHBondContact O-N 3.43Å; I54-I72 HydrophobicContact CG2-CG2 4.08Å; I54-P314 HydrophobicContact CD1-CB 3.5Å; I54-P314 HydrophobicContact CD1-CG 3.67Å; I54-F324 HydrophobicContact CD1-CE2 4.31Å; I54-F324 HydrophobicContact CD1-CZ 3.87Å; I54-F324 HydrophobicContact CG1-CE2 3.94Å; I54-F324 HydrophobicContact CG1-CZ 3.68Å |
| 55 | T | 88.5 | Confident | 87.9 | Confident | 10 Ų | 10 | 63.5 Ų | 63.5 | 6% | 0.061 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -57.4 | -51.9 | 178.1 | -57.7 | 0 | 0 | 0 | 0 | 110.5 | N51 V52 F57 I58 I59 L73 S76 L77 | N51-T55 PolarHBondContact O-N 3.39Å; N51-T55 PolarHBondContact O-OG1 3.22Å; V52-T55 PolarHBondContact O-N 2.94Å; T55-F57 PolarHBondContact O-N 2.9Å; T55-I58 PolarHBondContact O-N 2.97Å; T55-I59 HydrophobicContact CG2-CD1 3.8Å; T55-I59 VanDerWaalsContact O-CG1 3.29Å; T55-I59 WeakPolarHBondContact O-CG1 3.47Å; T55-I59 PolarHBondContact O-N 3.47Å; T55-I59 VanDerWaalsContact O-N 3.08Å; T55-L73 HydrophobicContact CG2-CD1 3.86Å; T55-S76 VanDerWaalsContact OG1-C 3.31Å; T55-S76 VanDerWaalsContact OG1-CB 3.26Å; T55-S76 WeakPolarHBondContact OG1-CB 3.5Å; T55-S76 PolarHBondContact OG1-O 3Å; T55-S76 PolarHBondContact OG1-OG 3.39Å; T55-L77 HydrophobicContact CG2-CB 4.49Å; T55-L77 HydrophobicContact CG2-CD1 4.35Å |
| 56 | L | 89.4 | Confident | 87.3 | Confident | 90 Ų | 90 | 63.1 Ų | 63.1 | 47% | 0.471 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 177.9 | -70 | 178.8 | 0 | 0 | 0 | 111.9 | V52 I58 I59 L60 | V52-L56 HydrophobicContact CG1-CD1 3.9Å; V52-L56 HydrophobicContact CG1-CG 4.24Å; V52-L56 WeakPolarHBondContact O-CB 3.25Å; V52-L56 WeakPolarHBondContact O-CG 3.34Å; V52-L56 PolarHBondContact O-N 2.77Å; L56-I58 PolarHBondContact O-N 2.93Å; L56-I59 PolarHBondContact O-N 2.84Å; L56-L60 HydrophobicContact CB-CD1 4.38Å; L56-L60 VanDerWaalsContact O-CB 3.26Å; L56-L60 WeakPolarHBondContact O-CB 3.4Å; L56-L60 VanDerWaalsContact O-CG 3.22Å; L56-L60 WeakPolarHBondContact O-CG 3.3Å; L56-L60 PolarHBondContact O-N 3.28Å |
| 57 | F | 86.4 | Confident | 86.9 | Confident | 63 Ų | 63 | 60.8 Ų | 60.8 | 28% | 0.276 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -57.6 | -47.8 | 178.2 | 175.5 | -91.9 | 0 | 0 | 0 | 111.7 | L53 I54 T55 R61 V63 V327 | L53-F57 WeakPolarHBondContact O-CB 3.35Å; L53-F57 PolarHBondContact O-N 3.03Å; I54-F57 PolarHBondContact O-N 3.12Å; T55-F57 PolarHBondContact O-N 2.9Å; F57-R61 HydrophobicContact CD2-CG 3.99Å; F57-R61 HydrophobicContact CE2-CG 3.82Å; F57-R61 HydrophobicContact CG-CG 4.47Å; F57-R61 HydrophobicContact CZ-CG 4.15Å; F57-R61 WeakPolarHBondContact O-CB 3.42Å; F57-R61 VanDerWaalsContact O-CG 3.24Å; F57-R61 WeakPolarHBondContact O-CG 3.25Å; F57-R61 PolarHBondContact O-N 3.42Å; F57-V63 HydrophobicContact CE1-CG2 4.47Å; F57-V327 HydrophobicContact CD2-CG1 4.49Å; F57-V327 HydrophobicContact CE1-CG1 4.01Å; F57-V327 HydrophobicContact CE2-CG1 3.57Å; F57-V327 HydrophobicContact CZ-CG1 3.3Å |
| 58 | I | 81.9 | Confident | 86.7 | Confident | 10 Ų | 10 | 58 Ų | 58 | 5% | 0.051 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.4 | -43.3 | -178.4 | -65 | 168.8 | 0 | 0 | 0 | 110.9 | I54 T55 L56 K62 V63 F64 I72 L73 | I54-I58 HydrophobicContact CG2-CD1 3.87Å; I54-I58 WeakPolarHBondContact O-CG1 3.37Å; I54-I58 PolarHBondContact O-N 3.43Å; T55-I58 PolarHBondContact O-N 2.97Å; L56-I58 PolarHBondContact O-N 2.93Å; I58-K62 WeakPolarHBondContact O-CA 3.22Å; I58-K62 PolarHBondContact O-N 2.83Å; I58-K62 VanDerWaalsContact O-N 3.07Å; I58-V63 HydrophobicContact CG2-CB 4.47Å; I58-V63 PolarHBondContact O-N 3.47Å; I58-F64 HydrophobicContact CG2-CE1 4.43Å; I58-I72 HydrophobicContact CD1-CB 4.46Å; I58-I72 HydrophobicContact CD1-CG2 3.87Å; I58-L73 HydrophobicContact CB-CD1 4.26Å; I58-L73 HydrophobicContact CD1-CB 4.21Å; I58-L73 HydrophobicContact CG2-CB 4.09Å; I58-L73 HydrophobicContact CG2-CD1 4.3Å; I58-L73 HydrophobicContact CG2-CD2 4.26Å; I58-L73 HydrophobicContact CG2-CG 4.47Å |
| 59 | I | 87.1 | Confident | 86.4 | Confident | 78 Ų | 78 | 59.6 Ų | 59.6 | 40% | 0.4 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -65.5 | -56 | -179.8 | -67.6 | 170.9 | 0 | 0 | 0 | 110.7 | T55 L56 R61 K62 L73 | T55-I59 HydrophobicContact CG2-CD1 3.8Å; T55-I59 VanDerWaalsContact O-CG1 3.29Å; T55-I59 WeakPolarHBondContact O-CG1 3.47Å; T55-I59 PolarHBondContact O-N 3.47Å; T55-I59 VanDerWaalsContact O-N 3.08Å; L56-I59 PolarHBondContact O-N 2.84Å; I59-R61 VanDerWaalsContact C-N 3.31Å; I59-R61 PolarHBondContact O-N 3.42Å; I59-K62 PolarHBondContact O-N 3.21Å; I59-L73 HydrophobicContact CD1-CD1 4.14Å; I59-L73 HydrophobicContact CG1-CD1 3.86Å; I59-L73 HydrophobicContact CG1-CD2 4.36Å |
| 60 | L | 87.1 | Confident | 86.3 | Confident | 132 Ų | 132 | 56.8 Ų | 56.8 | 69% | 0.691 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -64.4 | -36.2 | -175.2 | -66.2 | 175.2 | 0 | 0 | 0 | 112 | L56 K62 | L56-L60 HydrophobicContact CB-CD1 4.38Å; L56-L60 VanDerWaalsContact O-CB 3.26Å; L56-L60 WeakPolarHBondContact O-CB 3.4Å; L56-L60 VanDerWaalsContact O-CG 3.22Å; L56-L60 WeakPolarHBondContact O-CG 3.3Å; L56-L60 PolarHBondContact O-N 3.28Å; L60-K62 VanDerWaalsContact C-N 3.3Å |
| 61 | R | 84 | Confident | 86.5 | Confident | 118 Ų | 118 | 55.3 Ų | 55.3 | 45% | 0.445 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | 0.7 | 177.5 | -57.1 | -63.4 | -116 | -156.2 | -4.7 | 113.2 | F57 I59 V63 | F57-R61 HydrophobicContact CD2-CG 3.99Å; F57-R61 HydrophobicContact CE2-CG 3.82Å; F57-R61 HydrophobicContact CG-CG 4.47Å; F57-R61 HydrophobicContact CZ-CG 4.15Å; F57-R61 WeakPolarHBondContact O-CB 3.42Å; F57-R61 VanDerWaalsContact O-CG 3.24Å; F57-R61 WeakPolarHBondContact O-CG 3.25Å; F57-R61 PolarHBondContact O-N 3.42Å; I59-R61 VanDerWaalsContact C-N 3.31Å; I59-R61 PolarHBondContact O-N 3.42Å; R61-V63 HydrophobicContact CB-CG2 3.49Å; R61-V63 VanDerWaalsContact CB-CG2 3.49Å; R61-V63 WeakPolarHBondContact O-CG2 3.03Å; R61-V63 PolarHBondContact O-N 3.27Å |
| 62 | K | 82.7 | Confident | 86.5 | Confident | 164 Ų | 164 | 56.5 Ų | 56.5 | 71% | 0.713 | 28% | 0.284 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.3 | 43.2 | -179 | -59.1 | -177.3 | 179.2 | -179.2 | 0 | 113 | I58 I59 L60 F64 | I58-K62 WeakPolarHBondContact O-CA 3.22Å; I58-K62 PolarHBondContact O-N 2.83Å; I58-K62 VanDerWaalsContact O-N 3.07Å; I59-K62 PolarHBondContact O-N 3.21Å; L60-K62 VanDerWaalsContact C-N 3.3Å; K62-F64 VanDerWaalsContact C-CD2 3.5Å; K62-F64 HydrophobicContact CB-CD2 4.17Å; K62-F64 HydrophobicContact CB-CE2 4.13Å; K62-F64 HydrophobicContact CG-CE2 4.45Å; K62-F64 PolarHBondContact O-N 2.78Å |
| 63 | V | 79.1 | Confident | 86.5 | Confident | 42 Ų | 42 | 55.7 Ų | 55.7 | 26% | 0.255 | 28% | 0.278 | S | S | . | . | trans | -83.2 | 44.6 | -171.1 | -176.2 | 0 | 0 | 0 | 0 | 111.7 | F57 I58 R61 T65 N69 | F57-V63 HydrophobicContact CE1-CG2 4.47Å; I58-V63 HydrophobicContact CG2-CB 4.47Å; I58-V63 PolarHBondContact O-N 3.47Å; R61-V63 HydrophobicContact CB-CG2 3.49Å; R61-V63 VanDerWaalsContact CB-CG2 3.49Å; R61-V63 WeakPolarHBondContact O-CG2 3.03Å; R61-V63 PolarHBondContact O-N 3.27Å; V63-T65 PolarHBondContact O-N 3.36Å; V63-N69 VanDerWaalsContact CG1-ND2 3.27Å; V63-N69 WeakPolarHBondContact CG1-ND2 3.32Å; V63-N69 WeakPolarHBondContact O-CB 3.32Å; V63-N69 PolarHBondContact O-ND2 2.86Å | ||
| 64 | F | 78.7 | Confident | 86.8 | Confident | 83 Ų | 83 | 51.2 Ų | 51.2 | 36% | 0.364 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | 24.5 | -178.9 | -51.7 | -80.4 | 0 | 0 | 0 | 113.6 | I58 K62 L73 | I58-F64 HydrophobicContact CG2-CE1 4.43Å; K62-F64 VanDerWaalsContact C-CD2 3.5Å; K62-F64 HydrophobicContact CB-CD2 4.17Å; K62-F64 HydrophobicContact CB-CE2 4.13Å; K62-F64 HydrophobicContact CG-CE2 4.45Å; K62-F64 PolarHBondContact O-N 2.78Å; F64-L73 HydrophobicContact CD1-CD2 4.19Å; F64-L73 HydrophobicContact CE1-CD2 3.38Å; F64-L73 HydrophobicContact CZ-CD2 4.24Å |
| 65 | T | 77.1 | Confident | 87.2 | Confident | 79 Ų | 79 | 50.8 Ų | 50.8 | 49% | 0.485 | 25% | 0.253 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.4 | -21 | -169 | 51.7 | 0 | 0 | 0 | 0 | 113.8 | V63 R146 | V63-T65 PolarHBondContact O-N 3.36Å; T65-R146 WeakPolarHBondContact O-CD 3.29Å |
| 66 | T | 84.5 | Confident | 87.4 | Confident | 44 Ų | 44 | 50.5 Ų | 50.5 | 27% | 0.27 | 25% | 0.251 | S | S | . | . | S | Bend | trans | -126.2 | 153.6 | -177 | 71 | 0 | 0 | 0 | 0 | 111.2 | T68 N69 I70 | T66-T68 VanDerWaalsContact C-N 3.31Å; T66-T68 PolarHBondContact O-N 3.07Å; T66-N69 PolarHBondContact O-N 2.96Å; T66-N69 VanDerWaalsContact O-N 3.13Å; T66-N69 PolarHBondContact OG1-N 3.46Å; T66-N69 VanDerWaalsContact OG1-N 3.12Å; T66-N69 PolarHBondContact OG1-ND2 2.98Å; T66-N69 VanDerWaalsContact OG1-ND2 3.08Å; T66-N69 PolarHBondContact OG1-OD1 3.35Å; T66-I70 PolarHBondContact O-N 2.74Å |
| 67 | V | 88.9 | Confident | 87.7 | Confident | 11 Ų | 11 | 49.4 Ų | 49.4 | 7% | 0.067 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -55.4 | -49.1 | 174 | 170.6 | 0 | 0 | 0 | 0 | 110.2 | N69 I70 L71 D129 K145 A149 | V67-N69 VanDerWaalsContact C-N 3.31Å; V67-N69 PolarHBondContact O-N 3.38Å; V67-I70 WeakPolarHBondContact O-CB 3.32Å; V67-I70 PolarHBondContact O-N 2.94Å; V67-I70 VanDerWaalsContact O-N 3.17Å; V67-L71 HydrophobicContact CG1-CD1 3.99Å; V67-L71 HydrophobicContact CG1-CG 4.4Å; V67-L71 WeakPolarHBondContact O-CG 3.29Å; V67-L71 PolarHBondContact O-N 3.06Å; V67-D129 WeakPolarHBondContact CG1-OD1 3.14Å; V67-K145 HydrophobicContact CG2-CB 4.04Å; V67-A149 HydrophobicContact CB-CB 4.45Å; V67-A149 HydrophobicContact CG1-CB 3.87Å; V67-A149 HydrophobicContact CG2-CB 4.38Å |
| 68 | T | 87.6 | Confident | 88.2 | Confident | 19 Ų | 19 | 46.4 Ų | 46.4 | 12% | 0.117 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -44.7 | -51.4 | 171 | -70 | 0 | 0 | 0 | 0 | 113.2 | T66 I70 L71 I72 D129 R130 | T66-T68 VanDerWaalsContact C-N 3.31Å; T66-T68 PolarHBondContact O-N 3.07Å; T68-I70 VanDerWaalsContact C-N 3.31Å; T68-I70 PolarHBondContact O-N 3.09Å; T68-L71 PolarHBondContact O-N 3.33Å; T68-I72 HydrophobicContact CG2-CD1 3.49Å; T68-I72 VanDerWaalsContact CG2-CD1 3.49Å; T68-I72 HydrophobicContact CG2-CG1 4.11Å; T68-I72 WeakPolarHBondContact O-CB 3.39Å; T68-I72 WeakPolarHBondContact O-CG1 3.33Å; T68-I72 PolarHBondContact O-N 3.31Å; T68-D129 PolarHBondContact OG1-OD2 3.18Å; T68-R130 PolarHBondContact OG1-NH1 3.19Å; T68-R130 PolarHBondContact OG1-NH2 3.34Å |
| 69 | N | 87.6 | Confident | 88.9 | Confident | 34 Ų | 34 | 45.9 Ų | 45.9 | 18% | 0.182 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -68.5 | -33.7 | -173.2 | -64.8 | -16.4 | 0 | 0 | 0 | 112.1 | V63 T66 V67 L73 | V63-N69 VanDerWaalsContact CG1-ND2 3.27Å; V63-N69 WeakPolarHBondContact CG1-ND2 3.32Å; V63-N69 WeakPolarHBondContact O-CB 3.32Å; V63-N69 PolarHBondContact O-ND2 2.86Å; T66-N69 PolarHBondContact O-N 2.96Å; T66-N69 VanDerWaalsContact O-N 3.13Å; T66-N69 PolarHBondContact OG1-N 3.46Å; T66-N69 VanDerWaalsContact OG1-N 3.12Å; T66-N69 PolarHBondContact OG1-ND2 2.98Å; T66-N69 VanDerWaalsContact OG1-ND2 3.08Å; T66-N69 PolarHBondContact OG1-OD1 3.35Å; V67-N69 VanDerWaalsContact C-N 3.31Å; V67-N69 PolarHBondContact O-N 3.38Å; N69-L73 WeakPolarHBondContact O-CB 3.46Å; N69-L73 PolarHBondContact O-N 3.07Å |
| 70 | I | 91.4 | Very high | 89.3 | Confident | 10 Ų | 10 | 43 Ų | 43 | 5% | 0.051 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64.1 | -44.3 | 174 | -64.3 | 162.3 | 0 | 0 | 0 | 109.7 | T66 V67 T68 L73 N74 R146 A149 V150 | T66-I70 PolarHBondContact O-N 2.74Å; V67-I70 WeakPolarHBondContact O-CB 3.32Å; V67-I70 PolarHBondContact O-N 2.94Å; V67-I70 VanDerWaalsContact O-N 3.17Å; T68-I70 VanDerWaalsContact C-N 3.31Å; T68-I70 PolarHBondContact O-N 3.09Å; I70-L73 PolarHBondContact O-N 3.37Å; I70-N74 PolarHBondContact O-N 2.95Å; I70-N74 PolarHBondContact O-ND2 3.38Å; I70-R146 HydrophobicContact CD1-CB 4.06Å; I70-R146 HydrophobicContact CD1-CG 4.28Å; I70-A149 HydrophobicContact CD1-CB 4.36Å; I70-A149 HydrophobicContact CG2-CB 4.25Å; I70-V150 HydrophobicContact CD1-CG2 4.21Å; I70-V150 HydrophobicContact CG2-CG2 4.13Å |
| 71 | L | 93.3 | Very high | 89.7 | Confident | 5 Ų | 5 | 39 Ų | 39 | 3% | 0.026 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -70 | -42.7 | 179 | -63.2 | 178.1 | 0 | 0 | 0 | 112.7 | V67 T68 L73 N74 L75 F122 L125 L126 D129 | V67-L71 HydrophobicContact CG1-CD1 3.99Å; V67-L71 HydrophobicContact CG1-CG 4.4Å; V67-L71 WeakPolarHBondContact O-CG 3.29Å; V67-L71 PolarHBondContact O-N 3.06Å; T68-L71 PolarHBondContact O-N 3.33Å; L71-L73 VanDerWaalsContact C-N 3.29Å; L71-L73 PolarHBondContact O-N 3.02Å; L71-N74 PolarHBondContact O-N 3.5Å; L71-L75 WeakPolarHBondContact O-CB 3.34Å; L71-L75 PolarHBondContact O-N 3.16Å; L71-F122 HydrophobicContact CD2-CD1 4.25Å; L71-L125 HydrophobicContact CD1-CB 3.93Å; L71-L125 HydrophobicContact CD2-CB 3.91Å; L71-L125 HydrophobicContact CD2-CD1 3.67Å; L71-L125 HydrophobicContact CD2-CG 4.47Å; L71-L126 HydrophobicContact CB-CD1 4.5Å; L71-L126 HydrophobicContact CB-CD2 3.54Å; L71-L126 HydrophobicContact CB-CG 3.82Å; L71-L126 HydrophobicContact CD1-CD2 4.11Å; L71-L126 HydrophobicContact CD1-CG 4.31Å; L71-D129 HydrophobicContact CD1-CB 4.09Å |
| 72 | I | 91.6 | Very high | 90.3 | Very high | 28 Ų | 28 | 33.6 Ų | 33.6 | 14% | 0.144 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -61.9 | -39.6 | 175.3 | -70.4 | 176.9 | 0 | 0 | 0 | 110.5 | I54 I58 T68 L75 S76 L126 Y317 | I54-I72 HydrophobicContact CG2-CG2 4.08Å; I58-I72 HydrophobicContact CD1-CB 4.46Å; I58-I72 HydrophobicContact CD1-CG2 3.87Å; T68-I72 HydrophobicContact CG2-CD1 3.49Å; T68-I72 VanDerWaalsContact CG2-CD1 3.49Å; T68-I72 HydrophobicContact CG2-CG1 4.11Å; T68-I72 WeakPolarHBondContact O-CB 3.39Å; T68-I72 WeakPolarHBondContact O-CG1 3.33Å; T68-I72 PolarHBondContact O-N 3.31Å; I72-L75 PolarHBondContact O-N 2.9Å; I72-S76 WeakPolarHBondContact O-CB 3.33Å; I72-S76 PolarHBondContact O-N 2.96Å; I72-S76 PolarHBondContact O-OG 3.41Å; I72-S76 VanDerWaalsContact O-OG 3.1Å; I72-L126 HydrophobicContact CG1-CD1 4.33Å; I72-L126 HydrophobicContact CG1-CD2 3.89Å; I72-Y317 HydrophobicContact CD1-CD1 4.06Å; I72-Y317 HydrophobicContact CD1-CE1 4.12Å; I72-Y317 HydrophobicContact CG1-CE1 4.3Å |
| 73 | L | 92.2 | Very high | 90.9 | Very high | 20 Ų | 20 | 25.8 Ų | 25.8 | 11% | 0.105 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -59 | -52.4 | 175.6 | 173.9 | 62.5 | 0 | 0 | 0 | 111 | T55 I58 I59 F64 N69 I70 L71 L75 S76 L77 | T55-L73 HydrophobicContact CG2-CD1 3.86Å; I58-L73 HydrophobicContact CB-CD1 4.26Å; I58-L73 HydrophobicContact CD1-CB 4.21Å; I58-L73 HydrophobicContact CG2-CB 4.09Å; I58-L73 HydrophobicContact CG2-CD1 4.3Å; I58-L73 HydrophobicContact CG2-CD2 4.26Å; I58-L73 HydrophobicContact CG2-CG 4.47Å; I59-L73 HydrophobicContact CD1-CD1 4.14Å; I59-L73 HydrophobicContact CG1-CD1 3.86Å; I59-L73 HydrophobicContact CG1-CD2 4.36Å; F64-L73 HydrophobicContact CD1-CD2 4.19Å; F64-L73 HydrophobicContact CE1-CD2 3.38Å; F64-L73 HydrophobicContact CZ-CD2 4.24Å; N69-L73 WeakPolarHBondContact O-CB 3.46Å; N69-L73 PolarHBondContact O-N 3.07Å; I70-L73 PolarHBondContact O-N 3.37Å; L71-L73 VanDerWaalsContact C-N 3.29Å; L71-L73 PolarHBondContact O-N 3.02Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-L75 PolarHBondContact O-N 2.8Å; L73-S76 PolarHBondContact O-N 3.38Å; L73-S76 PolarHBondContact O-OG 3.18Å; L73-L77 WeakPolarHBondContact O-CB 3.25Å; L73-L77 PolarHBondContact O-N 3.26Å |
| 74 | N | 95.8 | Very high | 91.7 | Very high | 24 Ų | 24 | 28.1 Ų | 28.1 | 13% | 0.128 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -62.9 | -39 | -179 | -80.1 | -84.2 | 0 | 0 | 0 | 112.3 | I70 L71 L77 A78 F122 W157 | I70-N74 PolarHBondContact O-N 2.95Å; I70-N74 PolarHBondContact O-ND2 3.38Å; L71-N74 PolarHBondContact O-N 3.5Å; N74-L77 PolarHBondContact O-N 2.88Å; N74-A78 WeakPolarHBondContact O-CB 3.44Å; N74-A78 PolarHBondContact O-N 3.4Å; N74-F122 HydrophobicContact CB-CD1 3.72Å; N74-F122 HydrophobicContact CB-CD2 3.86Å; N74-F122 HydrophobicContact CB-CE1 3.44Å; N74-F122 VanDerWaalsContact CB-CE1 3.44Å; N74-F122 HydrophobicContact CB-CE2 3.61Å; N74-F122 HydrophobicContact CB-CG 3.96Å; N74-F122 HydrophobicContact CB-CZ 3.42Å; N74-F122 VanDerWaalsContact CB-CZ 3.42Å; N74-W157 PolarHBondContact OD1-NE1 3.36Å |
| 75 | L | 95.4 | Very high | 92.6 | Very high | 3 Ų | 3 | 25.6 Ų | 25.6 | 2% | 0.016 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.8 | -53.6 | 171.9 | 177.9 | 58.8 | 0 | 0 | 0 | 111.3 | L71 I72 L73 L77 A78 D79 S119 F122 I123 L126 N313 Y317 | L71-L75 WeakPolarHBondContact O-CB 3.34Å; L71-L75 PolarHBondContact O-N 3.16Å; I72-L75 PolarHBondContact O-N 2.9Å; L73-L75 VanDerWaalsContact C-N 3.32Å; L73-L75 PolarHBondContact O-N 2.8Å; L75-L77 VanDerWaalsContact C-N 3.25Å; L75-L77 PolarHBondContact O-N 3.48Å; L75-A78 PolarHBondContact O-N 3.48Å; L75-D79 VanDerWaalsContact O-CG 3.3Å; L75-D79 PolarHBondContact O-N 2.91Å; L75-S119 WeakPolarHBondContact CD1-O 3.34Å; L75-S119 VanDerWaalsContact CD1-OG 3.26Å; L75-S119 WeakPolarHBondContact CD1-OG 3.42Å; L75-F122 HydrophobicContact CB-CB 3.85Å; L75-F122 HydrophobicContact CD1-CB 4.2Å; L75-I123 HydrophobicContact CD1-CD1 4.34Å; L75-I123 HydrophobicContact CD1-CG1 3.84Å; L75-I123 HydrophobicContact CD2-CG1 3.99Å; L75-L126 HydrophobicContact CB-CD1 4.37Å; L75-L126 HydrophobicContact CD2-CD1 3.56Å; L75-N313 HydrophobicContact CD2-CB 4.45Å; L75-Y317 HydrophobicContact CD2-CE2 3.95Å |
| 76 | S | 94.4 | Very high | 93.5 | Very high | 3 Ų | 3 | 21.9 Ų | 21.9 | 2% | 0.021 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -63.5 | -32 | -179.3 | 66.8 | 0 | 0 | 0 | 0 | 112.7 | T55 I72 L73 T80 | T55-S76 VanDerWaalsContact OG1-C 3.31Å; T55-S76 VanDerWaalsContact OG1-CB 3.26Å; T55-S76 WeakPolarHBondContact OG1-CB 3.5Å; T55-S76 PolarHBondContact OG1-O 3Å; T55-S76 PolarHBondContact OG1-OG 3.39Å; I72-S76 WeakPolarHBondContact O-CB 3.33Å; I72-S76 PolarHBondContact O-N 2.96Å; I72-S76 PolarHBondContact O-OG 3.41Å; I72-S76 VanDerWaalsContact O-OG 3.1Å; L73-S76 PolarHBondContact O-N 3.38Å; L73-S76 PolarHBondContact O-OG 3.18Å; S76-T80 WeakPolarHBondContact O-CB 3.47Å; S76-T80 PolarHBondContact O-N 3.4Å; S76-T80 PolarHBondContact O-OG1 2.83Å |
| 77 | L | 95.4 | Very high | 94.1 | Very high | 67 Ų | 67 | 22.4 Ų | 22.4 | 35% | 0.351 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -68 | -47.3 | 174.9 | 178.1 | 63.5 | 0 | 0 | 0 | 110.6 | T55 L73 N74 L75 T80 V81 | T55-L77 HydrophobicContact CG2-CB 4.49Å; T55-L77 HydrophobicContact CG2-CD1 4.35Å; L73-L77 WeakPolarHBondContact O-CB 3.25Å; L73-L77 PolarHBondContact O-N 3.26Å; N74-L77 PolarHBondContact O-N 2.88Å; L75-L77 VanDerWaalsContact C-N 3.25Å; L75-L77 PolarHBondContact O-N 3.48Å; L77-T80 PolarHBondContact O-N 2.97Å; L77-V81 HydrophobicContact CD1-CG2 4.32Å; L77-V81 WeakPolarHBondContact O-CG2 3.29Å; L77-V81 PolarHBondContact O-N 3.48Å |
| 78 | A | 97.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -59.2 | -50.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111 | N74 L75 T80 V81 F82 T115 A118 W157 | N74-A78 WeakPolarHBondContact O-CB 3.44Å; N74-A78 PolarHBondContact O-N 3.4Å; L75-A78 PolarHBondContact O-N 3.48Å; A78-T80 VanDerWaalsContact C-N 3.29Å; A78-T80 PolarHBondContact O-N 3.5Å; A78-V81 PolarHBondContact O-N 2.76Å; A78-F82 WeakPolarHBondContact O-CB 3.26Å; A78-F82 PolarHBondContact O-N 2.95Å; A78-T115 WeakPolarHBondContact O-CB 3.46Å; A78-A118 HydrophobicContact CB-CB 4.02Å; A78-W157 HydrophobicContact CB-CH2 3.74Å; A78-W157 HydrophobicContact CB-CZ2 4.02Å |
| 79 | D | 95.9 | Very high | 94.9 | Very high | 0 Ų | 0 | 24 Ų | 24 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -61.2 | -38.3 | 179.1 | -66.2 | -19.1 | 0 | 0 | 0 | 111.9 | N51 L75 F82 I83 S119 C310 N313 | N51-D79 HydrophobicContact CB-CB 4.32Å; N51-D79 WeakPolarHBondContact ND2-CB 3.39Å; L75-D79 VanDerWaalsContact O-CG 3.3Å; L75-D79 PolarHBondContact O-N 2.91Å; D79-F82 PolarHBondContact O-N 2.94Å; D79-I83 WeakPolarHBondContact O-CG1 3.26Å; D79-I83 WeakPolarHBondContact O-CG2 3.31Å; D79-I83 PolarHBondContact O-N 3.07Å; D79-I83 VanDerWaalsContact O-N 3.11Å; D79-S119 WeakPolarHBondContact OD1-CB 3.27Å; D79-S119 PolarHBondContact OD1-OG 3.46Å; D79-C310 HydrophobicContact CB-CB 3.97Å; D79-C310 WeakPolarHBondContact OD1-CB 3.44Å; D79-N313 PolarHBondContact OD2-ND2 3.26Å |
| 80 | T | 95.1 | Very high | 95.3 | Very high | 17 Ų | 17 | 23.8 Ų | 23.8 | 10% | 0.104 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -63.5 | -52.3 | 175.8 | -67 | 0 | 0 | 0 | 0 | 111.4 | N51 V52 S76 L77 A78 F82 I83 M84 | N51-T80 WeakPolarHBondContact CB-OG1 3.4Å; V52-T80 HydrophobicContact CG2-CG2 3.6Å; V52-T80 PolarHBondContact N-OG1 3.49Å; S76-T80 WeakPolarHBondContact O-CB 3.47Å; S76-T80 PolarHBondContact O-N 3.4Å; S76-T80 PolarHBondContact O-OG1 2.83Å; L77-T80 PolarHBondContact O-N 2.97Å; A78-T80 VanDerWaalsContact C-N 3.29Å; A78-T80 PolarHBondContact O-N 3.5Å; T80-F82 PolarHBondContact O-N 3.48Å; T80-I83 WeakPolarHBondContact O-CG1 3.46Å; T80-I83 PolarHBondContact O-N 3.24Å; T80-M84 HydrophobicContact CG2-CG 4.24Å; T80-M84 WeakPolarHBondContact O-CG 3.43Å; T80-M84 PolarHBondContact O-N 3.41Å; T80-M84 VanDerWaalsContact O-N 3.09Å |
| 81 | V | 96.3 | Very high | 95.6 | Very high | 49 Ų | 49 | 24.7 Ų | 24.7 | 30% | 0.297 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -62.9 | -36.7 | -179.2 | 177.7 | 0 | 0 | 0 | 0 | 110.3 | L77 A78 M84 F85 T115 | L77-V81 HydrophobicContact CD1-CG2 4.32Å; L77-V81 WeakPolarHBondContact O-CG2 3.29Å; L77-V81 PolarHBondContact O-N 3.48Å; A78-V81 PolarHBondContact O-N 2.76Å; V81-M84 PolarHBondContact O-N 3.1Å; V81-F85 HydrophobicContact CG1-CE2 4.4Å; V81-F85 WeakPolarHBondContact O-CD2 3.5Å; V81-T115 HydrophobicContact CB-CG2 3.78Å; V81-T115 HydrophobicContact CG1-CG2 3.68Å |
| 82 | F | 96.5 | Very high | 95.7 | Very high | 3 Ų | 3 | 26 Ų | 26 | 1% | 0.013 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -60 | -48.7 | 177 | -175.6 | -150.9 | 0 | 0 | 0 | 112.7 | A78 D79 T80 M84 E112 T115 K116 P306 Y307 C310 | A78-F82 WeakPolarHBondContact O-CB 3.26Å; A78-F82 PolarHBondContact O-N 2.95Å; D79-F82 PolarHBondContact O-N 2.94Å; T80-F82 PolarHBondContact O-N 3.48Å; F82-M84 PolarHBondContact O-N 2.81Å; F82-E112 HydrophobicContact CD2-CG 4.39Å; F82-E112 HydrophobicContact CE2-CB 4.44Å; F82-E112 HydrophobicContact CE2-CG 3.85Å; F82-T115 WeakPolarHBondContact CA-OG1 3.03Å; F82-T115 WeakPolarHBondContact CB-OG1 3.03Å; F82-T115 PolarHBondContact N-OG1 3.35Å; F82-K116 HydrophobicContact CD1-CB 4.35Å; F82-K116 HydrophobicContact CD1-CG 4.42Å; F82-K116 HydrophobicContact CD2-CB 4.26Å; F82-K116 HydrophobicContact CE1-CB 4.17Å; F82-K116 HydrophobicContact CE1-CD 4.42Å; F82-K116 HydrophobicContact CE1-CG 3.8Å; F82-K116 HydrophobicContact CE2-CB 4.08Å; F82-K116 HydrophobicContact CE2-CD 4.28Å; F82-K116 HydrophobicContact CE2-CG 4.19Å; F82-K116 HydrophobicContact CG-CB 4.42Å; F82-K116 HydrophobicContact CZ-CB 4.04Å; F82-K116 HydrophobicContact CZ-CD 3.83Å; F82-K116 HydrophobicContact CZ-CG 3.67Å; F82-P306 HydrophobicContact CE1-CB 4.34Å; F82-P306 HydrophobicContact CZ-CB 4.3Å; F82-Y307 HydrophobicContact CD1-CD1 4.2Å; F82-Y307 HydrophobicContact CD1-CE1 4.43Å; F82-Y307 HydrophobicContact CD2-CD1 4.3Å; F82-Y307 AromaticContact CD2-CE1 3.72Å; F82-Y307 HydrophobicContact CD2-CE1 3.72Å; F82-Y307 AromaticContact CE1-CD1 3.64Å; F82-Y307 HydrophobicContact CE1-CD1 3.64Å; F82-Y307 AromaticContact CE1-CE1 3.93Å; F82-Y307 HydrophobicContact CE1-CE1 3.93Å; F82-Y307 HydrophobicContact CE1-CG 4.01Å; F82-Y307 AromaticContact CE2-CD1 3.75Å; F82-Y307 HydrophobicContact CE2-CD1 3.75Å; F82-Y307 AromaticContact CE2-CE1 3.11Å; F82-Y307 HydrophobicContact CE2-CE1 3.11Å; F82-Y307 HydrophobicContact CE2-CE2 4.13Å; F82-Y307 HydrophobicContact CE2-CG 4.49Å; F82-Y307 AromaticContact CE2-CZ 3.33Å; F82-Y307 WeakPolarHBondContact CE2-OH 3.13Å; F82-Y307 HydrophobicContact CG-CD1 4.49Å; F82-Y307 HydrophobicContact CG-CE1 4.33Å; F82-Y307 AromaticContact CZ-CD1 3.38Å; F82-Y307 HydrophobicContact CZ-CD1 3.38Å; F82-Y307 AromaticContact CZ-CD2 3.97Å; F82-Y307 HydrophobicContact CZ-CD2 3.97Å; F82-Y307 AromaticContact CZ-CE1 3.23Å; F82-Y307 HydrophobicContact CZ-CE1 3.23Å; F82-Y307 AromaticContact CZ-CE2 3.82Å; F82-Y307 HydrophobicContact CZ-CE2 3.82Å; F82-Y307 AromaticContact CZ-CG 3.76Å; F82-Y307 HydrophobicContact CZ-CG 3.76Å; F82-Y307 AromaticContact CZ-CZ 3.45Å; F82-Y307 VanDerWaalsContact CZ-CZ 3.45Å; F82-C310 HydrophobicContact CD1-CB 4.04Å; F82-C310 HydrophobicContact CE1-CB 4.47Å |
| 83 | I | 95.7 | Very high | 95.8 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -73.7 | -24.1 | -179.2 | 64 | 172.9 | 0 | 0 | 0 | 113.5 | F45 G48 D79 T80 F85 L86 V311 | F45-I83 WeakPolarHBondContact CD2-O 3.27Å; G48-I83 WeakPolarHBondContact O-CD1 3.5Å; D79-I83 WeakPolarHBondContact O-CG1 3.26Å; D79-I83 WeakPolarHBondContact O-CG2 3.31Å; D79-I83 PolarHBondContact O-N 3.07Å; D79-I83 VanDerWaalsContact O-N 3.11Å; T80-I83 WeakPolarHBondContact O-CG1 3.46Å; T80-I83 PolarHBondContact O-N 3.24Å; I83-F85 PolarHBondContact O-N 2.93Å; I83-L86 HydrophobicContact CB-CD1 4.2Å; I83-L86 HydrophobicContact CG2-CD1 4.36Å; I83-L86 VanDerWaalsContact O-CB 3.28Å; I83-L86 WeakPolarHBondContact O-CB 3.36Å; I83-L86 WeakPolarHBondContact O-CG 3.43Å; I83-L86 PolarHBondContact O-N 2.85Å; I83-V311 HydrophobicContact CG2-CG1 4.21Å |
| 84 | M | 95.8 | Very high | 95.9 | Very high | 92 Ų | 92 | 31.5 Ų | 31.5 | 45% | 0.453 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -63 | -18.5 | -174.9 | -80.5 | -62.9 | -65.2 | 0 | 0 | 112.8 | F45 T80 V81 F82 P87 | F45-M84 HydrophobicContact CE2-SD 4.26Å; T80-M84 HydrophobicContact CG2-CG 4.24Å; T80-M84 WeakPolarHBondContact O-CG 3.43Å; T80-M84 PolarHBondContact O-N 3.41Å; T80-M84 VanDerWaalsContact O-N 3.09Å; V81-M84 PolarHBondContact O-N 3.1Å; F82-M84 PolarHBondContact O-N 2.81Å; M84-P87 WeakPolarHBondContact O-CD 2.89Å |
| 85 | F | 96 | Very high | 95.8 | Very high | 30 Ų | 30 | 36.5 Ų | 36.5 | 13% | 0.132 | 18% | 0.183 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90 | -6.1 | 175.1 | -70.2 | -90 | 0 | 0 | 0 | 114.8 | V81 I83 P87 F88 V89 L107 F108 S111 | V81-F85 HydrophobicContact CG1-CE2 4.4Å; V81-F85 WeakPolarHBondContact O-CD2 3.5Å; I83-F85 PolarHBondContact O-N 2.93Å; F85-P87 VanDerWaalsContact C-CD 3.42Å; F85-P87 VanDerWaalsContact C-N 3.34Å; F85-F88 HydrophobicContact CB-CD2 4.38Å; F85-F88 AromaticContact CD1-CD2 4Å; F85-F88 HydrophobicContact CD1-CD2 4Å; F85-F88 HydrophobicContact CD1-CE2 4.18Å; F85-F88 WeakPolarHBondContact O-CB 3.13Å; F85-F88 PolarHBondContact O-N 3.33Å; F85-V89 PolarHBondContact O-N 3.48Å; F85-L107 HydrophobicContact CE1-CB 4.2Å; F85-L107 HydrophobicContact CZ-CB 4.33Å; F85-F108 HydrophobicContact CB-CD2 3.66Å; F85-F108 HydrophobicContact CB-CE2 4.18Å; F85-F108 HydrophobicContact CD1-CB 4.06Å; F85-F108 HydrophobicContact CD1-CD2 4.23Å; F85-F108 HydrophobicContact CE1-CB 4.49Å; F85-F108 HydrophobicContact CG-CD2 4.12Å; F85-S111 VanDerWaalsContact CE2-OG 3.25Å; F85-S111 WeakPolarHBondContact CE2-OG 3.24Å; F85-S111 WeakPolarHBondContact CZ-OG 3.42Å |
| 86 | L | 96.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -56.4 | -36.5 | 177.5 | -73.6 | -179.5 | 0 | 0 | 0 | 114.4 | Y41 L44 F45 I83 F88 V89 I90 Y307 | Y41-L86 HydrophobicContact CD1-CD2 3.5Å; Y41-L86 HydrophobicContact CE1-CD2 4.09Å; Y41-L86 HydrophobicContact CG-CD2 4.25Å; L44-L86 HydrophobicContact CB-CD1 4.03Å; F45-L86 HydrophobicContact CB-CB 4.21Å; F45-L86 HydrophobicContact CB-CD1 4.04Å; F45-L86 HydrophobicContact CD2-CB 4.26Å; I83-L86 HydrophobicContact CB-CD1 4.2Å; I83-L86 HydrophobicContact CG2-CD1 4.36Å; I83-L86 VanDerWaalsContact O-CB 3.28Å; I83-L86 WeakPolarHBondContact O-CB 3.36Å; I83-L86 WeakPolarHBondContact O-CG 3.43Å; I83-L86 PolarHBondContact O-N 2.85Å; L86-F88 PolarHBondContact O-N 3.38Å; L86-V89 WeakPolarHBondContact O-CB 3.13Å; L86-V89 PolarHBondContact O-N 2.72Å; L86-V89 VanDerWaalsContact O-N 3.13Å; L86-I90 VanDerWaalsContact O-CG1 3.27Å; L86-I90 WeakPolarHBondContact O-CG1 3.44Å; L86-I90 PolarHBondContact O-N 2.99Å; L86-Y307 HydrophobicContact CD1-CD1 4.1Å; L86-Y307 HydrophobicContact CD2-CD1 3.62Å; L86-Y307 HydrophobicContact CD2-CE1 3.35Å; L86-Y307 HydrophobicContact CD2-CE2 4.46Å; L86-Y307 HydrophobicContact CD2-CG 4.26Å; L86-Y307 HydrophobicContact CG-CD1 4.06Å; L86-Y307 HydrophobicContact CG-CE1 3.97Å |
| 87 | P | 97.5 | Very high | 95.7 | Very high | 56 Ų | 56 | 45 Ų | 45 | 36% | 0.364 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -56.9 | -36.1 | 173.6 | -27.6 | 37.1 | 0 | 0 | 0 | 113.8 | F45 M84 F85 I90 S91 | F45-P87 HydrophobicContact CD2-CG 4.13Å; F45-P87 HydrophobicContact CE2-CG 3.86Å; F45-P87 HydrophobicContact CZ-CG 4.1Å; M84-P87 WeakPolarHBondContact O-CD 2.89Å; F85-P87 VanDerWaalsContact C-CD 3.42Å; F85-P87 VanDerWaalsContact C-N 3.34Å; P87-I90 PolarHBondContact O-N 3.03Å; P87-S91 WeakPolarHBondContact O-CB 3.23Å; P87-S91 PolarHBondContact O-N 2.81Å |
| 88 | F | 97.1 | Very high | 95.8 | Very high | 55 Ų | 55 | 42.3 Ų | 42.3 | 24% | 0.241 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -69.9 | -40.9 | 176.2 | -58.3 | -91.8 | 0 | 0 | 0 | 111.1 | F85 L86 S91 F92 W98 F100 I104 | F85-F88 HydrophobicContact CB-CD2 4.38Å; F85-F88 AromaticContact CD1-CD2 4Å; F85-F88 HydrophobicContact CD1-CD2 4Å; F85-F88 HydrophobicContact CD1-CE2 4.18Å; F85-F88 WeakPolarHBondContact O-CB 3.13Å; F85-F88 PolarHBondContact O-N 3.33Å; L86-F88 PolarHBondContact O-N 3.38Å; F88-S91 PolarHBondContact O-N 3.22Å; F88-F92 WeakPolarHBondContact O-CB 3.37Å; F88-F92 PolarHBondContact O-N 2.8Å; F88-W98 HydrophobicContact CB-CH2 4.16Å; F88-W98 HydrophobicContact CB-CZ3 4.35Å; F88-F100 HydrophobicContact CB-CD2 4.37Å; F88-F100 HydrophobicContact CB-CE2 4.05Å; F88-F100 AromaticContact CD1-CD1 3.77Å; F88-F100 HydrophobicContact CD1-CD1 3.77Å; F88-F100 AromaticContact CD1-CD2 3.74Å; F88-F100 HydrophobicContact CD1-CD2 3.74Å; F88-F100 AromaticContact CD1-CE1 3.76Å; F88-F100 HydrophobicContact CD1-CE1 3.76Å; F88-F100 AromaticContact CD1-CE2 3.72Å; F88-F100 HydrophobicContact CD1-CE2 3.72Å; F88-F100 AromaticContact CD1-CG 3.75Å; F88-F100 HydrophobicContact CD1-CG 3.75Å; F88-F100 AromaticContact CD1-CZ 3.72Å; F88-F100 HydrophobicContact CD1-CZ 3.72Å; F88-F100 AromaticContact CE1-CD1 3.94Å; F88-F100 HydrophobicContact CE1-CD1 3.94Å; F88-F100 HydrophobicContact CE1-CE1 4.03Å; F88-F100 HydrophobicContact CE1-CG 4.25Å; F88-F100 HydrophobicContact CE1-CZ 4.42Å; F88-F100 HydrophobicContact CG-CE2 4.35Å; F88-F100 HydrophobicContact CG-CZ 4.5Å; F88-I104 HydrophobicContact CD1-CG2 3.68Å; F88-I104 HydrophobicContact CE1-CG2 3.66Å; F88-I104 HydrophobicContact CG-CG2 4.35Å; F88-I104 HydrophobicContact CZ-CG2 4.32Å |
| 89 | V | 95.9 | Very high | 95.8 | Very high | 8 Ų | 8 | 47.1 Ų | 47.1 | 5% | 0.048 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.1 | -45.9 | 173.7 | 179.7 | 0 | 0 | 0 | 0 | 110.7 | Y41 F85 L86 S91 F92 R93 F108 | Y41-V89 HydrophobicContact CD2-CG1 4.03Å; Y41-V89 HydrophobicContact CE1-CG1 4.29Å; Y41-V89 HydrophobicContact CE2-CG1 3.77Å; Y41-V89 HydrophobicContact CG-CG1 4.43Å; F85-V89 PolarHBondContact O-N 3.48Å; L86-V89 WeakPolarHBondContact O-CB 3.13Å; L86-V89 PolarHBondContact O-N 2.72Å; L86-V89 VanDerWaalsContact O-N 3.13Å; V89-S91 PolarHBondContact O-N 2.92Å; V89-F92 PolarHBondContact O-N 3.13Å; V89-R93 HydrophobicContact CG1-CG 4.32Å; V89-R93 VanDerWaalsContact O-CG 3.26Å; V89-R93 WeakPolarHBondContact O-CG 3.26Å; V89-R93 PolarHBondContact O-N 2.87Å; V89-F108 HydrophobicContact CG2-CD2 4.45Å; V89-F108 HydrophobicContact CG2-CE2 3.54Å; V89-F108 HydrophobicContact CG2-CZ 3.77Å |
| 90 | I | 97.2 | Very high | 95.8 | Very high | 30 Ų | 30 | 50.2 Ų | 50.2 | 15% | 0.154 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -58.5 | -50.3 | 177.1 | -69.2 | 162.6 | 0 | 0 | 0 | 110.5 | A38 Y41 A42 L86 P87 F92 R93 I94 | A38-I90 HydrophobicContact CB-CG2 4.31Å; Y41-I90 HydrophobicContact CG-CG1 4.49Å; A42-I90 HydrophobicContact CB-CD1 4.04Å; L86-I90 VanDerWaalsContact O-CG1 3.27Å; L86-I90 WeakPolarHBondContact O-CG1 3.44Å; L86-I90 PolarHBondContact O-N 2.99Å; P87-I90 PolarHBondContact O-N 3.03Å; I90-F92 VanDerWaalsContact C-N 3.32Å; I90-F92 PolarHBondContact O-N 3.26Å; I90-R93 PolarHBondContact O-N 3.42Å; I90-I94 HydrophobicContact CG2-CD1 3.81Å; I90-I94 WeakPolarHBondContact O-CG1 3.34Å; I90-I94 PolarHBondContact O-N 3.36Å |
| 91 | S | 97.3 | Very high | 95.9 | Very high | 28 Ų | 28 | 51 Ų | 51 | 20% | 0.196 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -56.5 | -47.1 | 176.8 | -179.9 | 0 | 0 | 0 | 0 | 111.4 | P87 F88 V89 R93 I94 K95 | P87-S91 WeakPolarHBondContact O-CB 3.23Å; P87-S91 PolarHBondContact O-N 2.81Å; F88-S91 PolarHBondContact O-N 3.22Å; V89-S91 PolarHBondContact O-N 2.92Å; S91-R93 PolarHBondContact O-N 2.94Å; S91-I94 PolarHBondContact O-N 2.91Å; S91-K95 WeakPolarHBondContact O-CB 3.21Å; S91-K95 WeakPolarHBondContact O-CG 3.45Å; S91-K95 PolarHBondContact O-N 3.12Å |
| 92 | F | 95.1 | Very high | 95.9 | Very high | 32 Ų | 32 | 51.5 Ų | 51.5 | 14% | 0.14 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.9 | -40.8 | 177.4 | 177.6 | -123.6 | 0 | 0 | 0 | 112.7 | F88 V89 I90 R96 W98 V182 | F88-F92 WeakPolarHBondContact O-CB 3.37Å; F88-F92 PolarHBondContact O-N 2.8Å; V89-F92 PolarHBondContact O-N 3.13Å; I90-F92 VanDerWaalsContact C-N 3.32Å; I90-F92 PolarHBondContact O-N 3.26Å; F92-R96 WeakPolarHBondContact O-CA 3.32Å; F92-R96 PolarHBondContact O-N 2.75Å; F92-W98 HydrophobicContact CB-CE3 4.17Å; F92-W98 HydrophobicContact CD2-CB 4.09Å; F92-W98 HydrophobicContact CD2-CE3 4.31Å; F92-W98 HydrophobicContact CE2-CB 4.18Å; F92-W98 HydrophobicContact CG-CE3 4.21Å; F92-V182 HydrophobicContact CE2-CG1 4.36Å; F92-V182 HydrophobicContact CZ-CB 4.21Å; F92-V182 HydrophobicContact CZ-CG1 4.08Å |
| 93 | R | 93.1 | Very high | 96 | Very high | 60 Ų | 60 | 54.8 Ų | 54.8 | 23% | 0.226 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -65.5 | -38.1 | 177.7 | -68.5 | -65 | 179 | -119.7 | 3.1 | 112.7 | Y41 V89 I90 S91 N300 | Y41-R93 HydrophobicContact CE2-CG 4.25Å; V89-R93 HydrophobicContact CG1-CG 4.32Å; V89-R93 VanDerWaalsContact O-CG 3.26Å; V89-R93 WeakPolarHBondContact O-CG 3.26Å; V89-R93 PolarHBondContact O-N 2.87Å; I90-R93 PolarHBondContact O-N 3.42Å; S91-R93 PolarHBondContact O-N 2.94Å; R93-N300 PolarHBondContact NH2-OD1 2.98Å |
| 94 | I | 94.1 | Very high | 96.1 | Very high | 104 Ų | 104 | 57.1 Ų | 57.1 | 53% | 0.533 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -76.1 | -48.8 | 179 | -64.7 | 169.6 | 0 | 0 | 0 | 110.9 | A38 I90 S91 | A38-I94 HydrophobicContact CB-CD1 4.34Å; A38-I94 HydrophobicContact CB-CG1 4.08Å; I90-I94 HydrophobicContact CG2-CD1 3.81Å; I90-I94 WeakPolarHBondContact O-CG1 3.34Å; I90-I94 PolarHBondContact O-N 3.36Å; S91-I94 PolarHBondContact O-N 2.91Å |
| 95 | K | 93.8 | Very high | 96.2 | Very high | 129 Ų | 129 | 52.8 Ų | 52.8 | 56% | 0.561 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -77.2 | -20.1 | -175.5 | -66.2 | -66.2 | -173.1 | 178.9 | 0 | 113.5 | S91 T97 | S91-K95 WeakPolarHBondContact O-CB 3.21Å; S91-K95 WeakPolarHBondContact O-CG 3.45Å; S91-K95 PolarHBondContact O-N 3.12Å; K95-T97 HydrophobicContact CB-CG2 4.39Å; K95-T97 PolarHBondContact O-N 3.01Å; K95-T97 VanDerWaalsContact O-N 3.12Å |
| 96 | R | 92.2 | Very high | 96.3 | Very high | 154 Ų | 154 | 55.3 Ų | 55.3 | 58% | 0.581 | 29% | 0.285 | S | S | * | . | S | Bend | trans | 63.9 | 4.7 | -175.6 | -50.8 | 178.2 | -70.6 | -170.6 | -9.3 | 114.6 | R34 F92 T180 | R34-R96 VanDerWaalsContact NH1-CD 3.26Å; F92-R96 WeakPolarHBondContact O-CA 3.32Å; F92-R96 PolarHBondContact O-N 2.75Å; R96-T180 VanDerWaalsContact O-CG2 3.25Å; R96-T180 WeakPolarHBondContact O-CG2 3.43Å |
| 97 | T | 95.7 | Very high | 96.3 | Very high | 30 Ų | 30 | 59.4 Ų | 59.4 | 18% | 0.184 | 31% | 0.307 | C | S | . | . | S | Bend | trans | -141.2 | 143 | 179.9 | -170.2 | 0 | 0 | 0 | 0 | 109.5 | K95 I99 V181 | K95-T97 HydrophobicContact CB-CG2 4.39Å; K95-T97 PolarHBondContact O-N 3.01Å; K95-T97 VanDerWaalsContact O-N 3.12Å; T97-I99 HydrophobicContact CG2-CG2 3.84Å; T97-I99 PolarHBondContact O-N 2.96Å; T97-V181 CarbonylContact C-O 3.57Å; T97-V181 WeakPolarHBondContact CA-O 3.1Å; T97-V181 PolarHBondContact OG1-N 2.57Å; T97-V181 PolarHBondContact OG1-O 3.25Å |
| 98 | W | 97.1 | Very high | 96.3 | Very high | 12 Ų | 12 | 57.7 Ų | 57.7 | 5% | 0.045 | 29% | 0.294 | C | S | . | . | trans | -83.9 | 110 | -179.7 | -179.3 | -93.1 | 0 | 0 | 0 | 110.1 | F88 F92 F100 G101 I104 C105 F108 V181 C183 | F88-W98 HydrophobicContact CB-CH2 4.16Å; F88-W98 HydrophobicContact CB-CZ3 4.35Å; F92-W98 HydrophobicContact CB-CE3 4.17Å; F92-W98 HydrophobicContact CD2-CB 4.09Å; F92-W98 HydrophobicContact CD2-CE3 4.31Å; F92-W98 HydrophobicContact CE2-CB 4.18Å; F92-W98 HydrophobicContact CG-CE3 4.21Å; W98-F100 HydrophobicContact CD2-CD2 4.23Å; W98-F100 HydrophobicContact CE3-CD2 4.25Å; W98-F100 HydrophobicContact CH2-CD2 4.05Å; W98-F100 HydrophobicContact CZ2-CB 3.8Å; W98-F100 AromaticContact CZ2-CD2 4Å; W98-F100 HydrophobicContact CZ2-CD2 4Å; W98-F100 HydrophobicContact CZ2-CG 4.36Å; W98-F100 HydrophobicContact CZ3-CD2 4.17Å; W98-G101 PolarHBondContact NE1-O 2.9Å; W98-I104 HydrophobicContact CH2-CG2 4.17Å; W98-I104 HydrophobicContact CZ2-CB 4.06Å; W98-I104 HydrophobicContact CZ2-CG2 3.79Å; W98-C105 HydrophobicContact CZ2-CB 3.94Å; W98-F108 HydrophobicContact CH2-CB 4.33Å; W98-V181 HydrophobicContact CB-CG1 4.49Å; W98-V181 PolarHBondContact N-O 3.47Å; W98-C183 HydrophobicContact CB-CB 4.27Å; W98-C183 HydrophobicContact CD2-CB 3.47Å; W98-C183 VanDerWaalsContact CD2-CB 3.47Å; W98-C183 HydrophobicContact CE3-CB 3.68Å; W98-C183 HydrophobicContact CG-CB 3.73Å; W98-C183 HydrophobicContact CZ2-CB 4.43Å; W98-C183 HydrophobicContact CZ3-CB 4.23Å | ||
| 99 | I | 96.6 | Very high | 96.4 | Very high | 100 Ų | 100 | 56.4 Ų | 56.4 | 51% | 0.513 | 29% | 0.288 | S | S | . | . | trans | -101.8 | 0 | -172.7 | 63.8 | 172.3 | 0 | 0 | 0 | 114.5 | T97 | T97-I99 HydrophobicContact CG2-CG2 3.84Å; T97-I99 PolarHBondContact O-N 2.96Å | ||
| 100 | F | 97.3 | Very high | 96.5 | Very high | 66 Ų | 66 | 58.4 Ų | 58.4 | 29% | 0.289 | 30% | 0.298 | S | S | . | . | S | Bend | trans | -97.6 | 4.6 | -170.7 | -54.8 | -76.3 | 0 | 0 | 0 | 114 | F88 W98 I104 | F88-F100 HydrophobicContact CB-CD2 4.37Å; F88-F100 HydrophobicContact CB-CE2 4.05Å; F88-F100 AromaticContact CD1-CD1 3.77Å; F88-F100 HydrophobicContact CD1-CD1 3.77Å; F88-F100 AromaticContact CD1-CD2 3.74Å; F88-F100 HydrophobicContact CD1-CD2 3.74Å; F88-F100 AromaticContact CD1-CE1 3.76Å; F88-F100 HydrophobicContact CD1-CE1 3.76Å; F88-F100 AromaticContact CD1-CE2 3.72Å; F88-F100 HydrophobicContact CD1-CE2 3.72Å; F88-F100 AromaticContact CD1-CG 3.75Å; F88-F100 HydrophobicContact CD1-CG 3.75Å; F88-F100 AromaticContact CD1-CZ 3.72Å; F88-F100 HydrophobicContact CD1-CZ 3.72Å; F88-F100 AromaticContact CE1-CD1 3.94Å; F88-F100 HydrophobicContact CE1-CD1 3.94Å; F88-F100 HydrophobicContact CE1-CE1 4.03Å; F88-F100 HydrophobicContact CE1-CG 4.25Å; F88-F100 HydrophobicContact CE1-CZ 4.42Å; F88-F100 HydrophobicContact CG-CE2 4.35Å; F88-F100 HydrophobicContact CG-CZ 4.5Å; W98-F100 HydrophobicContact CD2-CD2 4.23Å; W98-F100 HydrophobicContact CE3-CD2 4.25Å; W98-F100 HydrophobicContact CH2-CD2 4.05Å; W98-F100 HydrophobicContact CZ2-CB 3.8Å; W98-F100 AromaticContact CZ2-CD2 4Å; W98-F100 HydrophobicContact CZ2-CD2 4Å; W98-F100 HydrophobicContact CZ2-CG 4.36Å; W98-F100 HydrophobicContact CZ3-CD2 4.17Å; F100-I104 HydrophobicContact CB-CB 3.73Å; F100-I104 HydrophobicContact CB-CG1 4.05Å; F100-I104 HydrophobicContact CB-CG2 3.83Å; F100-I104 HydrophobicContact CG-CG2 4.42Å; F100-I104 WeakPolarHBondContact O-CG1 3.43Å |
| 101 | G | 96.7 | Very high | 96.4 | Very high | 32 Ų | 32 | 57.9 Ų | 57.9 | 33% | 0.33 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | 69.8 | 179.4 | -179.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | W98 C105 | W98-G101 PolarHBondContact NE1-O 2.9Å; G101-C105 PolarHBondContact O-N 3.35Å |
| 102 | T | 97.1 | Very high | 96.4 | Very high | 61 Ų | 61 | 58 Ų | 58 | 37% | 0.374 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -67.6 | -37.3 | -172.5 | -47.8 | 0 | 0 | 0 | 0 | 113.3 | C105 K106 I173 | T102-C105 WeakPolarHBondContact O-CB 3.39Å; T102-C105 PolarHBondContact O-N 3.28Å; T102-K106 HydrophobicContact CG2-CD 4.47Å; T102-K106 HydrophobicContact CG2-CG 4.48Å; T102-K106 PolarHBondContact O-N 3.26Å; T102-I173 VanDerWaalsContact OG1-CD1 3.26Å; T102-I173 WeakPolarHBondContact OG1-CD1 3.45Å; T102-I173 WeakPolarHBondContact OG1-CG1 3.31Å |
| 103 | A | 97.7 | Very high | 96.4 | Very high | 71 Ų | 71 | 56.6 Ų | 56.6 | 59% | 0.587 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -61.8 | -48.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | C105 K106 L107 | A103-C105 VanDerWaalsContact C-N 3.31Å; A103-C105 PolarHBondContact O-N 3.03Å; A103-K106 PolarHBondContact O-N 3.01Å; A103-L107 WeakPolarHBondContact O-CB 3.4Å; A103-L107 WeakPolarHBondContact O-CG 3.34Å; A103-L107 PolarHBondContact O-N 3.38Å |
| 104 | I | 97.6 | Very high | 96.7 | Very high | 50 Ų | 50 | 54.3 Ų | 54.3 | 26% | 0.256 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -68.4 | -33.8 | 177 | -55.9 | -57.6 | 0 | 0 | 0 | 110.9 | F88 W98 F100 L107 F108 | F88-I104 HydrophobicContact CD1-CG2 3.68Å; F88-I104 HydrophobicContact CE1-CG2 3.66Å; F88-I104 HydrophobicContact CG-CG2 4.35Å; F88-I104 HydrophobicContact CZ-CG2 4.32Å; W98-I104 HydrophobicContact CH2-CG2 4.17Å; W98-I104 HydrophobicContact CZ2-CB 4.06Å; W98-I104 HydrophobicContact CZ2-CG2 3.79Å; F100-I104 HydrophobicContact CB-CB 3.73Å; F100-I104 HydrophobicContact CB-CG1 4.05Å; F100-I104 HydrophobicContact CB-CG2 3.83Å; F100-I104 HydrophobicContact CG-CG2 4.42Å; F100-I104 WeakPolarHBondContact O-CG1 3.43Å; I104-L107 HydrophobicContact CD1-CD1 4.24Å; I104-L107 PolarHBondContact O-N 3.39Å; I104-F108 VanDerWaalsContact O-CB 3.28Å; I104-F108 WeakPolarHBondContact O-CB 3.28Å; I104-F108 PolarHBondContact O-N 2.86Å |
| 105 | C | 98.2 | Very high | 96.8 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.8 | -47.6 | 176 | 175.5 | 0 | 0 | 0 | 0 | 111.7 | W98 G101 T102 A103 F108 F109 E172 I173 C183 | W98-C105 HydrophobicContact CZ2-CB 3.94Å; G101-C105 PolarHBondContact O-N 3.35Å; T102-C105 WeakPolarHBondContact O-CB 3.39Å; T102-C105 PolarHBondContact O-N 3.28Å; A103-C105 VanDerWaalsContact C-N 3.31Å; A103-C105 PolarHBondContact O-N 3.03Å; C105-F108 WeakPolarHBondContact O-CB 3.28Å; C105-F108 PolarHBondContact O-N 3.13Å; C105-F109 PolarHBondContact O-N 3.27Å; C105-F109 VanDerWaalsContact O-N 3.15Å; C105-E172 PolarHBondContact SG-O 3.32Å; C105-E172 VanDerWaalsContact SG-O 3.41Å; C105-I173 HydrophobicContact CB-CG2 3.82Å; C105-C183 WeakPolarHBondContact CA-SG 3.43Å; C105-C183 HydrophobicContact CB-CB 3.82Å; C105-C183 WeakPolarHBondContact CB-SG 3.47Å; C105-C183 WeakPolarHBondContact SG-CA 3.41Å; C105-C183 WeakPolarHBondContact SG-CB 3.41Å; C105-C183 CovalentContact SG-SG 2.03Å; C105-C183 PolarHBondContact SG-SG 3.25Å |
| 106 | K | 98.1 | Very high | 96.9 | Very high | 84 Ų | 84 | 44.1 Ų | 44.1 | 37% | 0.365 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -63.3 | -47.3 | 175 | -72.9 | -170.6 | 171.5 | -165.3 | 0 | 111.5 | T102 A103 F108 F109 I110 S171 | T102-K106 HydrophobicContact CG2-CD 4.47Å; T102-K106 HydrophobicContact CG2-CG 4.48Å; T102-K106 PolarHBondContact O-N 3.26Å; A103-K106 PolarHBondContact O-N 3.01Å; K106-F108 VanDerWaalsContact C-N 3.26Å; K106-F108 PolarHBondContact O-N 3.48Å; K106-F109 PolarHBondContact O-N 3.22Å; K106-I110 HydrophobicContact CB-CD1 4.28Å; K106-I110 WeakPolarHBondContact O-CB 2.98Å; K106-I110 WeakPolarHBondContact O-CD1 3.41Å; K106-I110 WeakPolarHBondContact O-CG1 3.42Å; K106-I110 PolarHBondContact O-N 2.85Å; K106-S171 WeakPolarHBondContact CE-O 3.26Å; K106-S171 WeakPolarHBondContact CG-O 3.25Å |
| 107 | L | 97.8 | Very high | 97.2 | Very high | 86 Ų | 86 | 37.1 Ų | 37.1 | 45% | 0.45 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -59.2 | -37.9 | 178.1 | -76.1 | 172.5 | 0 | 0 | 0 | 112.6 | F85 A103 I104 S111 | F85-L107 HydrophobicContact CE1-CB 4.2Å; F85-L107 HydrophobicContact CZ-CB 4.33Å; A103-L107 WeakPolarHBondContact O-CB 3.4Å; A103-L107 WeakPolarHBondContact O-CG 3.34Å; A103-L107 PolarHBondContact O-N 3.38Å; I104-L107 HydrophobicContact CD1-CD1 4.24Å; I104-L107 PolarHBondContact O-N 3.39Å; L107-S111 WeakPolarHBondContact O-CB 3.42Å; L107-S111 PolarHBondContact O-N 3Å; L107-S111 PolarHBondContact O-OG 3.24Å |
| 108 | F | 97.6 | Very high | 97.3 | Very high | 20 Ų | 20 | 35.7 Ų | 35.7 | 9% | 0.088 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.3 | -56.9 | 174.3 | 166.8 | -112.3 | 0 | 0 | 0 | 110.9 | F85 V89 W98 I104 C105 K106 I110 S111 E112 | F85-F108 HydrophobicContact CB-CD2 3.66Å; F85-F108 HydrophobicContact CB-CE2 4.18Å; F85-F108 HydrophobicContact CD1-CB 4.06Å; F85-F108 HydrophobicContact CD1-CD2 4.23Å; F85-F108 HydrophobicContact CE1-CB 4.49Å; F85-F108 HydrophobicContact CG-CD2 4.12Å; V89-F108 HydrophobicContact CG2-CD2 4.45Å; V89-F108 HydrophobicContact CG2-CE2 3.54Å; V89-F108 HydrophobicContact CG2-CZ 3.77Å; W98-F108 HydrophobicContact CH2-CB 4.33Å; I104-F108 VanDerWaalsContact O-CB 3.28Å; I104-F108 WeakPolarHBondContact O-CB 3.28Å; I104-F108 PolarHBondContact O-N 2.86Å; C105-F108 WeakPolarHBondContact O-CB 3.28Å; C105-F108 PolarHBondContact O-N 3.13Å; K106-F108 VanDerWaalsContact C-N 3.26Å; K106-F108 PolarHBondContact O-N 3.48Å; F108-I110 PolarHBondContact O-N 2.93Å; F108-S111 PolarHBondContact O-N 2.97Å; F108-E112 WeakPolarHBondContact CE1-OE2 3.29Å; F108-E112 HydrophobicContact CE2-CB 4.41Å; F108-E112 WeakPolarHBondContact CZ-OE2 3.48Å; F108-E112 WeakPolarHBondContact O-CB 3.46Å; F108-E112 PolarHBondContact O-N 2.03Å |
| 109 | F | 98.1 | Very high | 97.2 | Very high | 27 Ų | 27 | 35.3 Ų | 35.3 | 12% | 0.118 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -67.6 | -37.3 | -178 | -84.2 | -62.1 | 0 | 0 | 0 | 113.6 | C105 K106 S113 I167 C183 I185 | C105-F109 PolarHBondContact O-N 3.27Å; C105-F109 VanDerWaalsContact O-N 3.15Å; K106-F109 PolarHBondContact O-N 3.22Å; F109-S113 VanDerWaalsContact O-CB 3.25Å; F109-S113 WeakPolarHBondContact O-CB 3.46Å; F109-S113 PolarHBondContact O-N 2.96Å; F109-S113 PolarHBondContact O-OG 3.39Å; F109-I167 HydrophobicContact CB-CG2 3.75Å; F109-I167 HydrophobicContact CD1-CG2 4.46Å; F109-I167 HydrophobicContact CG-CG2 4.41Å; F109-C183 HydrophobicContact CE2-CB 4.48Å; F109-C183 WeakPolarHBondContact CE2-SG 3.45Å; F109-I185 HydrophobicContact CD1-CD1 3.98Å; F109-I185 HydrophobicContact CD1-CG1 3.89Å; F109-I185 HydrophobicContact CE1-CD1 3.87Å; F109-I185 HydrophobicContact CE1-CG1 3.74Å; F109-I185 HydrophobicContact CE2-CG1 4.33Å; F109-I185 HydrophobicContact CG-CG1 4.29Å; F109-I185 HydrophobicContact CZ-CG1 3.97Å |
| 110 | I | 97.4 | Very high | 97.1 | Very high | 51 Ų | 51 | 30.6 Ų | 30.6 | 26% | 0.262 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -58.4 | -58 | 172.8 | -68.5 | 162.8 | 0 | 0 | 0 | 108.7 | K106 F108 E112 S113 T114 Y168 | K106-I110 HydrophobicContact CB-CD1 4.28Å; K106-I110 WeakPolarHBondContact O-CB 2.98Å; K106-I110 WeakPolarHBondContact O-CD1 3.41Å; K106-I110 WeakPolarHBondContact O-CG1 3.42Å; K106-I110 PolarHBondContact O-N 2.85Å; F108-I110 PolarHBondContact O-N 2.93Å; I110-E112 PolarHBondContact O-N 3.48Å; I110-S113 PolarHBondContact O-N 3.15Å; I110-S113 PolarHBondContact O-OG 3.13Å; I110-S113 VanDerWaalsContact O-OG 3.11Å; I110-T114 PolarHBondContact O-N 3.02Å; I110-T114 PolarHBondContact O-OG1 3.21Å; I110-Y168 HydrophobicContact CB-CD1 3.99Å; I110-Y168 HydrophobicContact CB-CE1 4.03Å; I110-Y168 HydrophobicContact CG1-CD1 3.43Å; I110-Y168 VanDerWaalsContact CG1-CD1 3.43Å; I110-Y168 HydrophobicContact CG1-CE1 3.98Å; I110-Y168 HydrophobicContact CG1-CG 3.76Å; I110-Y168 HydrophobicContact CG2-CD1 4.18Å; I110-Y168 HydrophobicContact CG2-CE1 3.86Å |
| 111 | S | 96.4 | Very high | 97.1 | Very high | 19 Ų | 19 | 30.5 Ų | 30.5 | 13% | 0.133 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -63.4 | -46.3 | -175.8 | -57.3 | 0 | 0 | 0 | 0 | 111.6 | F85 L107 F108 T115 | F85-S111 VanDerWaalsContact CE2-OG 3.25Å; F85-S111 WeakPolarHBondContact CE2-OG 3.24Å; F85-S111 WeakPolarHBondContact CZ-OG 3.42Å; L107-S111 WeakPolarHBondContact O-CB 3.42Å; L107-S111 PolarHBondContact O-N 3Å; L107-S111 PolarHBondContact O-OG 3.24Å; F108-S111 PolarHBondContact O-N 2.97Å; S111-T115 VanDerWaalsContact O-CB 3.26Å; S111-T115 WeakPolarHBondContact O-CB 3.3Å; S111-T115 VanDerWaalsContact O-CG2 3.26Å; S111-T115 WeakPolarHBondContact O-CG2 3.33Å; S111-T115 PolarHBondContact O-N 3.27Å; S111-T115 PolarHBondContact O-OG1 3.03Å |
| 112 | E | 96 | Very high | 97.1 | Very high | 29 Ų | 29 | 29 Ų | 29 | 14% | 0.136 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -55.8 | -54.3 | 176.9 | 169.6 | 168.9 | -145.6 | 0 | 0 | 110.8 | F82 F108 I110 K116 Y307 | F82-E112 HydrophobicContact CD2-CG 4.39Å; F82-E112 HydrophobicContact CE2-CB 4.44Å; F82-E112 HydrophobicContact CE2-CG 3.85Å; F108-E112 WeakPolarHBondContact CE1-OE2 3.29Å; F108-E112 HydrophobicContact CE2-CB 4.41Å; F108-E112 WeakPolarHBondContact CZ-OE2 3.48Å; F108-E112 WeakPolarHBondContact O-CB 3.46Å; F108-E112 PolarHBondContact O-N 2.03Å; I110-E112 PolarHBondContact O-N 3.48Å; E112-K116 WeakPolarHBondContact O-CB 3.14Å; E112-K116 PolarHBondContact O-N 2.92Å; E112-Y307 PolarHBondContact OE1-OH 3.03Å |
| 113 | S | 96.3 | Very high | 96.9 | Very high | 4 Ų | 4 | 26.1 Ų | 26.1 | 3% | 0.028 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -65 | -48.1 | -176.4 | 60 | 0 | 0 | 0 | 0 | 112.1 | F109 I110 Y117 | F109-S113 VanDerWaalsContact O-CB 3.25Å; F109-S113 WeakPolarHBondContact O-CB 3.46Å; F109-S113 PolarHBondContact O-N 2.96Å; F109-S113 PolarHBondContact O-OG 3.39Å; I110-S113 PolarHBondContact O-N 3.15Å; I110-S113 PolarHBondContact O-OG 3.13Å; I110-S113 VanDerWaalsContact O-OG 3.11Å; S113-Y117 WeakPolarHBondContact O-CD2 3.07Å; S113-Y117 PolarHBondContact O-N 2.93Å |
| 114 | T | 97.9 | Very high | 96.8 | Very high | 11 Ų | 11 | 23.1 Ų | 23.1 | 7% | 0.067 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -63.5 | -50.3 | -179.1 | -40.3 | 0 | 0 | 0 | 0 | 111.8 | I110 A118 W157 I160 S161 Y168 | I110-T114 PolarHBondContact O-N 3.02Å; I110-T114 PolarHBondContact O-OG1 3.21Å; T114-A118 VanDerWaalsContact O-CB 3.22Å; T114-A118 WeakPolarHBondContact O-CB 3.38Å; T114-A118 PolarHBondContact O-N 3.26Å; T114-W157 HydrophobicContact CG2-CE3 4.02Å; T114-W157 HydrophobicContact CG2-CZ3 3.99Å; T114-I160 HydrophobicContact CG2-CG2 4.2Å; T114-I160 WeakPolarHBondContact O-CG2 3.41Å; T114-S161 WeakPolarHBondContact CG2-OG 3.35Å; T114-Y168 PolarHBondContact OG1-OH 2.96Å |
| 115 | T | 97.8 | Very high | 96.6 | Very high | 7 Ų | 7 | 22.2 Ų | 22.2 | 4% | 0.043 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -79.1 | -35.3 | -167.2 | 63.1 | 0 | 0 | 0 | 0 | 112.2 | A78 V81 F82 S111 Y117 A118 S119 W157 | A78-T115 WeakPolarHBondContact O-CB 3.46Å; V81-T115 HydrophobicContact CB-CG2 3.78Å; V81-T115 HydrophobicContact CG1-CG2 3.68Å; F82-T115 WeakPolarHBondContact CA-OG1 3.03Å; F82-T115 WeakPolarHBondContact CB-OG1 3.03Å; F82-T115 PolarHBondContact N-OG1 3.35Å; S111-T115 VanDerWaalsContact O-CB 3.26Å; S111-T115 WeakPolarHBondContact O-CB 3.3Å; S111-T115 VanDerWaalsContact O-CG2 3.26Å; S111-T115 WeakPolarHBondContact O-CG2 3.33Å; S111-T115 PolarHBondContact O-N 3.27Å; S111-T115 PolarHBondContact O-OG1 3.03Å; T115-Y117 VanDerWaalsContact C-N 3.33Å; T115-Y117 PolarHBondContact O-N 2.94Å; T115-A118 PolarHBondContact O-N 2.99Å; T115-S119 PolarHBondContact O-N 3.31Å; T115-W157 HydrophobicContact CG2-CH2 4.15Å; T115-W157 HydrophobicContact CG2-CZ3 4.11Å |
| 116 | K | 96.1 | Very high | 96.3 | Very high | 13 Ų | 13 | 22.6 Ų | 22.6 | 6% | 0.057 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -59.1 | -43.9 | 173.7 | -170.5 | -170.2 | 60.8 | -176.3 | 0 | 111.1 | F82 E112 S119 W273 Y276 P306 | F82-K116 HydrophobicContact CD1-CB 4.35Å; F82-K116 HydrophobicContact CD1-CG 4.42Å; F82-K116 HydrophobicContact CD2-CB 4.26Å; F82-K116 HydrophobicContact CE1-CB 4.17Å; F82-K116 HydrophobicContact CE1-CD 4.42Å; F82-K116 HydrophobicContact CE1-CG 3.8Å; F82-K116 HydrophobicContact CE2-CB 4.08Å; F82-K116 HydrophobicContact CE2-CD 4.28Å; F82-K116 HydrophobicContact CE2-CG 4.19Å; F82-K116 HydrophobicContact CG-CB 4.42Å; F82-K116 HydrophobicContact CZ-CB 4.04Å; F82-K116 HydrophobicContact CZ-CD 3.83Å; F82-K116 HydrophobicContact CZ-CG 3.67Å; E112-K116 WeakPolarHBondContact O-CB 3.14Å; E112-K116 PolarHBondContact O-N 2.92Å; K116-S119 WeakPolarHBondContact O-CB 3.47Å; K116-W273 HydrophobicContact CD-CH2 3.81Å; K116-W273 HydrophobicContact CD-CZ2 4.41Å; K116-W273 HydrophobicContact CD-CZ3 4.38Å; K116-W273 HydrophobicContact CG-CH2 3.49Å; K116-W273 VanDerWaalsContact CG-CH2 3.49Å; K116-W273 HydrophobicContact CG-CZ2 3.75Å; K116-Y276 PolarHBondContact NZ-OH 2.71Å; K116-P306 HydrophobicContact CD-CB 3.78Å; K116-P306 HydrophobicContact CD-CG 4.28Å; K116-P306 HydrophobicContact CG-CB 4.02Å |
| 117 | Y | 96.9 | Very high | 96 | Very high | 7 Ų | 7 | 19 Ų | 19 | 3% | 0.027 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -80.1 | -30.2 | 177.3 | -62.6 | -54.8 | 0 | 0 | 0 | 113.4 | S113 T115 S119 V120 Y121 M164 C217 W273 Y276 W277 | S113-Y117 WeakPolarHBondContact O-CD2 3.07Å; S113-Y117 PolarHBondContact O-N 2.93Å; T115-Y117 VanDerWaalsContact C-N 3.33Å; T115-Y117 PolarHBondContact O-N 2.94Å; Y117-S119 VanDerWaalsContact C-N 3.28Å; Y117-S119 PolarHBondContact O-N 3.44Å; Y117-V120 WeakPolarHBondContact O-CB 3.12Å; Y117-V120 PolarHBondContact O-N 3.19Å; Y117-Y121 PolarHBondContact O-N 2.94Å; Y117-Y121 VanDerWaalsContact O-N 3.11Å; Y117-M164 HydrophobicContact CD2-CE 3.61Å; Y117-M164 HydrophobicContact CD2-CG 4.17Å; Y117-M164 HydrophobicContact CD2-SD 3.41Å; Y117-M164 WeakPolarHBondContact CD2-SD 3.35Å; Y117-M164 HydrophobicContact CE2-CE 3.81Å; Y117-M164 HydrophobicContact CE2-SD 3.41Å; Y117-M164 WeakPolarHBondContact CE2-SD 3.33Å; Y117-M164 HydrophobicContact CG-CE 4.48Å; Y117-C217 HydrophobicContact CD1-CB 3.44Å; Y117-C217 VanDerWaalsContact CD1-CB 3.44Å; Y117-C217 HydrophobicContact CE1-CB 3.87Å; Y117-C217 HydrophobicContact CG-CB 3.86Å; Y117-W273 AromaticContact CD1-CH2 3.63Å; Y117-W273 HydrophobicContact CD1-CH2 3.63Å; Y117-W273 AromaticContact CD1-CZ3 3.97Å; Y117-W273 HydrophobicContact CD1-CZ3 3.97Å; Y117-W273 AromaticContact CE1-CH2 3.64Å; Y117-W273 HydrophobicContact CE1-CH2 3.64Å; Y117-W273 AromaticContact CE1-CZ3 3.53Å; Y117-W273 HydrophobicContact CE1-CZ3 3.53Å; Y117-Y276 PolarHBondContact OH-OH 3.38Å; Y117-W277 HydrophobicContact CE1-CH2 4.36Å; Y117-W277 AromaticContact CE1-CZ2 3.65Å; Y117-W277 HydrophobicContact CE1-CZ2 3.65Å; Y117-W277 AromaticContact CZ-CZ2 4Å |
| 118 | A | 97.7 | Very high | 95.7 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -59.8 | -39.3 | 170.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | A78 T114 T115 V120 Y121 F122 W157 I160 | A78-A118 HydrophobicContact CB-CB 4.02Å; T114-A118 VanDerWaalsContact O-CB 3.22Å; T114-A118 WeakPolarHBondContact O-CB 3.38Å; T114-A118 PolarHBondContact O-N 3.26Å; T115-A118 PolarHBondContact O-N 2.99Å; A118-V120 VanDerWaalsContact C-N 3.34Å; A118-V120 PolarHBondContact O-N 3.37Å; A118-Y121 WeakPolarHBondContact O-CB 3.32Å; A118-Y121 PolarHBondContact O-N 2.89Å; A118-F122 HydrophobicContact CB-CD2 4.39Å; A118-F122 HydrophobicContact CB-CE2 4.11Å; A118-F122 WeakPolarHBondContact O-CD2 3.34Å; A118-F122 PolarHBondContact O-N 3.39Å; A118-W157 HydrophobicContact CB-CE3 4.07Å; A118-W157 HydrophobicContact CB-CH2 3.82Å; A118-W157 HydrophobicContact CB-CZ2 4.26Å; A118-W157 HydrophobicContact CB-CZ3 3.71Å; A118-I160 VanDerWaalsContact CA-CD1 3.48Å; A118-I160 HydrophobicContact CB-CD1 4.1Å |
| 119 | S | 96.1 | Very high | 95.3 | Very high | 4 Ų | 4 | 17 Ų | 17 | 3% | 0.028 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -54.1 | -49.1 | 173.4 | -175.3 | 0 | 0 | 0 | 0 | 111.7 | L75 D79 T115 K116 Y117 Y121 F122 I123 | L75-S119 WeakPolarHBondContact CD1-O 3.34Å; L75-S119 VanDerWaalsContact CD1-OG 3.26Å; L75-S119 WeakPolarHBondContact CD1-OG 3.42Å; D79-S119 WeakPolarHBondContact OD1-CB 3.27Å; D79-S119 PolarHBondContact OD1-OG 3.46Å; T115-S119 PolarHBondContact O-N 3.31Å; K116-S119 WeakPolarHBondContact O-CB 3.47Å; Y117-S119 VanDerWaalsContact C-N 3.28Å; Y117-S119 PolarHBondContact O-N 3.44Å; S119-Y121 VanDerWaalsContact C-N 3.33Å; S119-Y121 PolarHBondContact O-N 2.9Å; S119-F122 PolarHBondContact O-N 3.32Å; S119-I123 VanDerWaalsContact O-CG1 3.31Å; S119-I123 WeakPolarHBondContact O-CG1 3.5Å; S119-I123 PolarHBondContact O-N 2.84Å |
| 120 | V | 95.4 | Very high | 94.8 | Very high | 1 Ų | 1 | 17.8 Ų | 17.8 | 1% | 0.006 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -59.6 | -43.2 | 177.8 | -179 | 0 | 0 | 0 | 0 | 112.2 | Y117 A118 I123 S124 C217 P221 M225 Y269 W273 | Y117-V120 WeakPolarHBondContact O-CB 3.12Å; Y117-V120 PolarHBondContact O-N 3.19Å; A118-V120 VanDerWaalsContact C-N 3.34Å; A118-V120 PolarHBondContact O-N 3.37Å; V120-I123 PolarHBondContact O-N 2.88Å; V120-S124 PolarHBondContact O-N 3.48Å; V120-S124 PolarHBondContact O-OG 2.64Å; V120-C217 WeakPolarHBondContact CG1-O 3.2Å; V120-P221 HydrophobicContact CG1-CB 3.54Å; V120-P221 HydrophobicContact CG1-CG 3.96Å; V120-M225 HydrophobicContact CG1-CE 4.42Å; V120-Y269 HydrophobicContact CB-CE2 4.16Å; V120-Y269 HydrophobicContact CG1-CD2 4.49Å; V120-Y269 HydrophobicContact CG1-CE2 3.49Å; V120-Y269 VanDerWaalsContact CG1-CE2 3.49Å; V120-Y269 WeakPolarHBondContact CG1-OH 3.31Å; V120-Y269 HydrophobicContact CG2-CD2 4.45Å; V120-Y269 HydrophobicContact CG2-CE2 3.73Å; V120-W273 HydrophobicContact CG2-CD2 4.27Å; V120-W273 VanDerWaalsContact CG2-CE2 3.48Å; V120-W273 HydrophobicContact CG2-CH2 3.78Å; V120-W273 HydrophobicContact CG2-CZ2 3.19Å |
| 121 | Y | 96.3 | Very high | 94.3 | Very high | 64 Ų | 64 | 16.1 Ų | 16.1 | 25% | 0.251 | 8% | 0.081 | S | C | . | . | H | α-helix | trans | -61 | -47 | 177.2 | 175.3 | -100.4 | 0 | 0 | 0 | 111.8 | Y117 A118 S119 I123 S124 L125 A152 G156 I160 | Y117-Y121 PolarHBondContact O-N 2.94Å; Y117-Y121 VanDerWaalsContact O-N 3.11Å; A118-Y121 WeakPolarHBondContact O-CB 3.32Å; A118-Y121 PolarHBondContact O-N 2.89Å; S119-Y121 VanDerWaalsContact C-N 3.33Å; S119-Y121 PolarHBondContact O-N 2.9Å; Y121-I123 PolarHBondContact O-N 3.38Å; Y121-S124 WeakPolarHBondContact O-CB 3.13Å; Y121-S124 PolarHBondContact O-N 3.01Å; Y121-L125 HydrophobicContact CD1-CD1 4.06Å; Y121-L125 HydrophobicContact CD1-CG 4.49Å; Y121-L125 HydrophobicContact CE1-CD1 3.34Å; Y121-L125 HydrophobicContact CE1-CG 4.03Å; Y121-L125 HydrophobicContact CE2-CG 4.48Å; Y121-L125 PolarHBondContact O-N 3.24Å; Y121-A152 PolarHBondContact OH-O 2.98Å; Y121-G156 VanDerWaalsContact CE1-CA 3.49Å; Y121-I160 HydrophobicContact CG-CD1 4.07Å |
| 122 | F | 95.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -69.2 | -33.8 | 179.4 | -69.5 | -60 | 0 | 0 | 0 | 113.1 | L71 N74 L75 A118 S119 S124 L125 L126 A153 W157 | L71-F122 HydrophobicContact CD2-CD1 4.25Å; N74-F122 HydrophobicContact CB-CD1 3.72Å; N74-F122 HydrophobicContact CB-CD2 3.86Å; N74-F122 HydrophobicContact CB-CE1 3.44Å; N74-F122 VanDerWaalsContact CB-CE1 3.44Å; N74-F122 HydrophobicContact CB-CE2 3.61Å; N74-F122 HydrophobicContact CB-CG 3.96Å; N74-F122 HydrophobicContact CB-CZ 3.42Å; N74-F122 VanDerWaalsContact CB-CZ 3.42Å; L75-F122 HydrophobicContact CB-CB 3.85Å; L75-F122 HydrophobicContact CD1-CB 4.2Å; A118-F122 HydrophobicContact CB-CD2 4.39Å; A118-F122 HydrophobicContact CB-CE2 4.11Å; A118-F122 WeakPolarHBondContact O-CD2 3.34Å; A118-F122 PolarHBondContact O-N 3.39Å; S119-F122 PolarHBondContact O-N 3.32Å; F122-S124 VanDerWaalsContact C-N 3.29Å; F122-S124 PolarHBondContact O-N 3.42Å; F122-L125 HydrophobicContact CD1-CD1 4.18Å; F122-L125 HydrophobicContact CE1-CD1 4.4Å; F122-L125 PolarHBondContact O-N 3.19Å; F122-L126 WeakPolarHBondContact O-CB 3.04Å; F122-L126 WeakPolarHBondContact O-CD1 3.47Å; F122-L126 WeakPolarHBondContact O-CG 3.42Å; F122-L126 PolarHBondContact O-N 3.28Å; F122-A153 HydrophobicContact CE1-CB 3.76Å; F122-A153 HydrophobicContact CZ-CB 4.1Å; F122-W157 AromaticContact CE2-CE2 3.77Å; F122-W157 AromaticContact CE2-CZ2 3.97Å; F122-W157 HydrophobicContact CE2-CZ2 3.97Å; F122-W157 AromaticContact CE2-NE1 3.64Å; F122-W157 AromaticContact CZ-CD1 3.86Å; F122-W157 AromaticContact CZ-NE1 3.49Å |
| 123 | I | 94 | Very high | 93.2 | Very high | 1 Ų | 1 | 18.9 Ų | 18.9 | 1% | 0.005 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -61.9 | -39.8 | 171.2 | -67 | 168.6 | 0 | 0 | 0 | 110.7 | L75 S119 V120 Y121 L126 S127 M225 I265 | L75-I123 HydrophobicContact CD1-CD1 4.34Å; L75-I123 HydrophobicContact CD1-CG1 3.84Å; L75-I123 HydrophobicContact CD2-CG1 3.99Å; S119-I123 VanDerWaalsContact O-CG1 3.31Å; S119-I123 WeakPolarHBondContact O-CG1 3.5Å; S119-I123 PolarHBondContact O-N 2.84Å; V120-I123 PolarHBondContact O-N 2.88Å; Y121-I123 PolarHBondContact O-N 3.38Å; I123-L126 PolarHBondContact O-N 2.77Å; I123-S127 PolarHBondContact O-N 2.84Å; I123-S127 PolarHBondContact O-OG 3.5Å; I123-M225 HydrophobicContact CB-SD 4.46Å; I123-M225 HydrophobicContact CG2-SD 3.57Å; I123-M225 VanDerWaalsContact CG2-SD 3.57Å; I123-I265 HydrophobicContact CG2-CG2 3.64Å |
| 124 | S | 94.3 | Very high | 92.4 | Very high | 7 Ų | 7 | 19 Ų | 19 | 5% | 0.049 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -65 | -45.9 | 176.8 | -57.6 | 0 | 0 | 0 | 0 | 111.5 | V120 Y121 F122 L126 S127 I128 P221 | V120-S124 PolarHBondContact O-N 3.48Å; V120-S124 PolarHBondContact O-OG 2.64Å; Y121-S124 WeakPolarHBondContact O-CB 3.13Å; Y121-S124 PolarHBondContact O-N 3.01Å; F122-S124 VanDerWaalsContact C-N 3.29Å; F122-S124 PolarHBondContact O-N 3.42Å; S124-L126 VanDerWaalsContact C-N 3.33Å; S124-L126 PolarHBondContact O-N 3.08Å; S124-S127 WeakPolarHBondContact O-CB 3.23Å; S124-S127 PolarHBondContact O-N 3.46Å; S124-S127 VanDerWaalsContact O-N 3.17Å; S124-I128 WeakPolarHBondContact O-CG1 3.24Å; S124-I128 PolarHBondContact O-N 3.49Å; S124-P221 WeakPolarHBondContact OG-CB 3.37Å |
| 125 | L | 94.9 | Very high | 91.6 | Very high | 32 Ų | 32 | 24.9 Ų | 24.9 | 17% | 0.168 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -61.8 | -39.4 | 174.2 | -71.1 | -175 | 0 | 0 | 0 | 112.6 | L71 Y121 F122 S127 I128 D129 A152 | L71-L125 HydrophobicContact CD1-CB 3.93Å; L71-L125 HydrophobicContact CD2-CB 3.91Å; L71-L125 HydrophobicContact CD2-CD1 3.67Å; L71-L125 HydrophobicContact CD2-CG 4.47Å; Y121-L125 HydrophobicContact CD1-CD1 4.06Å; Y121-L125 HydrophobicContact CD1-CG 4.49Å; Y121-L125 HydrophobicContact CE1-CD1 3.34Å; Y121-L125 HydrophobicContact CE1-CG 4.03Å; Y121-L125 HydrophobicContact CE2-CG 4.48Å; Y121-L125 PolarHBondContact O-N 3.24Å; F122-L125 HydrophobicContact CD1-CD1 4.18Å; F122-L125 HydrophobicContact CE1-CD1 4.4Å; F122-L125 PolarHBondContact O-N 3.19Å; L125-S127 VanDerWaalsContact C-N 3.31Å; L125-S127 PolarHBondContact O-N 3.47Å; L125-I128 HydrophobicContact CD2-CD1 4.4Å; L125-I128 PolarHBondContact O-N 3.06Å; L125-D129 WeakPolarHBondContact O-CB 3.37Å; L125-D129 PolarHBondContact O-N 3.44Å; L125-A152 HydrophobicContact CD1-CB 4.18Å |
| 126 | L | 91.8 | Very high | 90.6 | Very high | 7 Ų | 7 | 30 Ų | 30 | 4% | 0.037 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -63.1 | -39.9 | 175 | -75.8 | 162.9 | 0 | 0 | 0 | 111.1 | L71 I72 L75 F122 I123 S124 D129 R130 Y317 | L71-L126 HydrophobicContact CB-CD1 4.5Å; L71-L126 HydrophobicContact CB-CD2 3.54Å; L71-L126 HydrophobicContact CB-CG 3.82Å; L71-L126 HydrophobicContact CD1-CD2 4.11Å; L71-L126 HydrophobicContact CD1-CG 4.31Å; I72-L126 HydrophobicContact CG1-CD1 4.33Å; I72-L126 HydrophobicContact CG1-CD2 3.89Å; L75-L126 HydrophobicContact CB-CD1 4.37Å; L75-L126 HydrophobicContact CD2-CD1 3.56Å; F122-L126 WeakPolarHBondContact O-CB 3.04Å; F122-L126 WeakPolarHBondContact O-CD1 3.47Å; F122-L126 WeakPolarHBondContact O-CG 3.42Å; F122-L126 PolarHBondContact O-N 3.28Å; I123-L126 PolarHBondContact O-N 2.77Å; S124-L126 VanDerWaalsContact C-N 3.33Å; S124-L126 PolarHBondContact O-N 3.08Å; L126-D129 PolarHBondContact O-N 3.01Å; L126-R130 WeakPolarHBondContact O-CG 3.34Å; L126-R130 PolarHBondContact O-N 3.31Å; L126-Y317 VanDerWaalsContact CD1-OH 3.24Å; L126-Y317 WeakPolarHBondContact CD1-OH 3.42Å |
| 127 | S | 90.5 | Very high | 89 | Confident | 8 Ų | 8 | 35 Ų | 35 | 6% | 0.056 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.6 | -43.3 | 175.9 | -60.7 | 0 | 0 | 0 | 0 | 111.5 | I123 S124 L125 R130 C131 | I123-S127 PolarHBondContact O-N 2.84Å; I123-S127 PolarHBondContact O-OG 3.5Å; S124-S127 WeakPolarHBondContact O-CB 3.23Å; S124-S127 PolarHBondContact O-N 3.46Å; S124-S127 VanDerWaalsContact O-N 3.17Å; L125-S127 VanDerWaalsContact C-N 3.31Å; L125-S127 PolarHBondContact O-N 3.47Å; S127-R130 PolarHBondContact O-N 3.37Å; S127-C131 PolarHBondContact O-N 2.82Å; S127-C131 VanDerWaalsContact O-N 3.1Å; S127-C131 PolarHBondContact O-SG 3.48Å |
| 128 | I | 91.7 | Very high | 87.2 | Confident | 58 Ų | 58 | 42 Ų | 42 | 30% | 0.297 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -61.9 | -48.9 | 174.1 | -66 | 165.2 | 0 | 0 | 0 | 110.8 | S124 L125 R130 C131 L132 I224 C228 | S124-I128 WeakPolarHBondContact O-CG1 3.24Å; S124-I128 PolarHBondContact O-N 3.49Å; L125-I128 HydrophobicContact CD2-CD1 4.4Å; L125-I128 PolarHBondContact O-N 3.06Å; I128-R130 PolarHBondContact O-N 2.67Å; I128-C131 WeakPolarHBondContact O-CB 3.39Å; I128-C131 PolarHBondContact O-N 3.09Å; I128-L132 HydrophobicContact CG2-CD1 3.83Å; I128-L132 HydrophobicContact CG2-CG 4.21Å; I128-L132 WeakPolarHBondContact O-CG 3.48Å; I128-L132 PolarHBondContact O-N 2.94Å; I128-I224 HydrophobicContact CD1-CG2 3.81Å; I128-I224 HydrophobicContact CG1-CG2 3.97Å; I128-C228 VanDerWaalsContact CG1-SG 3.53Å |
| 129 | D | 89.7 | Confident | 85.3 | Confident | 6 Ų | 6 | 44.3 Ų | 44.3 | 3% | 0.032 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -54.1 | -41.3 | 177.7 | 175.8 | 64.3 | 0 | 0 | 0 | 111.5 | V67 T68 L71 L125 L126 S133 | V67-D129 WeakPolarHBondContact CG1-OD1 3.14Å; T68-D129 PolarHBondContact OG1-OD2 3.18Å; L71-D129 HydrophobicContact CD1-CB 4.09Å; L125-D129 WeakPolarHBondContact O-CB 3.37Å; L125-D129 PolarHBondContact O-N 3.44Å; L126-D129 PolarHBondContact O-N 3.01Å; D129-S133 VanDerWaalsContact O-CB 3.23Å; D129-S133 WeakPolarHBondContact O-CB 3.4Å; D129-S133 PolarHBondContact O-N 3.06Å; D129-S133 PolarHBondContact O-OG 3.11Å |
| 130 | R | 87.3 | Confident | 83.5 | Confident | 45 Ų | 45 | 54.1 Ų | 54.1 | 17% | 0.17 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.9 | -42.7 | 175.1 | -65 | -44.3 | 173.3 | -149.7 | -15.7 | 113.3 | T68 L126 S127 I128 L132 S133 V134 L232 L258 V262 | T68-R130 PolarHBondContact OG1-NH1 3.19Å; T68-R130 PolarHBondContact OG1-NH2 3.34Å; L126-R130 WeakPolarHBondContact O-CG 3.34Å; L126-R130 PolarHBondContact O-N 3.31Å; S127-R130 PolarHBondContact O-N 3.37Å; I128-R130 PolarHBondContact O-N 2.67Å; R130-L132 VanDerWaalsContact C-N 3.35Å; R130-S133 PolarHBondContact O-N 3.32Å; R130-V134 VanDerWaalsContact O-CG2 3.26Å; R130-V134 WeakPolarHBondContact O-CG2 2.95Å; R130-V134 PolarHBondContact O-N 3.38Å; R130-L232 HydrophobicContact CB-CD1 4.01Å; R130-L258 HydrophobicContact CG-CD1 4.03Å; R130-V262 HydrophobicContact CB-CG2 4.38Å; R130-V262 HydrophobicContact CG-CG2 4.12Å |
| 131 | C | 87 | Confident | 82.1 | Confident | 15 Ų | 15 | 57 Ų | 57 | 10% | 0.101 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.2 | -45.6 | 178.2 | -64.1 | 0 | 0 | 0 | 0 | 111.5 | S127 I128 V134 R135 C228 | S127-C131 PolarHBondContact O-N 2.82Å; S127-C131 VanDerWaalsContact O-N 3.1Å; S127-C131 PolarHBondContact O-SG 3.48Å; I128-C131 WeakPolarHBondContact O-CB 3.39Å; I128-C131 PolarHBondContact O-N 3.09Å; C131-V134 PolarHBondContact O-N 2.83Å; C131-R135 VanDerWaalsContact O-CB 3.26Å; C131-R135 WeakPolarHBondContact O-CB 3.46Å; C131-R135 PolarHBondContact O-N 3.43Å; C131-C228 WeakPolarHBondContact SG-CA 3.13Å; C131-C228 WeakPolarHBondContact SG-CB 3.02Å; C131-C228 PolarHBondContact SG-O 3.38Å |
| 132 | L | 87.7 | Confident | 81.3 | Confident | 68 Ų | 68 | 56.4 Ų | 56.4 | 36% | 0.356 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -65.4 | -43.5 | 178.2 | -64.5 | 177.3 | 0 | 0 | 0 | 111.7 | I128 R130 V134 R135 F136 Y139 | I128-L132 HydrophobicContact CG2-CD1 3.83Å; I128-L132 HydrophobicContact CG2-CG 4.21Å; I128-L132 WeakPolarHBondContact O-CG 3.48Å; I128-L132 PolarHBondContact O-N 2.94Å; R130-L132 VanDerWaalsContact C-N 3.35Å; L132-V134 VanDerWaalsContact C-N 3.33Å; L132-V134 PolarHBondContact O-N 2.97Å; L132-R135 PolarHBondContact O-N 2.93Å; L132-F136 HydrophobicContact CD2-CD2 4.31Å; L132-F136 HydrophobicContact CD2-CE2 3.92Å; L132-F136 WeakPolarHBondContact O-CD2 3.42Å; L132-F136 PolarHBondContact O-N 3.15Å; L132-Y139 HydrophobicContact CB-CE2 4.1Å |
| 133 | S | 82.9 | Confident | 80.8 | Confident | 38 Ų | 38 | 65.7 Ų | 65.7 | 27% | 0.266 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -63.2 | -36.3 | 178.9 | -65 | 0 | 0 | 0 | 0 | 113 | D129 R130 | D129-S133 VanDerWaalsContact O-CB 3.23Å; D129-S133 WeakPolarHBondContact O-CB 3.4Å; D129-S133 PolarHBondContact O-N 3.06Å; D129-S133 PolarHBondContact O-OG 3.11Å; R130-S133 PolarHBondContact O-N 3.32Å |
| 134 | V | 79.2 | Confident | 80.5 | Confident | 7 Ų | 7 | 70 Ų | 70 | 4% | 0.042 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -77.9 | -36.3 | 178 | 174.8 | 0 | 0 | 0 | 0 | 111.3 | R130 C131 L132 Q235 V236 Y255 L258 | R130-V134 VanDerWaalsContact O-CG2 3.26Å; R130-V134 WeakPolarHBondContact O-CG2 2.95Å; R130-V134 PolarHBondContact O-N 3.38Å; C131-V134 PolarHBondContact O-N 2.83Å; L132-V134 VanDerWaalsContact C-N 3.33Å; L132-V134 PolarHBondContact O-N 2.97Å; V134-Q235 HydrophobicContact CG1-CB 4.34Å; V134-Q235 HydrophobicContact CG1-CG 3.72Å; V134-V236 HydrophobicContact CG1-CG2 4.27Å; V134-Y255 HydrophobicContact CB-CE1 4.29Å; V134-Y255 HydrophobicContact CG1-CD1 4.11Å; V134-Y255 HydrophobicContact CG1-CE1 3.79Å; V134-Y255 HydrophobicContact CG2-CD1 4.16Å; V134-Y255 HydrophobicContact CG2-CE1 3.98Å; V134-L258 HydrophobicContact CG2-CD2 3.52Å |
| 135 | R | 80.1 | Confident | 80.3 | Confident | 135 Ų | 135 | 72.3 Ų | 72.3 | 51% | 0.509 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -73.4 | -42.4 | -178.8 | -177.1 | 60.4 | -176.8 | 150.6 | 9.7 | 112.4 | C131 L132 | C131-R135 VanDerWaalsContact O-CB 3.26Å; C131-R135 WeakPolarHBondContact O-CB 3.46Å; C131-R135 PolarHBondContact O-N 3.43Å; L132-R135 PolarHBondContact O-N 2.93Å |
| 136 | F | 77.7 | Confident | 80.1 | Confident | 114 Ų | 114 | 75 Ų | 75 | 50% | 0.5 | 35% | 0.352 | S | S | . | . | trans | -105 | 92.5 | -179.1 | -59.2 | -71.2 | 0 | 0 | 0 | 109.6 | L132 N138 Y139 | L132-F136 HydrophobicContact CD2-CD2 4.31Å; L132-F136 HydrophobicContact CD2-CE2 3.92Å; L132-F136 WeakPolarHBondContact O-CD2 3.42Å; L132-F136 PolarHBondContact O-N 3.15Å; F136-N138 PolarHBondContact O-N 3.28Å; F136-Y139 HydrophobicContact CB-CD2 4.31Å; F136-Y139 WeakPolarHBondContact O-CB 3.49Å; F136-Y139 PolarHBondContact O-N 3Å | ||
| 137 | Q | 62.5 | Low | 80.1 | Confident | 118 Ų | 118 | 80.2 Ų | 80.2 | 55% | 0.551 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65 | -26.2 | -176.7 | -159 | 163.2 | -28.9 | 0 | 0 | 113.2 | Y139 | Q137-Y139 VanDerWaalsContact C-N 3.27Å; Q137-Y139 PolarHBondContact O-N 3.39Å |
| 138 | N | 59 | Low | 80.3 | Confident | 153 Ų | 153 | 85.3 Ų | 85.3 | 82% | 0.818 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.8 | 32.4 | 170.8 | -66.5 | -16.7 | 0 | 0 | 0 | 112.2 | F136 R140 | F136-N138 PolarHBondContact O-N 3.28Å; N138-R140 PolarHBondContact O-N 3.23Å |
| 139 | Y | 57.5 | Low | 80.4 | Confident | 49 Ų | 49 | 82.9 Ų | 82.9 | 19% | 0.192 | 39% | 0.392 | C | S | . | . | trans | -67.4 | 67.3 | 170.5 | -163.7 | -92 | 0 | 0 | 0 | 109.6 | L132 F136 Q137 V141 K145 | L132-Y139 HydrophobicContact CB-CE2 4.1Å; F136-Y139 HydrophobicContact CB-CD2 4.31Å; F136-Y139 WeakPolarHBondContact O-CB 3.49Å; F136-Y139 PolarHBondContact O-N 3Å; Q137-Y139 VanDerWaalsContact C-N 3.27Å; Q137-Y139 PolarHBondContact O-N 3.39Å; Y139-V141 PolarHBondContact O-N 3.04Å; Y139-V141 VanDerWaalsContact O-N 3.17Å; Y139-K145 HydrophobicContact CD1-CD 4.43Å; Y139-K145 HydrophobicContact CE1-CD 3.84Å; Y139-K145 HydrophobicContact CE2-CD 3.99Å; Y139-K145 VanDerWaalsContact CE2-NZ 3.35Å | ||
| 140 | R | 59 | Low | 80.7 | Confident | 210 Ų | 210 | 85.8 Ų | 85.8 | 79% | 0.792 | 41% | 0.41 | S | S | * | . | trans | -58 | 124.3 | 164.9 | -78.8 | -173.9 | -176.6 | -179.2 | 2.1 | 106.4 | N138 S142 K145 | N138-R140 PolarHBondContact O-N 3.23Å; R140-S142 PolarHBondContact O-N 3.19Å; R140-K145 PolarHBondContact O-NZ 2.56Å | ||
| 141 | V | 66.1 | Low | 81.2 | Confident | 63 Ų | 63 | 87 Ų | 87 | 38% | 0.382 | 42% | 0.422 | S | S | . | . | trans | -67.6 | 99.2 | 172.5 | 175.9 | 0 | 0 | 0 | 0 | 106.4 | Y139 R146 | Y139-V141 PolarHBondContact O-N 3.04Å; Y139-V141 VanDerWaalsContact O-N 3.17Å; V141-R146 HydrophobicContact CG1-CG 3.64Å | ||
| 142 | S | 79.4 | Confident | 81.7 | Confident | 50 Ų | 50 | 87.3 Ų | 87.3 | 35% | 0.35 | 43% | 0.425 | S | S | . | . | trans | -81 | 159.8 | 172.4 | 67.3 | 0 | 0 | 0 | 0 | 110 | R140 C144 K145 R146 | R140-S142 PolarHBondContact O-N 3.19Å; S142-C144 PolarHBondContact O-N 3.28Å; S142-K145 PolarHBondContact O-N 3.17Å; S142-K145 WeakPolarHBondContact OG-CG 3.33Å; S142-K145 PolarHBondContact OG-N 3.43Å; S142-R146 PolarHBondContact O-N 2.96Å | ||
| 143 | R | 85 | Confident | 82.2 | Confident | 196 Ų | 196 | 84.2 Ų | 84.2 | 74% | 0.74 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -54.8 | -39.5 | 170.5 | -177 | 177.2 | 177.2 | 118.4 | 0.9 | 111.5 | K145 R146 M147 | R143-K145 PolarHBondContact O-N 3.46Å; R143-R146 PolarHBondContact O-N 3.37Å; R143-M147 PolarHBondContact O-N 3.31Å |
| 144 | C | 88.4 | Confident | 82.9 | Confident | 91 Ų | 91 | 87.6 Ų | 87.6 | 62% | 0.615 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -57.6 | -47.8 | 177.3 | 178.2 | 0 | 0 | 0 | 0 | 112.4 | S142 R146 M147 L148 | S142-C144 PolarHBondContact O-N 3.28Å; C144-R146 VanDerWaalsContact C-N 3.33Å; C144-R146 PolarHBondContact O-N 2.91Å; C144-M147 WeakPolarHBondContact O-CB 3.39Å; C144-M147 PolarHBondContact O-N 2.75Å; C144-L148 PolarHBondContact O-N 2.92Å |
| 145 | K | 88.5 | Confident | 83.8 | Confident | 56 Ų | 56 | 90.7 Ų | 90.7 | 24% | 0.243 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -63.1 | -37 | 179 | -70.3 | 170.2 | 176.8 | 179.9 | 0 | 113.3 | V67 Y139 R140 S142 R143 L148 A149 | V67-K145 HydrophobicContact CG2-CB 4.04Å; Y139-K145 HydrophobicContact CD1-CD 4.43Å; Y139-K145 HydrophobicContact CE1-CD 3.84Å; Y139-K145 HydrophobicContact CE2-CD 3.99Å; Y139-K145 VanDerWaalsContact CE2-NZ 3.35Å; R140-K145 PolarHBondContact O-NZ 2.56Å; S142-K145 PolarHBondContact O-N 3.17Å; S142-K145 WeakPolarHBondContact OG-CG 3.33Å; S142-K145 PolarHBondContact OG-N 3.43Å; R143-K145 PolarHBondContact O-N 3.46Å; K145-L148 PolarHBondContact O-N 2.79Å; K145-A149 PolarHBondContact O-N 2.99Å |
| 146 | R | 90.5 | Very high | 84.7 | Confident | 88 Ų | 88 | 84.4 Ų | 84.4 | 33% | 0.332 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.1 | -43 | 174.9 | -67.9 | -174.6 | -62.6 | 168.6 | -0.7 | 111.5 | T65 I70 V141 S142 R143 C144 L148 A149 V150 | T65-R146 WeakPolarHBondContact O-CD 3.29Å; I70-R146 HydrophobicContact CD1-CB 4.06Å; I70-R146 HydrophobicContact CD1-CG 4.28Å; V141-R146 HydrophobicContact CG1-CG 3.64Å; S142-R146 PolarHBondContact O-N 2.96Å; R143-R146 PolarHBondContact O-N 3.37Å; C144-R146 VanDerWaalsContact C-N 3.33Å; C144-R146 PolarHBondContact O-N 2.91Å; R146-L148 VanDerWaalsContact C-N 3.32Å; R146-L148 PolarHBondContact O-N 3.5Å; R146-A149 WeakPolarHBondContact O-CB 3.5Å; R146-A149 PolarHBondContact O-N 2.84Å; R146-V150 WeakPolarHBondContact O-CG2 3.35Å; R146-V150 PolarHBondContact O-N 3.26Å |
| 147 | M | 93.2 | Very high | 85.6 | Confident | 116 Ų | 116 | 81.4 Ų | 81.4 | 57% | 0.571 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -60 | -44.7 | 174.4 | -173.2 | -159.3 | -71.3 | 0 | 0 | 110.6 | R143 C144 A149 V150 V151 | R143-M147 PolarHBondContact O-N 3.31Å; C144-M147 WeakPolarHBondContact O-CB 3.39Å; C144-M147 PolarHBondContact O-N 2.75Å; M147-A149 VanDerWaalsContact C-N 3.29Å; M147-A149 PolarHBondContact O-N 3.08Å; M147-V150 PolarHBondContact O-N 3.22Å; M147-V150 VanDerWaalsContact O-N 3.12Å; M147-V151 HydrophobicContact CG-CG2 4.38Å; M147-V151 WeakPolarHBondContact O-CG2 3.46Å; M147-V151 PolarHBondContact O-N 3.43Å |
| 148 | L | 94.3 | Very high | 87.3 | Confident | 116 Ų | 116 | 79.8 Ų | 79.8 | 61% | 0.607 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -58.5 | -40.7 | 175.9 | -179 | 62.2 | 0 | 0 | 0 | 112.1 | C144 K145 R146 V151 A152 | C144-L148 PolarHBondContact O-N 2.92Å; K145-L148 PolarHBondContact O-N 2.79Å; R146-L148 VanDerWaalsContact C-N 3.32Å; R146-L148 PolarHBondContact O-N 3.5Å; L148-V151 PolarHBondContact O-N 3.45Å; L148-A152 VanDerWaalsContact O-CB 3.24Å; L148-A152 WeakPolarHBondContact O-CB 3.12Å; L148-A152 PolarHBondContact O-N 3.06Å |
| 149 | A | 94.2 | Very high | 89.2 | Confident | 7 Ų | 7 | 76 Ų | 76 | 6% | 0.058 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -65.2 | -38.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | V67 I70 K145 R146 M147 A153 | V67-A149 HydrophobicContact CB-CB 4.45Å; V67-A149 HydrophobicContact CG1-CB 3.87Å; V67-A149 HydrophobicContact CG2-CB 4.38Å; I70-A149 HydrophobicContact CD1-CB 4.36Å; I70-A149 HydrophobicContact CG2-CB 4.25Å; K145-A149 PolarHBondContact O-N 2.99Å; R146-A149 WeakPolarHBondContact O-CB 3.5Å; R146-A149 PolarHBondContact O-N 2.84Å; M147-A149 VanDerWaalsContact C-N 3.29Å; M147-A149 PolarHBondContact O-N 3.08Å; A149-A153 WeakPolarHBondContact O-CB 3.42Å; A149-A153 PolarHBondContact O-N 2.95Å |
| 150 | V | 96.1 | Very high | 91.1 | Very high | 67 Ų | 67 | 74.2 Ų | 74.2 | 41% | 0.406 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -66.6 | -46.1 | 174.8 | 173.1 | 0 | 0 | 0 | 0 | 110.6 | I70 R146 M147 A153 L154 | I70-V150 HydrophobicContact CD1-CG2 4.21Å; I70-V150 HydrophobicContact CG2-CG2 4.13Å; R146-V150 WeakPolarHBondContact O-CG2 3.35Å; R146-V150 PolarHBondContact O-N 3.26Å; M147-V150 PolarHBondContact O-N 3.22Å; M147-V150 VanDerWaalsContact O-N 3.12Å; V150-A153 WeakPolarHBondContact O-CB 3.25Å; V150-A153 PolarHBondContact O-N 3.11Å; V150-L154 HydrophobicContact CG1-CD1 4.21Å; V150-L154 WeakPolarHBondContact O-CG 3.47Å; V150-L154 PolarHBondContact O-N 3.08Å |
| 151 | V | 97.5 | Very high | 93 | Very high | 69 Ų | 69 | 66.1 Ų | 66.1 | 42% | 0.418 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.5 | -46.1 | 176.9 | 172.3 | 0 | 0 | 0 | 0 | 110.5 | M147 L148 A153 L154 V155 | M147-V151 HydrophobicContact CG-CG2 4.38Å; M147-V151 WeakPolarHBondContact O-CG2 3.46Å; M147-V151 PolarHBondContact O-N 3.43Å; L148-V151 PolarHBondContact O-N 3.45Å; V151-A153 VanDerWaalsContact C-N 3.29Å; V151-A153 PolarHBondContact O-N 2.69Å; V151-L154 PolarHBondContact O-N 3.33Å; V151-V155 HydrophobicContact CG1-CG2 4.22Å; V151-V155 WeakPolarHBondContact O-CB 3.49Å; V151-V155 VanDerWaalsContact O-CG2 3.29Å; V151-V155 WeakPolarHBondContact O-CG2 3.37Å; V151-V155 PolarHBondContact O-N 3.45Å |
| 152 | A | 97.5 | Very high | 94.5 | Very high | 22 Ų | 22 | 67 Ų | 67 | 18% | 0.182 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -59.5 | -39.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y121 L125 L148 G156 | Y121-A152 PolarHBondContact OH-O 2.98Å; L125-A152 HydrophobicContact CD1-CB 4.18Å; L148-A152 VanDerWaalsContact O-CB 3.24Å; L148-A152 WeakPolarHBondContact O-CB 3.12Å; L148-A152 PolarHBondContact O-N 3.06Å; A152-G156 PolarHBondContact O-N 3.39Å |
| 153 | A | 97.8 | Very high | 95.4 | Very high | 4 Ų | 4 | 66.6 Ų | 66.6 | 3% | 0.033 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -63.9 | -47.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | F122 A149 V150 V151 V155 G156 W157 | F122-A153 HydrophobicContact CE1-CB 3.76Å; F122-A153 HydrophobicContact CZ-CB 4.1Å; A149-A153 WeakPolarHBondContact O-CB 3.42Å; A149-A153 PolarHBondContact O-N 2.95Å; V150-A153 WeakPolarHBondContact O-CB 3.25Å; V150-A153 PolarHBondContact O-N 3.11Å; V151-A153 VanDerWaalsContact C-N 3.29Å; V151-A153 PolarHBondContact O-N 2.69Å; A153-V155 PolarHBondContact O-N 2.98Å; A153-G156 PolarHBondContact O-N 2.84Å; A153-W157 PolarHBondContact O-N 3.32Å |
| 154 | L | 98 | Very high | 96 | Very high | 109 Ų | 109 | 57.3 Ų | 57.3 | 57% | 0.571 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -60.5 | -46.4 | 177.5 | -68.7 | 172.9 | 0 | 0 | 0 | 111.5 | V150 V151 G156 W157 T158 | V150-L154 HydrophobicContact CG1-CD1 4.21Å; V150-L154 WeakPolarHBondContact O-CG 3.47Å; V150-L154 PolarHBondContact O-N 3.08Å; V151-L154 PolarHBondContact O-N 3.33Å; L154-G156 VanDerWaalsContact C-N 3.35Å; L154-G156 PolarHBondContact O-N 2.91Å; L154-W157 PolarHBondContact O-N 2.97Å; L154-T158 WeakPolarHBondContact O-CG2 3.43Å; L154-T158 PolarHBondContact O-N 3.32Å; L154-T158 PolarHBondContact O-OG1 3.37Å |
| 155 | V | 97.9 | Very high | 96.5 | Very high | 72 Ų | 72 | 55.8 Ų | 55.8 | 44% | 0.436 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 176.5 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | V151 A153 T158 V159 | V151-V155 HydrophobicContact CG1-CG2 4.22Å; V151-V155 WeakPolarHBondContact O-CB 3.49Å; V151-V155 VanDerWaalsContact O-CG2 3.29Å; V151-V155 WeakPolarHBondContact O-CG2 3.37Å; V151-V155 PolarHBondContact O-N 3.45Å; A153-V155 PolarHBondContact O-N 2.98Å; V155-T158 WeakPolarHBondContact CA-OG1 3.4Å; V155-T158 PolarHBondContact O-N 3.02Å; V155-T158 PolarHBondContact O-OG1 3.47Å; V155-V159 HydrophobicContact CG1-CG2 3.99Å; V155-V159 VanDerWaalsContact O-CB 3.27Å; V155-V159 WeakPolarHBondContact O-CB 3.44Å; V155-V159 WeakPolarHBondContact O-CG2 3.33Å; V155-V159 PolarHBondContact O-N 3.27Å |
| 156 | G | 97.7 | Very high | 96.9 | Very high | 2 Ų | 2 | 54.6 Ų | 54.6 | 2% | 0.021 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -59.8 | -48.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y121 A152 A153 L154 T158 I160 | Y121-G156 VanDerWaalsContact CE1-CA 3.49Å; A152-G156 PolarHBondContact O-N 3.39Å; A153-G156 PolarHBondContact O-N 2.84Å; L154-G156 VanDerWaalsContact C-N 3.35Å; L154-G156 PolarHBondContact O-N 2.91Å; G156-T158 PolarHBondContact O-N 2.86Å; G156-I160 WeakPolarHBondContact O-CB 3.16Å; G156-I160 WeakPolarHBondContact O-CD1 3.33Å; G156-I160 WeakPolarHBondContact O-CG1 3.5Å; G156-I160 PolarHBondContact O-N 2.92Å |
| 157 | W | 98.3 | Very high | 97.3 | Very high | 52 Ų | 52 | 50.9 Ų | 50.9 | 20% | 0.197 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -60.5 | -44.9 | 177 | -79.6 | 114.1 | 0 | 0 | 0 | 112.3 | N74 A78 T114 T115 A118 F122 A153 L154 S161 | N74-W157 PolarHBondContact OD1-NE1 3.36Å; A78-W157 HydrophobicContact CB-CH2 3.74Å; A78-W157 HydrophobicContact CB-CZ2 4.02Å; T114-W157 HydrophobicContact CG2-CE3 4.02Å; T114-W157 HydrophobicContact CG2-CZ3 3.99Å; T115-W157 HydrophobicContact CG2-CH2 4.15Å; T115-W157 HydrophobicContact CG2-CZ3 4.11Å; A118-W157 HydrophobicContact CB-CE3 4.07Å; A118-W157 HydrophobicContact CB-CH2 3.82Å; A118-W157 HydrophobicContact CB-CZ2 4.26Å; A118-W157 HydrophobicContact CB-CZ3 3.71Å; F122-W157 AromaticContact CE2-CE2 3.77Å; F122-W157 AromaticContact CE2-CZ2 3.97Å; F122-W157 HydrophobicContact CE2-CZ2 3.97Å; F122-W157 AromaticContact CE2-NE1 3.64Å; F122-W157 AromaticContact CZ-CD1 3.86Å; F122-W157 AromaticContact CZ-NE1 3.49Å; A153-W157 PolarHBondContact O-N 3.32Å; L154-W157 PolarHBondContact O-N 2.97Å; W157-S161 VanDerWaalsContact O-CB 3.23Å; W157-S161 WeakPolarHBondContact O-CB 3.37Å; W157-S161 PolarHBondContact O-N 3.02Å; W157-S161 PolarHBondContact O-OG 3.35Å |
| 158 | T | 98.2 | Very high | 97.5 | Very high | 84 Ų | 84 | 47.6 Ų | 47.6 | 52% | 0.515 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -68.1 | -47.7 | -179.9 | 55.5 | 0 | 0 | 0 | 0 | 111.7 | L154 V155 G156 I160 S161 S162 | L154-T158 WeakPolarHBondContact O-CG2 3.43Å; L154-T158 PolarHBondContact O-N 3.32Å; L154-T158 PolarHBondContact O-OG1 3.37Å; V155-T158 WeakPolarHBondContact CA-OG1 3.4Å; V155-T158 PolarHBondContact O-N 3.02Å; V155-T158 PolarHBondContact O-OG1 3.47Å; G156-T158 PolarHBondContact O-N 2.86Å; T158-I160 PolarHBondContact O-N 2.99Å; T158-S161 PolarHBondContact O-N 3.35Å; T158-S162 WeakPolarHBondContact O-CB 3.49Å; T158-S162 PolarHBondContact O-N 3.41Å; T158-S162 PolarHBondContact O-OG 3.44Å |
| 159 | V | 98 | Very high | 97.6 | Very high | 74 Ų | 74 | 47.2 Ų | 47.2 | 45% | 0.448 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -60.7 | -46.8 | 179.7 | 169.4 | 0 | 0 | 0 | 0 | 111.1 | V155 S161 S162 L163 | V155-V159 HydrophobicContact CG1-CG2 3.99Å; V155-V159 VanDerWaalsContact O-CB 3.27Å; V155-V159 WeakPolarHBondContact O-CB 3.44Å; V155-V159 WeakPolarHBondContact O-CG2 3.33Å; V155-V159 PolarHBondContact O-N 3.27Å; V159-S161 VanDerWaalsContact C-N 3.34Å; V159-S161 PolarHBondContact O-N 3.26Å; V159-S162 PolarHBondContact O-N 3.32Å; V159-L163 HydrophobicContact CG1-CD1 4.07Å; V159-L163 HydrophobicContact CG1-CG 4.43Å; V159-L163 VanDerWaalsContact O-CG 3.32Å; V159-L163 WeakPolarHBondContact O-CG 3.33Å; V159-L163 PolarHBondContact O-N 2.69Å |
| 160 | I | 98.4 | Very high | 97.8 | Very high | 11 Ų | 11 | 50.2 Ų | 50.2 | 6% | 0.056 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -65.6 | -41.4 | 179.2 | -66.2 | 168.7 | 0 | 0 | 0 | 110.6 | T114 A118 Y121 G156 T158 S162 L163 M164 | T114-I160 HydrophobicContact CG2-CG2 4.2Å; T114-I160 WeakPolarHBondContact O-CG2 3.41Å; A118-I160 VanDerWaalsContact CA-CD1 3.48Å; A118-I160 HydrophobicContact CB-CD1 4.1Å; Y121-I160 HydrophobicContact CG-CD1 4.07Å; G156-I160 WeakPolarHBondContact O-CB 3.16Å; G156-I160 WeakPolarHBondContact O-CD1 3.33Å; G156-I160 WeakPolarHBondContact O-CG1 3.5Å; G156-I160 PolarHBondContact O-N 2.92Å; T158-I160 PolarHBondContact O-N 2.99Å; I160-S162 VanDerWaalsContact C-N 3.29Å; I160-S162 PolarHBondContact O-N 3.38Å; I160-L163 PolarHBondContact O-N 3.35Å; I160-M164 HydrophobicContact CG2-CG 4.36Å; I160-M164 VanDerWaalsContact O-CG 3.29Å; I160-M164 WeakPolarHBondContact O-CG 3.41Å; I160-M164 PolarHBondContact O-N 2.81Å |
| 161 | S | 98.1 | Very high | 97.9 | Very high | 40 Ų | 40 | 47 Ų | 47 | 28% | 0.28 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60.8 | -40.4 | 176.4 | -60.2 | 0 | 0 | 0 | 0 | 111.9 | T114 W157 T158 V159 M164 V165 Y168 | T114-S161 WeakPolarHBondContact CG2-OG 3.35Å; W157-S161 VanDerWaalsContact O-CB 3.23Å; W157-S161 WeakPolarHBondContact O-CB 3.37Å; W157-S161 PolarHBondContact O-N 3.02Å; W157-S161 PolarHBondContact O-OG 3.35Å; T158-S161 PolarHBondContact O-N 3.35Å; V159-S161 VanDerWaalsContact C-N 3.34Å; V159-S161 PolarHBondContact O-N 3.26Å; S161-M164 PolarHBondContact O-N 3.32Å; S161-V165 PolarHBondContact O-N 2.87Å; S161-Y168 WeakPolarHBondContact CA-OH 3.46Å; S161-Y168 WeakPolarHBondContact O-CE2 3.13Å; S161-Y168 PolarHBondContact O-OH 2.91Å |
| 162 | S | 97.9 | Very high | 97.9 | Very high | 82 Ų | 82 | 47 Ų | 47 | 57% | 0.573 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -65.7 | -42.2 | 175.7 | -62.2 | 0 | 0 | 0 | 0 | 112.4 | T158 V159 I160 M164 V165 | T158-S162 WeakPolarHBondContact O-CB 3.49Å; T158-S162 PolarHBondContact O-N 3.41Å; T158-S162 PolarHBondContact O-OG 3.44Å; V159-S162 PolarHBondContact O-N 3.32Å; I160-S162 VanDerWaalsContact C-N 3.29Å; I160-S162 PolarHBondContact O-N 3.38Å; S162-M164 PolarHBondContact O-N 3.29Å; S162-V165 WeakPolarHBondContact O-CB 3.16Å; S162-V165 VanDerWaalsContact O-CG2 3.3Å; S162-V165 WeakPolarHBondContact O-CG2 3.26Å; S162-V165 PolarHBondContact O-N 3.42Å |
| 163 | L | 97.8 | Very high | 97.9 | Very high | 41 Ų | 41 | 48.8 Ų | 48.8 | 22% | 0.215 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64 | -29.8 | 176.6 | -70.5 | 173.7 | 0 | 0 | 0 | 112.2 | V159 I160 Y212 L216 | V159-L163 HydrophobicContact CG1-CD1 4.07Å; V159-L163 HydrophobicContact CG1-CG 4.43Å; V159-L163 VanDerWaalsContact O-CG 3.32Å; V159-L163 WeakPolarHBondContact O-CG 3.33Å; V159-L163 PolarHBondContact O-N 2.69Å; I160-L163 PolarHBondContact O-N 3.35Å; L163-Y212 HydrophobicContact CB-CE2 4.44Å; L163-Y212 HydrophobicContact CD2-CD2 4.35Å; L163-Y212 HydrophobicContact CD2-CE2 4.22Å; L163-Y212 PolarHBondContact O-OH 3.41Å; L163-L216 HydrophobicContact CD1-CB 4.35Å; L163-L216 HydrophobicContact CD1-CD1 4.02Å; L163-L216 HydrophobicContact CD2-CD1 3.69Å |
| 164 | M | 98 | Very high | 97.8 | Very high | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 29% | 0.289 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.8 | 0.5 | -177.8 | -62.9 | -56.2 | 119.1 | 0 | 0 | 114.2 | Y117 I160 S161 S162 P166 I167 Y168 F209 | Y117-M164 HydrophobicContact CD2-CE 3.61Å; Y117-M164 HydrophobicContact CD2-CG 4.17Å; Y117-M164 HydrophobicContact CD2-SD 3.41Å; Y117-M164 WeakPolarHBondContact CD2-SD 3.35Å; Y117-M164 HydrophobicContact CE2-CE 3.81Å; Y117-M164 HydrophobicContact CE2-SD 3.41Å; Y117-M164 WeakPolarHBondContact CE2-SD 3.33Å; Y117-M164 HydrophobicContact CG-CE 4.48Å; I160-M164 HydrophobicContact CG2-CG 4.36Å; I160-M164 VanDerWaalsContact O-CG 3.29Å; I160-M164 WeakPolarHBondContact O-CG 3.41Å; I160-M164 PolarHBondContact O-N 2.81Å; S161-M164 PolarHBondContact O-N 3.32Å; S162-M164 PolarHBondContact O-N 3.29Å; M164-P166 VanDerWaalsContact C-CD 3.43Å; M164-P166 VanDerWaalsContact C-N 3.32Å; M164-I167 WeakPolarHBondContact O-CB 3.26Å; M164-I167 PolarHBondContact O-N 2.88Å; M164-I167 HydrophobicContact SD-CD1 4.33Å; M164-Y168 HydrophobicContact CB-CE1 3.63Å; M164-Y168 VanDerWaalsContact O-CD1 3.26Å; M164-Y168 WeakPolarHBondContact O-CD1 3.38Å; M164-Y168 WeakPolarHBondContact O-CE1 3.13Å; M164-Y168 PolarHBondContact O-N 3.47Å; M164-F209 HydrophobicContact CE-CZ 4.42Å; M164-F209 HydrophobicContact SD-CE2 4.24Å; M164-F209 HydrophobicContact SD-CZ 3.89Å |
| 165 | V | 98.1 | Very high | 97.7 | Very high | 60 Ų | 60 | 56.2 Ų | 56.2 | 36% | 0.364 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -49.8 | -41.6 | 179.9 | 168.4 | 0 | 0 | 0 | 0 | 114.1 | S161 S162 I167 Y168 I169 | S161-V165 PolarHBondContact O-N 2.87Å; S162-V165 WeakPolarHBondContact O-CB 3.16Å; S162-V165 VanDerWaalsContact O-CG2 3.3Å; S162-V165 WeakPolarHBondContact O-CG2 3.26Å; S162-V165 PolarHBondContact O-N 3.42Å; V165-I167 VanDerWaalsContact C-N 3.26Å; V165-I167 PolarHBondContact O-N 3.28Å; V165-Y168 HydrophobicContact CG2-CD2 4.23Å; V165-Y168 HydrophobicContact CG2-CE2 4.3Å; V165-Y168 WeakPolarHBondContact O-CA 3.32Å; V165-Y168 VanDerWaalsContact O-CB 3.31Å; V165-Y168 WeakPolarHBondContact O-CB 3.14Å; V165-Y168 PolarHBondContact O-N 3.24Å; V165-I169 HydrophobicContact CG1-CD1 3.75Å; V165-I169 HydrophobicContact CG1-CG1 4.22Å; V165-I169 PolarHBondContact O-N 3.37Å; V165-I169 VanDerWaalsContact O-N 3.08Å |
| 166 | P | 97.7 | Very high | 97.5 | Very high | 30 Ų | 30 | 57.4 Ų | 57.4 | 20% | 0.195 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -57.5 | -37.7 | 177.7 | -28.7 | 38.6 | 0 | 0 | 0 | 113.4 | M164 Y168 I169 Y170 W187 F209 | M164-P166 VanDerWaalsContact C-CD 3.43Å; M164-P166 VanDerWaalsContact C-N 3.32Å; P166-Y168 VanDerWaalsContact C-N 3.25Å; P166-Y168 PolarHBondContact O-N 2.94Å; P166-I169 PolarHBondContact O-N 2.82Å; P166-Y170 HydrophobicContact CB-CD2 4.17Å; P166-Y170 HydrophobicContact CB-CE2 4.2Å; P166-Y170 WeakPolarHBondContact O-CB 2.9Å; P166-Y170 WeakPolarHBondContact O-CD2 2.98Å; P166-Y170 PolarHBondContact O-N 3.21Å; P166-W187 HydrophobicContact CB-CH2 4.4Å; P166-W187 HydrophobicContact CB-CZ3 4.01Å; P166-F209 HydrophobicContact CB-CD2 3.93Å; P166-F209 HydrophobicContact CB-CE2 4.42Å; P166-F209 HydrophobicContact CG-CD2 4.12Å |
| 167 | I | 97.8 | Very high | 97.2 | Very high | 10 Ų | 10 | 60.2 Ų | 60.2 | 5% | 0.051 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -63.3 | -35.6 | 174.2 | -69.9 | -177.5 | 0 | 0 | 0 | 110.7 | F109 M164 V165 I169 S171 I185 W187 F209 | F109-I167 HydrophobicContact CB-CG2 3.75Å; F109-I167 HydrophobicContact CD1-CG2 4.46Å; F109-I167 HydrophobicContact CG-CG2 4.41Å; M164-I167 WeakPolarHBondContact O-CB 3.26Å; M164-I167 PolarHBondContact O-N 2.88Å; M164-I167 HydrophobicContact SD-CD1 4.33Å; V165-I167 VanDerWaalsContact C-N 3.26Å; V165-I167 PolarHBondContact O-N 3.28Å; I167-I169 VanDerWaalsContact C-N 3.34Å; I167-S171 WeakPolarHBondContact O-CB 3.4Å; I167-S171 PolarHBondContact O-N 2.99Å; I167-S171 PolarHBondContact O-OG 3.23Å; I167-I185 HydrophobicContact CD1-CD1 4.18Å; I167-I185 HydrophobicContact CG1-CD1 4.08Å; I167-I185 HydrophobicContact CG2-CD1 4.28Å; I167-W187 HydrophobicContact CG1-CH2 4.25Å; I167-F209 HydrophobicContact CD1-CE1 3.78Å; I167-F209 HydrophobicContact CD1-CE2 4.1Å; I167-F209 HydrophobicContact CD1-CZ 3.3Å; I167-F209 HydrophobicContact CG1-CE1 4.09Å; I167-F209 HydrophobicContact CG1-CE2 3.9Å; I167-F209 HydrophobicContact CG1-CZ 3.56Å |
| 168 | Y | 97.8 | Very high | 97 | Very high | 48 Ų | 48 | 63.1 Ų | 63.1 | 19% | 0.188 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -69.9 | -36 | -178.4 | -50.4 | -11.9 | 0 | 0 | 0 | 111.6 | I110 T114 S161 M164 V165 P166 | I110-Y168 HydrophobicContact CB-CD1 3.99Å; I110-Y168 HydrophobicContact CB-CE1 4.03Å; I110-Y168 HydrophobicContact CG1-CD1 3.43Å; I110-Y168 VanDerWaalsContact CG1-CD1 3.43Å; I110-Y168 HydrophobicContact CG1-CE1 3.98Å; I110-Y168 HydrophobicContact CG1-CG 3.76Å; I110-Y168 HydrophobicContact CG2-CD1 4.18Å; I110-Y168 HydrophobicContact CG2-CE1 3.86Å; T114-Y168 PolarHBondContact OG1-OH 2.96Å; S161-Y168 WeakPolarHBondContact CA-OH 3.46Å; S161-Y168 WeakPolarHBondContact O-CE2 3.13Å; S161-Y168 PolarHBondContact O-OH 2.91Å; M164-Y168 HydrophobicContact CB-CE1 3.63Å; M164-Y168 VanDerWaalsContact O-CD1 3.26Å; M164-Y168 WeakPolarHBondContact O-CD1 3.38Å; M164-Y168 WeakPolarHBondContact O-CE1 3.13Å; M164-Y168 PolarHBondContact O-N 3.47Å; V165-Y168 HydrophobicContact CG2-CD2 4.23Å; V165-Y168 HydrophobicContact CG2-CE2 4.3Å; V165-Y168 WeakPolarHBondContact O-CA 3.32Å; V165-Y168 VanDerWaalsContact O-CB 3.31Å; V165-Y168 WeakPolarHBondContact O-CB 3.14Å; V165-Y168 PolarHBondContact O-N 3.24Å; P166-Y168 VanDerWaalsContact C-N 3.25Å; P166-Y168 PolarHBondContact O-N 2.94Å |
| 169 | I | 97.6 | Very high | 96.7 | Very high | 107 Ų | 107 | 66 Ų | 66 | 55% | 0.549 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -73.3 | -49 | 178.3 | -64 | 172.4 | 0 | 0 | 0 | 110 | V165 P166 I167 | V165-I169 HydrophobicContact CG1-CD1 3.75Å; V165-I169 HydrophobicContact CG1-CG1 4.22Å; V165-I169 PolarHBondContact O-N 3.37Å; V165-I169 VanDerWaalsContact O-N 3.08Å; P166-I169 PolarHBondContact O-N 2.82Å; I167-I169 VanDerWaalsContact C-N 3.34Å |
| 170 | Y | 97.4 | Very high | 96.6 | Very high | 71 Ų | 71 | 64.4 Ų | 64.4 | 28% | 0.278 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -91.7 | -3 | -170.5 | -58.7 | -54.5 | 0 | 0 | 0 | 114.7 | P166 E172 A186 W187 P188 T205 | P166-Y170 HydrophobicContact CB-CD2 4.17Å; P166-Y170 HydrophobicContact CB-CE2 4.2Å; P166-Y170 WeakPolarHBondContact O-CB 2.9Å; P166-Y170 WeakPolarHBondContact O-CD2 2.98Å; P166-Y170 PolarHBondContact O-N 3.21Å; Y170-E172 PolarHBondContact O-N 3.01Å; Y170-A186 PolarHBondContact O-N 2.8Å; Y170-W187 AromaticContact CD2-CE3 3.67Å; Y170-W187 HydrophobicContact CD2-CE3 3.67Å; Y170-W187 AromaticContact CD2-CZ3 3.66Å; Y170-W187 HydrophobicContact CD2-CZ3 3.66Å; Y170-W187 HydrophobicContact CE2-CE3 4.27Å; Y170-W187 HydrophobicContact CE2-CZ3 4.26Å; Y170-W187 HydrophobicContact CG-CE3 4.34Å; Y170-P188 HydrophobicContact CE1-CG 4.02Å; Y170-P188 HydrophobicContact CE2-CG 4.46Å; Y170-T205 HydrophobicContact CD2-CG2 4.4Å; Y170-T205 HydrophobicContact CE2-CG2 3.65Å |
| 171 | S | 98 | Very high | 96.5 | Very high | 0 Ų | 0 | 65.7 Ų | 65.7 | 0% | 0 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.1 | 123.8 | 172.8 | 48.2 | 0 | 0 | 0 | 0 | 111.3 | K106 I167 | K106-S171 WeakPolarHBondContact CE-O 3.26Å; K106-S171 WeakPolarHBondContact CG-O 3.25Å; I167-S171 WeakPolarHBondContact O-CB 3.4Å; I167-S171 PolarHBondContact O-N 2.99Å; I167-S171 PolarHBondContact O-OG 3.23Å |
| 172 | E | 97.2 | Very high | 96.4 | Very high | 69 Ų | 69 | 65.3 Ų | 65.3 | 32% | 0.322 | 35% | 0.348 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.1 | 171.7 | -178 | 66.3 | 176.3 | 176.6 | 0 | 0 | 112.5 | C105 Y170 R174 T184 A186 | C105-E172 PolarHBondContact SG-O 3.32Å; C105-E172 VanDerWaalsContact SG-O 3.41Å; Y170-E172 PolarHBondContact O-N 3.01Å; E172-R174 HydrophobicContact CG-CG 4.23Å; E172-R174 IonicContact OE1-CZ 3.14Å; E172-R174 IonicContact OE1-NE 2.74Å; E172-R174 PolarHBondContact OE1-NE 2.88Å; E172-R174 IonicContact OE1-NH2 2.72Å; E172-R174 PolarHBondContact OE1-NH2 3.36Å; E172-T184 PolarHBondContact N-O 2.82Å; E172-T184 PolarHBondContact O-N 2.78Å; E172-A186 HydrophobicContact CG-CB 3.69Å; E172-A186 WeakPolarHBondContact OE1-CB 3.29Å |
| 173 | I | 97.9 | Very high | 96.4 | Very high | 59 Ų | 59 | 62 Ų | 62 | 30% | 0.303 | 33% | 0.325 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.4 | 139.3 | 168.8 | 61.4 | 171.7 | 0 | 0 | 0 | 109.5 | T102 C105 V181 V182 | T102-I173 VanDerWaalsContact OG1-CD1 3.26Å; T102-I173 WeakPolarHBondContact OG1-CD1 3.45Å; T102-I173 WeakPolarHBondContact OG1-CG1 3.31Å; C105-I173 HydrophobicContact CB-CG2 3.82Å; I173-V181 HydrophobicContact CB-CG1 3.85Å; I173-V181 HydrophobicContact CD1-CG1 4.39Å; I173-V181 HydrophobicContact CG2-CG1 4.42Å; I173-V182 CarbonylContact C-O 3.52Å; I173-V182 VanDerWaalsContact CA-O 3.24Å; I173-V182 WeakPolarHBondContact CA-O 3.47Å |
| 174 | R | 96.4 | Very high | 96.3 | Very high | 132 Ų | 132 | 62.5 Ų | 62.5 | 50% | 0.498 | 33% | 0.33 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 137.5 | 173 | -69.3 | -163.7 | 169.6 | -137.7 | -7.1 | 110.6 | E172 V181 V182 T184 A186 | E172-R174 HydrophobicContact CG-CG 4.23Å; E172-R174 IonicContact OE1-CZ 3.14Å; E172-R174 IonicContact OE1-NE 2.74Å; E172-R174 PolarHBondContact OE1-NE 2.88Å; E172-R174 IonicContact OE1-NH2 2.72Å; E172-R174 PolarHBondContact OE1-NH2 3.36Å; R174-V181 CarbonylContact O-C 3.51Å; R174-V181 WeakPolarHBondContact O-CA 3.46Å; R174-V182 HydrophobicContact CB-CG2 4.26Å; R174-V182 PolarHBondContact N-O 3.38Å; R174-V182 PolarHBondContact O-N 3.1Å; R174-T184 HydrophobicContact CB-CG2 4.36Å; R174-T184 HydrophobicContact CG-CG2 4.07Å; R174-A186 VanDerWaalsContact NE-CB 3.35Å |
| 175 | E | 95.8 | Very high | 96.2 | Very high | 137 Ų | 137 | 64.4 Ų | 64.4 | 64% | 0.64 | 34% | 0.34 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -82.6 | 117.4 | 171.4 | -166.5 | 176.5 | 150.3 | 0 | 0 | 108.9 | T177 P178 | E175-T177 VanDerWaalsContact CG-O 3.27Å; E175-T177 WeakPolarHBondContact CG-O 3.33Å; E175-P178 WeakPolarHBondContact OE1-CA 3.33Å |
| 176 | V | 92.6 | Very high | 96.1 | Very high | 96 Ų | 96 | 62.2 Ų | 62.2 | 58% | 0.582 | 33% | 0.328 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.6 | -34.5 | 178.9 | -178 | 0 | 0 | 0 | 0 | 110.4 | T180 V182 | V176-T180 PolarHBondContact N-O 3.2Å; V176-V182 HydrophobicContact CG2-CB 4.31Å; V176-V182 HydrophobicContact CG2-CG1 3.74Å; V176-V182 HydrophobicContact CG2-CG2 3.62Å |
| 177 | T | 93.4 | Very high | 96 | Very high | 61 Ų | 61 | 62.2 Ų | 62.2 | 37% | 0.374 | 32% | 0.324 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.7 | 163.4 | 173 | 68.6 | 0 | 0 | 0 | 0 | 107.7 | E175 N179 T180 | E175-T177 VanDerWaalsContact CG-O 3.27Å; E175-T177 WeakPolarHBondContact CG-O 3.33Å; T177-N179 PolarHBondContact O-N 3.3Å; T177-T180 PolarHBondContact N-O 2.83Å; T177-T180 PolarHBondContact O-N 2.93Å; T177-T180 WeakPolarHBondContact OG1-CB 3.41Å; T177-T180 PolarHBondContact OG1-N 3.41Å; T177-T180 VanDerWaalsContact OG1-N 3.12Å; T177-T180 PolarHBondContact OG1-OG1 3.45Å |
| 178 | P | 92.3 | Very high | 95.8 | Very high | 113 Ų | 113 | 63.7 Ų | 63.7 | 73% | 0.734 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.2 | -26.8 | 178.3 | -30.1 | 36.7 | 0 | 0 | 0 | 115.4 | E175 | E175-P178 WeakPolarHBondContact OE1-CA 3.33Š|
| 179 | N | 93.3 | Very high | 95.5 | Very high | 145 Ų | 145 | 64 Ų | 64 | 78% | 0.775 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.5 | 1.5 | -178.8 | -64.2 | -37.6 | 0 | 0 | 0 | 113.9 | T177 | T177-N179 PolarHBondContact O-N 3.3Š|
| 180 | T | 95 | Very high | 95.1 | Very high | 41 Ų | 41 | 62.2 Ų | 62.2 | 25% | 0.252 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.2 | 107.6 | -173.7 | -50.9 | 0 | 0 | 0 | 0 | 110.9 | R96 V176 T177 V182 | R96-T180 VanDerWaalsContact O-CG2 3.25Å; R96-T180 WeakPolarHBondContact O-CG2 3.43Å; V176-T180 PolarHBondContact N-O 3.2Å; T177-T180 PolarHBondContact N-O 2.83Å; T177-T180 PolarHBondContact O-N 2.93Å; T177-T180 WeakPolarHBondContact OG1-CB 3.41Å; T177-T180 PolarHBondContact OG1-N 3.41Å; T177-T180 VanDerWaalsContact OG1-N 3.12Å; T177-T180 PolarHBondContact OG1-OG1 3.45Å; T180-V182 HydrophobicContact CG2-CG1 4.35Å |
| 181 | V | 97 | Very high | 94.7 | Very high | 38 Ų | 38 | 63.4 Ų | 63.4 | 23% | 0.23 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.6 | 138.8 | 171.2 | 179.3 | 0 | 0 | 0 | 0 | 108.3 | T97 W98 I173 R174 | T97-V181 CarbonylContact C-O 3.57Å; T97-V181 WeakPolarHBondContact CA-O 3.1Å; T97-V181 PolarHBondContact OG1-N 2.57Å; T97-V181 PolarHBondContact OG1-O 3.25Å; W98-V181 HydrophobicContact CB-CG1 4.49Å; W98-V181 PolarHBondContact N-O 3.47Å; I173-V181 HydrophobicContact CB-CG1 3.85Å; I173-V181 HydrophobicContact CD1-CG1 4.39Å; I173-V181 HydrophobicContact CG2-CG1 4.42Å; R174-V181 CarbonylContact O-C 3.51Å; R174-V181 WeakPolarHBondContact O-CA 3.46Å |
| 182 | V | 96.5 | Very high | 94.2 | Very high | 31 Ų | 31 | 68 Ų | 68 | 19% | 0.188 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.2 | 144.1 | 175.4 | -58.4 | 0 | 0 | 0 | 0 | 110 | F92 I173 R174 V176 T180 T184 | F92-V182 HydrophobicContact CE2-CG1 4.36Å; F92-V182 HydrophobicContact CZ-CB 4.21Å; F92-V182 HydrophobicContact CZ-CG1 4.08Å; I173-V182 CarbonylContact C-O 3.52Å; I173-V182 VanDerWaalsContact CA-O 3.24Å; I173-V182 WeakPolarHBondContact CA-O 3.47Å; R174-V182 HydrophobicContact CB-CG2 4.26Å; R174-V182 PolarHBondContact N-O 3.38Å; R174-V182 PolarHBondContact O-N 3.1Å; V176-V182 HydrophobicContact CG2-CB 4.31Å; V176-V182 HydrophobicContact CG2-CG1 3.74Å; V176-V182 HydrophobicContact CG2-CG2 3.62Å; T180-V182 HydrophobicContact CG2-CG1 4.35Å; V182-T184 HydrophobicContact CG2-CG2 4.27Å |
| 183 | C | 97.3 | Very high | 93.7 | Very high | 14 Ų | 14 | 70.9 Ų | 70.9 | 10% | 0.095 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 116.3 | 166.2 | 174.8 | 0 | 0 | 0 | 0 | 107.7 | W98 C105 F109 | W98-C183 HydrophobicContact CB-CB 4.27Å; W98-C183 HydrophobicContact CD2-CB 3.47Å; W98-C183 VanDerWaalsContact CD2-CB 3.47Å; W98-C183 HydrophobicContact CE3-CB 3.68Å; W98-C183 HydrophobicContact CG-CB 3.73Å; W98-C183 HydrophobicContact CZ2-CB 4.43Å; W98-C183 HydrophobicContact CZ3-CB 4.23Å; C105-C183 WeakPolarHBondContact CA-SG 3.43Å; C105-C183 HydrophobicContact CB-CB 3.82Å; C105-C183 WeakPolarHBondContact CB-SG 3.47Å; C105-C183 WeakPolarHBondContact SG-CA 3.41Å; C105-C183 WeakPolarHBondContact SG-CB 3.41Å; C105-C183 CovalentContact SG-SG 2.03Å; C105-C183 PolarHBondContact SG-SG 3.25Å; F109-C183 HydrophobicContact CE2-CB 4.48Å; F109-C183 WeakPolarHBondContact CE2-SG 3.45Å |
| 184 | T | 95.7 | Very high | 93.1 | Very high | 51 Ų | 51 | 69 Ų | 69 | 31% | 0.313 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.8 | 168.1 | -173.4 | -167.5 | 0 | 0 | 0 | 0 | 111.6 | E172 R174 V182 | E172-T184 PolarHBondContact N-O 2.82Å; E172-T184 PolarHBondContact O-N 2.78Å; R174-T184 HydrophobicContact CB-CG2 4.36Å; R174-T184 HydrophobicContact CG-CG2 4.07Å; V182-T184 HydrophobicContact CG2-CG2 4.27Å |
| 185 | I | 96.1 | Very high | 92.8 | Very high | 39 Ų | 39 | 71 Ų | 71 | 20% | 0.2 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.4 | 121.2 | 164.6 | -54.9 | 164.4 | 0 | 0 | 0 | 106.9 | F109 I167 W187 | F109-I185 HydrophobicContact CD1-CD1 3.98Å; F109-I185 HydrophobicContact CD1-CG1 3.89Å; F109-I185 HydrophobicContact CE1-CD1 3.87Å; F109-I185 HydrophobicContact CE1-CG1 3.74Å; F109-I185 HydrophobicContact CE2-CG1 4.33Å; F109-I185 HydrophobicContact CG-CG1 4.29Å; F109-I185 HydrophobicContact CZ-CG1 3.97Å; I167-I185 HydrophobicContact CD1-CD1 4.18Å; I167-I185 HydrophobicContact CG1-CD1 4.08Å; I167-I185 HydrophobicContact CG2-CD1 4.28Å; I185-W187 HydrophobicContact CD1-CZ2 4.49Å; I185-W187 HydrophobicContact CG2-CD2 3.79Å; I185-W187 VanDerWaalsContact CG2-CE2 3.44Å; I185-W187 HydrophobicContact CG2-CE3 4.26Å; I185-W187 HydrophobicContact CG2-CG 4.3Å; I185-W187 HydrophobicContact CG2-CH2 4.09Å; I185-W187 HydrophobicContact CG2-CZ2 3.62Å; I185-W187 HydrophobicContact CG2-CZ3 4.4Å |
| 186 | A | 95.3 | Very high | 92.6 | Very high | 14 Ų | 14 | 71.5 Ų | 71.5 | 12% | 0.116 | 40% | 0.396 | C | S | . | . | trans | -103.1 | 82 | -178.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | Y170 E172 R174 | Y170-A186 PolarHBondContact O-N 2.8Å; E172-A186 HydrophobicContact CG-CB 3.69Å; E172-A186 WeakPolarHBondContact OE1-CB 3.29Å; R174-A186 VanDerWaalsContact NE-CB 3.35Å | ||
| 187 | W | 94.7 | Very high | 92.4 | Very high | 31 Ų | 31 | 69.2 Ų | 69.2 | 12% | 0.117 | 39% | 0.392 | C | S | . | . | P | Polyproline II helix | trans | -62 | 138.2 | 177.8 | -59.9 | 115.6 | 0 | 0 | 0 | 111.1 | P166 I167 Y170 I185 Y203 T205 E206 F209 | P166-W187 HydrophobicContact CB-CH2 4.4Å; P166-W187 HydrophobicContact CB-CZ3 4.01Å; I167-W187 HydrophobicContact CG1-CH2 4.25Å; Y170-W187 AromaticContact CD2-CE3 3.67Å; Y170-W187 HydrophobicContact CD2-CE3 3.67Å; Y170-W187 AromaticContact CD2-CZ3 3.66Å; Y170-W187 HydrophobicContact CD2-CZ3 3.66Å; Y170-W187 HydrophobicContact CE2-CE3 4.27Å; Y170-W187 HydrophobicContact CE2-CZ3 4.26Å; Y170-W187 HydrophobicContact CG-CE3 4.34Å; I185-W187 HydrophobicContact CD1-CZ2 4.49Å; I185-W187 HydrophobicContact CG2-CD2 3.79Å; I185-W187 VanDerWaalsContact CG2-CE2 3.44Å; I185-W187 HydrophobicContact CG2-CE3 4.26Å; I185-W187 HydrophobicContact CG2-CG 4.3Å; I185-W187 HydrophobicContact CG2-CH2 4.09Å; I185-W187 HydrophobicContact CG2-CZ2 3.62Å; I185-W187 HydrophobicContact CG2-CZ3 4.4Å; W187-Y203 HydrophobicContact CB-CD1 4.15Å; W187-T205 HydrophobicContact CE3-CG2 3.86Å; W187-T205 HydrophobicContact CZ3-CG2 4.02Å; W187-E206 HydrophobicContact CB-CB 4.07Å; W187-E206 HydrophobicContact CD2-CB 3.83Å; W187-E206 HydrophobicContact CD2-CG 4.21Å; W187-E206 HydrophobicContact CE3-CB 4.48Å; W187-E206 HydrophobicContact CG-CB 3.62Å; W187-E206 HydrophobicContact CG-CG 4.03Å; W187-E206 PolarHBondContact NE1-OE1 3.35Å; W187-F209 HydrophobicContact CH2-CB 3.7Å; W187-F209 AromaticContact CH2-CD1 3.48Å; W187-F209 HydrophobicContact CH2-CD1 3.48Å; W187-F209 VanDerWaalsContact CH2-CD1 3.48Å; W187-F209 AromaticContact CH2-CD2 3.73Å; W187-F209 HydrophobicContact CH2-CD2 3.73Å; W187-F209 HydrophobicContact CH2-CE1 4.09Å; W187-F209 HydrophobicContact CH2-CE2 4.34Å; W187-F209 AromaticContact CH2-CG 3.31Å; W187-F209 HydrophobicContact CH2-CG 3.31Å; W187-F209 HydrophobicContact CZ2-CB 4.34Å; W187-F209 AromaticContact CZ2-CD1 3.64Å; W187-F209 HydrophobicContact CZ2-CD1 3.64Å; W187-F209 HydrophobicContact CZ2-CE1 4.19Å; W187-F209 AromaticContact CZ2-CG 3.95Å; W187-F209 HydrophobicContact CZ2-CG 3.95Å; W187-F209 HydrophobicContact CZ3-CB 4.04Å; W187-F209 HydrophobicContact CZ3-CD2 4.38Å; W187-F209 HydrophobicContact CZ3-CG 4.07Å |
| 188 | P | 94.2 | Very high | 92.2 | Very high | 41 Ų | 41 | 72.1 Ų | 72.1 | 27% | 0.266 | 40% | 0.402 | S | S | . | . | P | Polyproline II helix | trans | -63.6 | 138.5 | 176 | 27.8 | -34.3 | 0 | 0 | 0 | 110.1 | Y170 T205 | Y170-P188 HydrophobicContact CE1-CG 4.02Å; Y170-P188 HydrophobicContact CE2-CG 4.46Å; P188-T205 HydrophobicContact CG-CG2 4.16Å; P188-T205 WeakPolarHBondContact CG-OG1 3.33Å |
| 189 | A | 91.1 | Very high | 91.9 | Very high | 55 Ų | 55 | 70.9 Ų | 70.9 | 46% | 0.455 | 39% | 0.392 | S | S | . | . | P | Polyproline II helix | trans | -100.9 | 121.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | Y203 | A189-Y203 HydrophobicContact CB-CD1 4.12Å; A189-Y203 HydrophobicContact CB-CE1 3.65Å |
| 190 | D | 89.5 | Confident | 91.5 | Very high | 69 Ų | 69 | 70 Ų | 70 | 37% | 0.369 | 38% | 0.378 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 125.3 | 172.2 | -56.4 | -49.9 | 0 | 0 | 0 | 108.7 | T201 S202 T204 | D190-T201 CarbonylContact O-C 3.52Å; D190-T201 WeakPolarHBondContact O-CA 3.47Å; D190-S202 PolarHBondContact N-O 3.42Å; D190-S202 PolarHBondContact O-N 3.25Å; D190-T204 WeakPolarHBondContact OD2-CB 3.26Å; D190-T204 WeakPolarHBondContact OD2-CG2 3.23Å; D190-T204 PolarHBondContact OD2-OG1 3.02Å |
| 191 | S | 88.5 | Confident | 91 | Very high | 95 Ų | 95 | 72.4 Ų | 72.4 | 66% | 0.664 | 39% | 0.392 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 134.9 | 175.1 | 57.3 | 0 | 0 | 0 | 0 | 110.7 | R200 | S191-R200 CarbonylContact C-O 3.57Å; S191-R200 WeakPolarHBondContact CA-O 3.17Å |
| 192 | F | 87.6 | Confident | 90.5 | Very high | 97 Ų | 97 | 72 Ų | 72 | 43% | 0.425 | 39% | 0.392 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.2 | 149.2 | 176 | 71 | -84.7 | 0 | 0 | 0 | 110.1 | T199 R200 | F192-T199 CarbonylContact O-C 3.59Å; F192-T199 WeakPolarHBondContact O-CA 3.28Å; F192-R200 HydrophobicContact CD1-CB 4.18Å; F192-R200 WeakPolarHBondContact CD1-O 3.46Å; F192-R200 HydrophobicContact CD2-CB 4.45Å; F192-R200 HydrophobicContact CE1-CB 3.6Å; F192-R200 HydrophobicContact CE2-CB 3.93Å; F192-R200 HydrophobicContact CE2-CG 4.47Å; F192-R200 HydrophobicContact CZ-CB 3.48Å; F192-R200 VanDerWaalsContact CZ-CB 3.48Å; F192-R200 HydrophobicContact CZ-CG 4.29Å; F192-R200 PolarHBondContact N-O 3.32Å; F192-R200 PolarHBondContact O-N 2.94Å |
| 193 | H | 87.9 | Confident | 90.2 | Very high | 130 Ų | 130 | 75.2 Ų | 75.2 | 60% | 0.602 | 40% | 0.401 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 130.1 | 172.9 | -71.1 | -86.6 | 0 | 0 | 0 | 109.9 | G197 Q198 T199 | H193-G197 PolarHBondContact ND1-O 2.96Å; H193-Q198 WeakPolarHBondContact CA-O 3.34Å; H193-T199 PolarHBondContact CE1-OG1 2.58Å; H193-T199 PolarHBondContact ND1-OG1 2.86Å |
| 194 | D | 85.7 | Confident | 89.9 | Confident | 20 Ų | 20 | 76.9 Ų | 76.9 | 11% | 0.107 | 41% | 0.411 | C | S | . | . | trans | -75.5 | 176 | 172.8 | 76 | 6.9 | 0 | 0 | 0 | 112 | F196 G197 Q198 R200 | D194-F196 PolarHBondContact O-N 2.93Å; D194-F196 VanDerWaalsContact OD1-CA 3.32Å; D194-F196 WeakPolarHBondContact OD1-CA 3.19Å; D194-F196 WeakPolarHBondContact OD1-CB 3.32Å; D194-F196 PolarHBondContact OD1-N 3.49Å; D194-G197 PolarHBondContact O-N 3.3Å; D194-G197 PolarHBondContact OD1-N 3.49Å; D194-Q198 PolarHBondContact N-O 2.87Å; D194-Q198 WeakPolarHBondContact OD1-CB 3.5Å; D194-Q198 PolarHBondContact OD1-N 3.34Å; D194-R200 HydrophobicContact CB-CG 4.27Å; D194-R200 IonicContact OD2-CZ 3.12Å; D194-R200 IonicContact OD2-NE 2.8Å; D194-R200 PolarHBondContact OD2-NE 2.88Å; D194-R200 IonicContact OD2-NH2 2.74Å; D194-R200 PolarHBondContact OD2-NH2 2.71Å | ||
| 195 | Q | 89.7 | Confident | 89.9 | Confident | 174 Ų | 174 | 76.2 Ų | 76.2 | 81% | 0.813 | 41% | 0.407 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.4 | -14.1 | 178.5 | 68.2 | -170.5 | -0.1 | 0 | 0 | 114.6 | ||
| 196 | F | 90.7 | Very high | 89.8 | Confident | 146 Ų | 146 | 76.7 Ų | 76.7 | 64% | 0.64 | 41% | 0.408 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.4 | 9.6 | 176.2 | -56.3 | -72.3 | 0 | 0 | 0 | 112.2 | D194 Q198 | D194-F196 PolarHBondContact O-N 2.93Å; D194-F196 VanDerWaalsContact OD1-CA 3.32Å; D194-F196 WeakPolarHBondContact OD1-CA 3.19Å; D194-F196 WeakPolarHBondContact OD1-CB 3.32Å; D194-F196 PolarHBondContact OD1-N 3.49Å; F196-Q198 PolarHBondContact O-N 3.35Å |
| 197 | G | 88.5 | Confident | 89.8 | Confident | 49 Ų | 49 | 78.4 Ų | 78.4 | 51% | 0.505 | 41% | 0.414 | S | S | . | . | S | Bend | trans | 76.1 | 3.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | H193 D194 | H193-G197 PolarHBondContact ND1-O 2.96Å; D194-G197 PolarHBondContact O-N 3.3Å; D194-G197 PolarHBondContact OD1-N 3.49Å |
| 198 | Q | 88.8 | Confident | 89.8 | Confident | 121 Ų | 121 | 84.9 Ų | 84.9 | 57% | 0.565 | 44% | 0.439 | S | S | * | . | trans | -79.5 | 130.3 | -179.1 | -65.1 | 179.6 | 64.9 | 0 | 0 | 110.6 | H193 D194 F196 R200 | H193-Q198 WeakPolarHBondContact CA-O 3.34Å; D194-Q198 PolarHBondContact N-O 2.87Å; D194-Q198 WeakPolarHBondContact OD1-CB 3.5Å; D194-Q198 PolarHBondContact OD1-N 3.34Å; F196-Q198 PolarHBondContact O-N 3.35Å; Q198-R200 PolarHBondContact O-N 3.41Å | ||
| 199 | T | 86 | Confident | 90 | Very high | 87 Ų | 87 | 83.6 Ų | 83.6 | 53% | 0.534 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.1 | 116.3 | 173.7 | -48.4 | 0 | 0 | 0 | 0 | 109.7 | F192 H193 | F192-T199 CarbonylContact O-C 3.59Å; F192-T199 WeakPolarHBondContact O-CA 3.28Å; H193-T199 PolarHBondContact CE1-OG1 2.58Å; H193-T199 PolarHBondContact ND1-OG1 2.86Å |
| 200 | R | 85 | Confident | 90.3 | Very high | 128 Ų | 128 | 81.4 Ų | 81.4 | 48% | 0.483 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108 | 149 | 170.9 | -63.6 | -169.1 | -174.5 | -168.6 | 2 | 109.7 | S191 F192 D194 Q198 | S191-R200 CarbonylContact C-O 3.57Å; S191-R200 WeakPolarHBondContact CA-O 3.17Å; F192-R200 HydrophobicContact CD1-CB 4.18Å; F192-R200 WeakPolarHBondContact CD1-O 3.46Å; F192-R200 HydrophobicContact CD2-CB 4.45Å; F192-R200 HydrophobicContact CE1-CB 3.6Å; F192-R200 HydrophobicContact CE2-CB 3.93Å; F192-R200 HydrophobicContact CE2-CG 4.47Å; F192-R200 HydrophobicContact CZ-CB 3.48Å; F192-R200 VanDerWaalsContact CZ-CB 3.48Å; F192-R200 HydrophobicContact CZ-CG 4.29Å; F192-R200 PolarHBondContact N-O 3.32Å; F192-R200 PolarHBondContact O-N 2.94Å; D194-R200 HydrophobicContact CB-CG 4.27Å; D194-R200 IonicContact OD2-CZ 3.12Å; D194-R200 IonicContact OD2-NE 2.8Å; D194-R200 PolarHBondContact OD2-NE 2.88Å; D194-R200 IonicContact OD2-NH2 2.74Å; D194-R200 PolarHBondContact OD2-NH2 2.71Å; Q198-R200 PolarHBondContact O-N 3.41Å |
| 201 | T | 85 | Confident | 90.6 | Very high | 90 Ų | 90 | 82.2 Ų | 82.2 | 55% | 0.552 | 41% | 0.414 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -105.3 | 131 | 174.8 | 50.9 | 0 | 0 | 0 | 0 | 109.7 | D190 | D190-T201 CarbonylContact O-C 3.52Å; D190-T201 WeakPolarHBondContact O-CA 3.47Å |
| 202 | S | 86.4 | Confident | 91.1 | Very high | 31 Ų | 31 | 80.9 Ų | 80.9 | 22% | 0.217 | 40% | 0.395 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 135.6 | 173.1 | -175.2 | 0 | 0 | 0 | 0 | 109.9 | D190 T204 | D190-S202 PolarHBondContact N-O 3.42Å; D190-S202 PolarHBondContact O-N 3.25Å; S202-T204 VanDerWaalsContact C-N 3.34Å; S202-T204 PolarHBondContact O-N 3.39Å; S202-T204 WeakPolarHBondContact OG-CG2 3.41Å |
| 203 | Y | 90.4 | Very high | 91.6 | Very high | 98 Ų | 98 | 76.3 Ų | 76.3 | 38% | 0.384 | 38% | 0.375 | S | S | . | . | trans | -96.6 | 57.8 | 175 | -63.9 | -83.6 | 0 | 0 | 0 | 109.8 | W187 A189 T205 E206 H207 | W187-Y203 HydrophobicContact CB-CD1 4.15Å; A189-Y203 HydrophobicContact CB-CD1 4.12Å; A189-Y203 HydrophobicContact CB-CE1 3.65Å; Y203-T205 PolarHBondContact O-N 3.49Å; Y203-T205 VanDerWaalsContact O-N 3.12Å; Y203-E206 WeakPolarHBondContact O-CB 3.4Å; Y203-E206 PolarHBondContact O-N 2.98Å; Y203-H207 VanDerWaalsContact C-ND1 3.32Å; Y203-H207 PolarHBondContact O-N 2.92Å; Y203-H207 PolarHBondContact O-ND1 3.13Å | ||
| 204 | T | 91.7 | Very high | 92 | Very high | 48 Ų | 48 | 72.1 Ų | 72.1 | 29% | 0.294 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -54 | -40.1 | -168.6 | 65.5 | 0 | 0 | 0 | 0 | 112.5 | D190 S202 E206 H207 Y208 | D190-T204 WeakPolarHBondContact OD2-CB 3.26Å; D190-T204 WeakPolarHBondContact OD2-CG2 3.23Å; D190-T204 PolarHBondContact OD2-OG1 3.02Å; S202-T204 VanDerWaalsContact C-N 3.34Å; S202-T204 PolarHBondContact O-N 3.39Å; S202-T204 WeakPolarHBondContact OG-CG2 3.41Å; T204-E206 VanDerWaalsContact C-N 3.31Å; T204-E206 PolarHBondContact O-N 3.44Å; T204-H207 WeakPolarHBondContact O-CB 3.49Å; T204-H207 PolarHBondContact O-N 2.92Å; T204-H207 VanDerWaalsContact O-N 3.13Å; T204-Y208 WeakPolarHBondContact O-CD2 3.29Å; T204-Y208 PolarHBondContact O-N 3.46Å |
| 205 | T | 94.2 | Very high | 92.6 | Very high | 37 Ų | 37 | 73.5 Ų | 73.5 | 23% | 0.227 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -58.9 | -40.3 | 177.6 | -62.2 | 0 | 0 | 0 | 0 | 112.4 | Y170 W187 P188 Y203 F209 | Y170-T205 HydrophobicContact CD2-CG2 4.4Å; Y170-T205 HydrophobicContact CE2-CG2 3.65Å; W187-T205 HydrophobicContact CE3-CG2 3.86Å; W187-T205 HydrophobicContact CZ3-CG2 4.02Å; P188-T205 HydrophobicContact CG-CG2 4.16Å; P188-T205 WeakPolarHBondContact CG-OG1 3.33Å; Y203-T205 PolarHBondContact O-N 3.49Å; Y203-T205 VanDerWaalsContact O-N 3.12Å; T205-F209 WeakPolarHBondContact O-CB 3.3Å; T205-F209 PolarHBondContact O-N 3.38Å |
| 206 | E | 95 | Very high | 93 | Very high | 50 Ų | 50 | 69 Ų | 69 | 23% | 0.234 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -64.9 | -41.5 | 175.7 | -177.3 | 170.9 | -159 | 0 | 0 | 111.8 | W187 Y203 T204 F209 T210 V284 | W187-E206 HydrophobicContact CB-CB 4.07Å; W187-E206 HydrophobicContact CD2-CB 3.83Å; W187-E206 HydrophobicContact CD2-CG 4.21Å; W187-E206 HydrophobicContact CE3-CB 4.48Å; W187-E206 HydrophobicContact CG-CB 3.62Å; W187-E206 HydrophobicContact CG-CG 4.03Å; W187-E206 PolarHBondContact NE1-OE1 3.35Å; Y203-E206 WeakPolarHBondContact O-CB 3.4Å; Y203-E206 PolarHBondContact O-N 2.98Å; T204-E206 VanDerWaalsContact C-N 3.31Å; T204-E206 PolarHBondContact O-N 3.44Å; E206-F209 PolarHBondContact O-N 3.28Å; E206-T210 VanDerWaalsContact O-CB 3.26Å; E206-T210 WeakPolarHBondContact O-CB 3.45Å; E206-T210 PolarHBondContact O-N 3.47Å; E206-T210 PolarHBondContact O-OG1 2.94Å; E206-V284 HydrophobicContact CG-CG1 4.36Å; E206-V284 HydrophobicContact CG-CG2 3.99Å |
| 207 | H | 94.8 | Very high | 93.2 | Very high | 50 Ų | 50 | 62.4 Ų | 62.4 | 23% | 0.231 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.1 | -49.7 | 178.1 | -61.9 | 86.3 | 0 | 0 | 0 | 111.2 | Y203 T204 T210 L211 V284 F285 | Y203-H207 VanDerWaalsContact C-ND1 3.32Å; Y203-H207 PolarHBondContact O-N 2.92Å; Y203-H207 PolarHBondContact O-ND1 3.13Å; T204-H207 WeakPolarHBondContact O-CB 3.49Å; T204-H207 PolarHBondContact O-N 2.92Å; T204-H207 VanDerWaalsContact O-N 3.13Å; H207-T210 PolarHBondContact O-N 3.18Å; H207-L211 VanDerWaalsContact O-CB 3.32Å; H207-L211 WeakPolarHBondContact O-CB 3.41Å; H207-L211 PolarHBondContact O-N 3.04Å; H207-V284 HydrophobicContact CB-CG1 4.24Å; H207-V284 PolarHBondContact NE2-O 2.85Å; H207-F285 HydrophobicContact CB-CE1 4.15Å; H207-F285 HydrophobicContact CB-CZ 4.24Å; H207-F285 AromaticContact CD2-CD1 3.74Å; H207-F285 AromaticContact CD2-CE1 3.7Å |
| 208 | Y | 96.1 | Very high | 93.6 | Very high | 166 Ų | 166 | 60.8 Ų | 60.8 | 65% | 0.651 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -61.6 | -47.5 | 176.9 | -73.1 | -65.8 | 0 | 0 | 0 | 111.1 | T204 T210 L211 Y212 | T204-Y208 WeakPolarHBondContact O-CD2 3.29Å; T204-Y208 PolarHBondContact O-N 3.46Å; Y208-T210 VanDerWaalsContact C-N 3.35Å; Y208-T210 PolarHBondContact O-N 3.43Å; Y208-L211 PolarHBondContact O-N 3.5Å; Y208-Y212 WeakPolarHBondContact O-CD1 3.07Å; Y208-Y212 PolarHBondContact O-N 2.9Å |
| 209 | F | 97.4 | Very high | 93.9 | Very high | 15 Ų | 15 | 58.2 Ų | 58.2 | 7% | 0.066 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -53.6 | -51.5 | 177.1 | 179 | -92.7 | 0 | 0 | 0 | 112.3 | M164 P166 I167 W187 T205 E206 Y212 S213 | M164-F209 HydrophobicContact CE-CZ 4.42Å; M164-F209 HydrophobicContact SD-CE2 4.24Å; M164-F209 HydrophobicContact SD-CZ 3.89Å; P166-F209 HydrophobicContact CB-CD2 3.93Å; P166-F209 HydrophobicContact CB-CE2 4.42Å; P166-F209 HydrophobicContact CG-CD2 4.12Å; I167-F209 HydrophobicContact CD1-CE1 3.78Å; I167-F209 HydrophobicContact CD1-CE2 4.1Å; I167-F209 HydrophobicContact CD1-CZ 3.3Å; I167-F209 HydrophobicContact CG1-CE1 4.09Å; I167-F209 HydrophobicContact CG1-CE2 3.9Å; I167-F209 HydrophobicContact CG1-CZ 3.56Å; W187-F209 HydrophobicContact CH2-CB 3.7Å; W187-F209 AromaticContact CH2-CD1 3.48Å; W187-F209 HydrophobicContact CH2-CD1 3.48Å; W187-F209 VanDerWaalsContact CH2-CD1 3.48Å; W187-F209 AromaticContact CH2-CD2 3.73Å; W187-F209 HydrophobicContact CH2-CD2 3.73Å; W187-F209 HydrophobicContact CH2-CE1 4.09Å; W187-F209 HydrophobicContact CH2-CE2 4.34Å; W187-F209 AromaticContact CH2-CG 3.31Å; W187-F209 HydrophobicContact CH2-CG 3.31Å; W187-F209 HydrophobicContact CZ2-CB 4.34Å; W187-F209 AromaticContact CZ2-CD1 3.64Å; W187-F209 HydrophobicContact CZ2-CD1 3.64Å; W187-F209 HydrophobicContact CZ2-CE1 4.19Å; W187-F209 AromaticContact CZ2-CG 3.95Å; W187-F209 HydrophobicContact CZ2-CG 3.95Å; W187-F209 HydrophobicContact CZ3-CB 4.04Å; W187-F209 HydrophobicContact CZ3-CD2 4.38Å; W187-F209 HydrophobicContact CZ3-CG 4.07Å; T205-F209 WeakPolarHBondContact O-CB 3.3Å; T205-F209 PolarHBondContact O-N 3.38Å; E206-F209 PolarHBondContact O-N 3.28Å; F209-Y212 HydrophobicContact CB-CE1 4.29Å; F209-Y212 HydrophobicContact CD2-CE1 4.2Å; F209-Y212 HydrophobicContact CD2-CE2 4.36Å; F209-Y212 AromaticContact CD2-CZ 3.62Å; F209-Y212 WeakPolarHBondContact CD2-OH 3.28Å; F209-Y212 HydrophobicContact CE2-CE2 4.44Å; F209-Y212 WeakPolarHBondContact CE2-OH 2.99Å; F209-S213 WeakPolarHBondContact CZ-OG 3.27Å; F209-S213 WeakPolarHBondContact O-CB 3.27Å; F209-S213 PolarHBondContact O-N 3.21Å; F209-S213 PolarHBondContact O-OG 3.11Å |
| 210 | T | 96.9 | Very high | 94.4 | Very high | 9 Ų | 9 | 57.5 Ų | 57.5 | 6% | 0.055 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -64.1 | -44 | -177.8 | -59.8 | 0 | 0 | 0 | 0 | 110.9 | E206 H207 Y208 F214 W277 N280 L281 V284 | E206-T210 VanDerWaalsContact O-CB 3.26Å; E206-T210 WeakPolarHBondContact O-CB 3.45Å; E206-T210 PolarHBondContact O-N 3.47Å; E206-T210 PolarHBondContact O-OG1 2.94Å; H207-T210 PolarHBondContact O-N 3.18Å; Y208-T210 VanDerWaalsContact C-N 3.35Å; Y208-T210 PolarHBondContact O-N 3.43Å; T210-F214 VanDerWaalsContact O-CB 3.24Å; T210-F214 WeakPolarHBondContact O-CB 3.17Å; T210-F214 PolarHBondContact O-N 2.94Å; T210-W277 HydrophobicContact CG2-CZ3 4.4Å; T210-N280 HydrophobicContact CG2-CB 4.48Å; T210-L281 HydrophobicContact CG2-CD2 4.17Å; T210-V284 HydrophobicContact CG2-CB 4.42Å; T210-V284 HydrophobicContact CG2-CG2 4.15Å |
| 211 | L | 97.5 | Very high | 94.9 | Very high | 86 Ų | 86 | 52 Ų | 52 | 45% | 0.45 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -66.3 | -50.4 | -177.5 | -174.5 | 64.6 | 0 | 0 | 0 | 112.3 | H207 Y208 S213 F214 V215 F285 | H207-L211 VanDerWaalsContact O-CB 3.32Å; H207-L211 WeakPolarHBondContact O-CB 3.41Å; H207-L211 PolarHBondContact O-N 3.04Å; Y208-L211 PolarHBondContact O-N 3.5Å; L211-S213 VanDerWaalsContact C-N 3.33Å; L211-S213 PolarHBondContact O-N 3.22Å; L211-F214 WeakPolarHBondContact O-CB 3.11Å; L211-F214 PolarHBondContact O-N 2.98Å; L211-V215 WeakPolarHBondContact O-CG2 3Å; L211-V215 PolarHBondContact O-N 2.9Å; L211-V215 VanDerWaalsContact O-N 3.08Å; L211-F285 HydrophobicContact CB-CZ 4.37Å |
| 212 | Y | 97.6 | Very high | 95.4 | Very high | 67 Ų | 67 | 48.1 Ų | 48.1 | 26% | 0.263 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -69.3 | -35.2 | 179.8 | 76.4 | -114.1 | 0 | 0 | 0 | 111.3 | L163 Y208 F209 F214 V215 L216 | L163-Y212 HydrophobicContact CB-CE2 4.44Å; L163-Y212 HydrophobicContact CD2-CD2 4.35Å; L163-Y212 HydrophobicContact CD2-CE2 4.22Å; L163-Y212 PolarHBondContact O-OH 3.41Å; Y208-Y212 WeakPolarHBondContact O-CD1 3.07Å; Y208-Y212 PolarHBondContact O-N 2.9Å; F209-Y212 HydrophobicContact CB-CE1 4.29Å; F209-Y212 HydrophobicContact CD2-CE1 4.2Å; F209-Y212 HydrophobicContact CD2-CE2 4.36Å; F209-Y212 AromaticContact CD2-CZ 3.62Å; F209-Y212 WeakPolarHBondContact CD2-OH 3.28Å; F209-Y212 HydrophobicContact CE2-CE2 4.44Å; F209-Y212 WeakPolarHBondContact CE2-OH 2.99Å; Y212-F214 VanDerWaalsContact C-N 3.33Å; Y212-V215 PolarHBondContact O-N 3.27Å; Y212-L216 HydrophobicContact CD2-CD1 4.23Å; Y212-L216 VanDerWaalsContact O-CB 3.28Å; Y212-L216 WeakPolarHBondContact O-CB 3.25Å; Y212-L216 VanDerWaalsContact O-CG 3.29Å; Y212-L216 WeakPolarHBondContact O-CG 3.24Å; Y212-L216 PolarHBondContact O-N 3.27Å |
| 213 | S | 97.5 | Very high | 95.8 | Very high | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -67.1 | -38.3 | 178 | -61.9 | 0 | 0 | 0 | 0 | 110.6 | F209 L211 V215 C217 | F209-S213 WeakPolarHBondContact CZ-OG 3.27Å; F209-S213 WeakPolarHBondContact O-CB 3.27Å; F209-S213 PolarHBondContact O-N 3.21Å; F209-S213 PolarHBondContact O-OG 3.11Å; L211-S213 VanDerWaalsContact C-N 3.33Å; L211-S213 PolarHBondContact O-N 3.22Å; S213-V215 PolarHBondContact O-N 3.37Å; S213-C217 WeakPolarHBondContact O-CA 3.42Å; S213-C217 WeakPolarHBondContact O-CB 3.18Å; S213-C217 PolarHBondContact O-N 3.2Å |
| 214 | F | 97.8 | Very high | 96 | Very high | 42 Ų | 42 | 49.7 Ų | 49.7 | 18% | 0.184 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.2 | -48.9 | 172.2 | 168.6 | -108.9 | 0 | 0 | 0 | 111.1 | T210 L211 Y212 F218 L219 W277 L281 | T210-F214 VanDerWaalsContact O-CB 3.24Å; T210-F214 WeakPolarHBondContact O-CB 3.17Å; T210-F214 PolarHBondContact O-N 2.94Å; L211-F214 WeakPolarHBondContact O-CB 3.11Å; L211-F214 PolarHBondContact O-N 2.98Å; Y212-F214 VanDerWaalsContact C-N 3.33Å; F214-F218 AromaticContact CD2-CD1 3.69Å; F214-F218 HydrophobicContact CD2-CD1 3.69Å; F214-F218 HydrophobicContact CD2-CE1 4.35Å; F214-F218 AromaticContact CE2-CD1 3.4Å; F214-F218 HydrophobicContact CE2-CD1 3.4Å; F214-F218 AromaticContact CE2-CE1 3.64Å; F214-F218 HydrophobicContact CE2-CE1 3.64Å; F214-F218 HydrophobicContact CZ-CD1 4.31Å; F214-F218 HydrophobicContact CZ-CE1 4.42Å; F214-F218 WeakPolarHBondContact O-CB 3.22Å; F214-F218 PolarHBondContact O-N 3.46Å; F214-L219 HydrophobicContact CE1-CB 4.46Å; F214-L219 HydrophobicContact CE1-CD2 4.21Å; F214-L219 PolarHBondContact O-N 3.39Å; F214-W277 VanDerWaalsContact CA-CZ3 3.49Å; F214-W277 HydrophobicContact CB-CD2 4.2Å; F214-W277 HydrophobicContact CB-CE3 3.59Å; F214-W277 HydrophobicContact CB-CH2 4.24Å; F214-W277 HydrophobicContact CB-CZ3 3.64Å; F214-W277 HydrophobicContact CD2-CB 3.74Å; F214-W277 AromaticContact CD2-CD2 3.77Å; F214-W277 HydrophobicContact CD2-CD2 3.77Å; F214-W277 AromaticContact CD2-CE3 3.81Å; F214-W277 HydrophobicContact CD2-CE3 3.81Å; F214-W277 AromaticContact CD2-CG 3.76Å; F214-W277 HydrophobicContact CD2-CG 3.76Å; F214-W277 HydrophobicContact CE2-CB 3.96Å; F214-W277 HydrophobicContact CE2-CG 4.33Å; F214-W277 HydrophobicContact CG-CD2 4.49Å; F214-W277 HydrophobicContact CG-CE3 4.19Å; F214-L281 HydrophobicContact CB-CD2 4.47Å; F214-L281 HydrophobicContact CD1-CD1 4.28Å; F214-L281 HydrophobicContact CD2-CD1 3.85Å; F214-L281 HydrophobicContact CE1-CD1 4.27Å; F214-L281 HydrophobicContact CE2-CD1 3.81Å; F214-L281 HydrophobicContact CG-CD1 4.07Å; F214-L281 HydrophobicContact CG-CD2 4.42Å; F214-L281 HydrophobicContact CZ-CD1 4.03Å |
| 215 | V | 97.9 | Very high | 96 | Very high | 50 Ų | 50 | 47.4 Ų | 47.4 | 30% | 0.303 | 23% | 0.233 | S | C | . | . | I | π-helix | trans | -67.1 | -53.1 | -178 | 174.5 | 0 | 0 | 0 | 0 | 111.4 | L211 Y212 S213 L219 I220 | L211-V215 WeakPolarHBondContact O-CG2 3Å; L211-V215 PolarHBondContact O-N 2.9Å; L211-V215 VanDerWaalsContact O-N 3.08Å; Y212-V215 PolarHBondContact O-N 3.27Å; S213-V215 PolarHBondContact O-N 3.37Å; V215-L219 PolarHBondContact O-N 2.98Å; V215-I220 HydrophobicContact CG1-CD1 4.11Å; V215-I220 HydrophobicContact CG1-CG1 4.31Å; V215-I220 WeakPolarHBondContact O-CB 2.91Å; V215-I220 WeakPolarHBondContact O-CG1 3.37Å; V215-I220 PolarHBondContact O-N 3.49Å |
| 216 | L | 97.2 | Very high | 96 | Very high | 78 Ų | 78 | 49.8 Ų | 49.8 | 41% | 0.408 | 24% | 0.243 | S | C | . | . | I | π-helix | trans | -79.2 | -37.2 | -170.8 | -62.2 | 179.5 | 0 | 0 | 0 | 113 | L163 Y212 I220 P221 | L163-L216 HydrophobicContact CD1-CB 4.35Å; L163-L216 HydrophobicContact CD1-CD1 4.02Å; L163-L216 HydrophobicContact CD2-CD1 3.69Å; Y212-L216 HydrophobicContact CD2-CD1 4.23Å; Y212-L216 VanDerWaalsContact O-CB 3.28Å; Y212-L216 WeakPolarHBondContact O-CB 3.25Å; Y212-L216 VanDerWaalsContact O-CG 3.29Å; Y212-L216 WeakPolarHBondContact O-CG 3.24Å; Y212-L216 PolarHBondContact O-N 3.27Å; L216-I220 HydrophobicContact CD2-CD1 3.87Å; L216-P221 VanDerWaalsContact O-CD 3.26Å; L216-P221 WeakPolarHBondContact O-CD 3.5Å |
| 217 | C | 95.7 | Very high | 95.9 | Very high | 8 Ų | 8 | 53.1 Ų | 53.1 | 5% | 0.054 | 26% | 0.257 | C | S | . | . | I | π-helix | trans | -100 | -7 | -174.1 | -53 | 0 | 0 | 0 | 0 | 113.5 | Y117 V120 S213 | Y117-C217 HydrophobicContact CD1-CB 3.44Å; Y117-C217 VanDerWaalsContact CD1-CB 3.44Å; Y117-C217 HydrophobicContact CE1-CB 3.87Å; Y117-C217 HydrophobicContact CG-CB 3.86Å; V120-C217 WeakPolarHBondContact CG1-O 3.2Å; S213-C217 WeakPolarHBondContact O-CA 3.42Å; S213-C217 WeakPolarHBondContact O-CB 3.18Å; S213-C217 PolarHBondContact O-N 3.2Å |
| 218 | F | 95.9 | Very high | 95.8 | Very high | 15 Ų | 15 | 51.2 Ų | 51.2 | 7% | 0.066 | 25% | 0.249 | C | C | . | . | I | π-helix | trans | -134.8 | -55.8 | 175.6 | 168.9 | -99.6 | 0 | 0 | 0 | 115 | F214 S222 Y269 W273 T274 W277 | F214-F218 AromaticContact CD2-CD1 3.69Å; F214-F218 HydrophobicContact CD2-CD1 3.69Å; F214-F218 HydrophobicContact CD2-CE1 4.35Å; F214-F218 AromaticContact CE2-CD1 3.4Å; F214-F218 HydrophobicContact CE2-CD1 3.4Å; F214-F218 AromaticContact CE2-CE1 3.64Å; F214-F218 HydrophobicContact CE2-CE1 3.64Å; F214-F218 HydrophobicContact CZ-CD1 4.31Å; F214-F218 HydrophobicContact CZ-CE1 4.42Å; F214-F218 WeakPolarHBondContact O-CB 3.22Å; F214-F218 PolarHBondContact O-N 3.46Å; F218-S222 WeakPolarHBondContact O-CB 3.39Å; F218-S222 PolarHBondContact O-N 3.33Å; F218-S222 PolarHBondContact O-OG 3.38Å; F218-Y269 HydrophobicContact CD2-CE1 4.37Å; F218-Y269 AromaticContact CD2-CZ 3.87Å; F218-Y269 VanDerWaalsContact CD2-OH 3.23Å; F218-Y269 WeakPolarHBondContact CD2-OH 2.88Å; F218-Y269 HydrophobicContact CE2-CE1 4.31Å; F218-Y269 PolarHBondContact O-OH 2.67Å; F218-W273 HydrophobicContact CD2-CB 3.72Å; F218-W273 HydrophobicContact CE2-CB 3.65Å; F218-T274 HydrophobicContact CZ-CG2 4.46Å; F218-T274 WeakPolarHBondContact CZ-OG1 3.33Å; F218-W277 HydrophobicContact CB-CD2 4.3Å; F218-W277 HydrophobicContact CB-CG 4.14Å; F218-W277 HydrophobicContact CB-CZ2 4.26Å; F218-W277 HydrophobicContact CD1-CB 4.28Å; F218-W277 AromaticContact CD1-CD1 3.62Å; F218-W277 AromaticContact CD1-CG 3.95Å; F218-W277 HydrophobicContact CD1-CG 3.95Å; F218-W277 AromaticContact CD2-CD1 3.39Å; F218-W277 HydrophobicContact CD2-CG 4.43Å; F218-W277 AromaticContact CD2-NE1 3.8Å; F218-W277 HydrophobicContact CE1-CB 4.4Å; F218-W277 HydrophobicContact CE1-CG 4.49Å; F218-W277 AromaticContact CG-CD1 3.16Å; F218-W277 AromaticContact CG-CG 3.92Å; F218-W277 HydrophobicContact CG-CG 3.92Å; F218-W277 AromaticContact CG-NE1 3.45Å |
| 219 | L | 96.9 | Very high | 95.4 | Very high | 67 Ų | 67 | 46.4 Ų | 46.4 | 35% | 0.351 | 23% | 0.23 | S | C | . | . | I | π-helix | trans | -64 | -51 | -172.7 | -175.3 | 61.5 | 0 | 0 | 0 | 111.7 | F214 V215 S222 I223 | F214-L219 HydrophobicContact CE1-CB 4.46Å; F214-L219 HydrophobicContact CE1-CD2 4.21Å; F214-L219 PolarHBondContact O-N 3.39Å; V215-L219 PolarHBondContact O-N 2.98Å; L219-S222 WeakPolarHBondContact O-CB 3.37Å; L219-S222 PolarHBondContact O-N 2.87Å; L219-I223 HydrophobicContact CD1-CD1 4.19Å; L219-I223 HydrophobicContact CG-CD1 4.03Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.26Å; L219-I223 PolarHBondContact O-N 2.92Å |
| 220 | I | 96.2 | Very high | 95.2 | Very high | 73 Ų | 73 | 51.8 Ų | 51.8 | 37% | 0.374 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -60.9 | -52.4 | 177.4 | -69.5 | 174.4 | 0 | 0 | 0 | 111.1 | V215 L216 S222 I223 I224 | V215-I220 HydrophobicContact CG1-CD1 4.11Å; V215-I220 HydrophobicContact CG1-CG1 4.31Å; V215-I220 WeakPolarHBondContact O-CB 2.91Å; V215-I220 WeakPolarHBondContact O-CG1 3.37Å; V215-I220 PolarHBondContact O-N 3.49Å; L216-I220 HydrophobicContact CD2-CD1 3.87Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 2.92Å; I220-I223 PolarHBondContact O-N 3.5Å; I220-I224 HydrophobicContact CG2-CD1 3.78Å; I220-I224 HydrophobicContact CG2-CG1 4.47Å; I220-I224 WeakPolarHBondContact O-CG1 3.43Å; I220-I224 PolarHBondContact O-N 3.24Å |
| 221 | P | 95.2 | Very high | 94.8 | Very high | 13 Ų | 13 | 54.3 Ų | 54.3 | 8% | 0.084 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -52.9 | -43.1 | 172.9 | -31.8 | 37.4 | 0 | 0 | 0 | 114.1 | V120 S124 L216 I224 M225 | V120-P221 HydrophobicContact CG1-CB 3.54Å; V120-P221 HydrophobicContact CG1-CG 3.96Å; S124-P221 WeakPolarHBondContact OG-CB 3.37Å; L216-P221 VanDerWaalsContact O-CD 3.26Å; L216-P221 WeakPolarHBondContact O-CD 3.5Å; P221-I224 PolarHBondContact O-N 2.86Å; P221-M225 HydrophobicContact CB-CE 4.01Å; P221-M225 WeakPolarHBondContact O-CB 3.17Å; P221-M225 VanDerWaalsContact O-CE 3.28Å; P221-M225 WeakPolarHBondContact O-CE 3.22Å; P221-M225 WeakPolarHBondContact O-CG 3.47Å; P221-M225 PolarHBondContact O-N 3.46Å |
| 222 | S | 95.2 | Very high | 94.4 | Very high | 7 Ų | 7 | 50.3 Ų | 50.3 | 5% | 0.049 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61.2 | -47.6 | 178 | -63.9 | 0 | 0 | 0 | 0 | 111.7 | F218 L219 I220 I224 M225 I226 Y269 | F218-S222 WeakPolarHBondContact O-CB 3.39Å; F218-S222 PolarHBondContact O-N 3.33Å; F218-S222 PolarHBondContact O-OG 3.38Å; L219-S222 WeakPolarHBondContact O-CB 3.37Å; L219-S222 PolarHBondContact O-N 2.87Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 2.92Å; S222-I224 VanDerWaalsContact C-N 3.34Å; S222-I224 PolarHBondContact O-N 2.93Å; S222-M225 PolarHBondContact O-N 3.2Å; S222-I226 WeakPolarHBondContact O-CB 3.44Å; S222-I226 VanDerWaalsContact O-CG1 3.23Å; S222-I226 WeakPolarHBondContact O-CG1 3.36Å; S222-I226 PolarHBondContact O-N 3.4Å; S222-Y269 WeakPolarHBondContact OG-CE1 3.48Å; S222-Y269 PolarHBondContact OG-OH 2.88Å |
| 223 | I | 95.7 | Very high | 93.9 | Very high | 102 Ų | 102 | 48.1 Ų | 48.1 | 52% | 0.523 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -60.6 | -46 | 177.3 | -68.8 | 166 | 0 | 0 | 0 | 110.2 | L219 I220 M225 I226 F227 | L219-I223 HydrophobicContact CD1-CD1 4.19Å; L219-I223 HydrophobicContact CG-CD1 4.03Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.26Å; L219-I223 PolarHBondContact O-N 2.92Å; I220-I223 PolarHBondContact O-N 3.5Å; I223-M225 PolarHBondContact O-N 2.89Å; I223-I226 PolarHBondContact O-N 3.2Å; I223-F227 WeakPolarHBondContact O-CB 3.44Å; I223-F227 PolarHBondContact O-N 2.98Å |
| 224 | I | 93.8 | Very high | 93.5 | Very high | 60 Ų | 60 | 54.8 Ų | 54.8 | 31% | 0.308 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -58.5 | -47.8 | 177.1 | -69.7 | 169 | 0 | 0 | 0 | 110.5 | I128 I220 P221 S222 F227 C228 | I128-I224 HydrophobicContact CD1-CG2 3.81Å; I128-I224 HydrophobicContact CG1-CG2 3.97Å; I220-I224 HydrophobicContact CG2-CD1 3.78Å; I220-I224 HydrophobicContact CG2-CG1 4.47Å; I220-I224 WeakPolarHBondContact O-CG1 3.43Å; I220-I224 PolarHBondContact O-N 3.24Å; P221-I224 PolarHBondContact O-N 2.86Å; S222-I224 VanDerWaalsContact C-N 3.34Å; S222-I224 PolarHBondContact O-N 2.93Å; I224-F227 PolarHBondContact O-N 3.41Å; I224-C228 WeakPolarHBondContact O-CB 3.38Å; I224-C228 PolarHBondContact O-N 3.25Å; I224-C228 PolarHBondContact O-SG 3.37Å |
| 225 | M | 92 | Very high | 92.7 | Very high | 1 Ų | 1 | 54.6 Ų | 54.6 | 1% | 0.005 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.6 | -44.9 | -179.6 | -78.7 | -174.8 | -82.5 | 0 | 0 | 112.7 | V120 I123 P221 S222 I223 C228 Y229 V266 Y269 | V120-M225 HydrophobicContact CG1-CE 4.42Å; I123-M225 HydrophobicContact CB-SD 4.46Å; I123-M225 HydrophobicContact CG2-SD 3.57Å; I123-M225 VanDerWaalsContact CG2-SD 3.57Å; P221-M225 HydrophobicContact CB-CE 4.01Å; P221-M225 WeakPolarHBondContact O-CB 3.17Å; P221-M225 VanDerWaalsContact O-CE 3.28Å; P221-M225 WeakPolarHBondContact O-CE 3.22Å; P221-M225 WeakPolarHBondContact O-CG 3.47Å; P221-M225 PolarHBondContact O-N 3.46Å; S222-M225 PolarHBondContact O-N 3.2Å; I223-M225 PolarHBondContact O-N 2.89Å; M225-C228 PolarHBondContact O-N 3.48Å; M225-Y229 VanDerWaalsContact O-CB 3.31Å; M225-Y229 WeakPolarHBondContact O-CB 3.48Å; M225-Y229 PolarHBondContact O-N 3.18Å; M225-V266 HydrophobicContact CB-CG1 4.49Å; M225-V266 HydrophobicContact CB-CG2 4.24Å; M225-Y269 HydrophobicContact CE-CD1 3.36Å; M225-Y269 HydrophobicContact CE-CD2 4.16Å; M225-Y269 HydrophobicContact CE-CE1 3.08Å; M225-Y269 HydrophobicContact CE-CE2 3.93Å; M225-Y269 HydrophobicContact CE-CG 3.91Å; M225-Y269 HydrophobicContact SD-CD1 3.99Å; M225-Y269 HydrophobicContact SD-CE1 4.29Å; M225-Y269 HydrophobicContact SD-CG 4.26Å |
| 226 | I | 93.8 | Very high | 91.9 | Very high | 86 Ų | 86 | 53.6 Ų | 53.6 | 44% | 0.441 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 177.8 | -69 | 166 | 0 | 0 | 0 | 110.3 | S222 I223 Y229 Y230 L270 | S222-I226 WeakPolarHBondContact O-CB 3.44Å; S222-I226 VanDerWaalsContact O-CG1 3.23Å; S222-I226 WeakPolarHBondContact O-CG1 3.36Å; S222-I226 PolarHBondContact O-N 3.4Å; I223-I226 PolarHBondContact O-N 3.2Å; I226-Y229 PolarHBondContact O-N 3.42Å; I226-Y230 PolarHBondContact O-N 3.48Å; I226-L270 HydrophobicContact CD1-CD1 4.21Å; I226-L270 HydrophobicContact CG1-CD1 4.27Å |
| 227 | F | 93.4 | Very high | 91.3 | Very high | 121 Ų | 121 | 53.6 Ų | 53.6 | 53% | 0.531 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -64.2 | -45.7 | 178 | -179.8 | -109.9 | 0 | 0 | 0 | 111.9 | I223 I224 Y229 Y230 L231 | I223-F227 WeakPolarHBondContact O-CB 3.44Å; I223-F227 PolarHBondContact O-N 2.98Å; I224-F227 PolarHBondContact O-N 3.41Å; F227-Y229 VanDerWaalsContact C-N 3.32Å; F227-Y229 PolarHBondContact O-N 3.3Å; F227-Y230 WeakPolarHBondContact O-CB 3.36Å; F227-Y230 PolarHBondContact O-N 2.87Å; F227-L231 HydrophobicContact CD1-CD1 4.02Å; F227-L231 HydrophobicContact CD1-CG 4.48Å; F227-L231 HydrophobicContact CE1-CD1 3.47Å; F227-L231 VanDerWaalsContact CE1-CD1 3.47Å; F227-L231 HydrophobicContact CE1-CG 4.14Å; F227-L231 HydrophobicContact CE2-CD1 4.48Å; F227-L231 HydrophobicContact CE2-CD2 4.35Å; F227-L231 HydrophobicContact CE2-CG 4.34Å; F227-L231 HydrophobicContact CZ-CD1 3.74Å; F227-L231 HydrophobicContact CZ-CD2 4.15Å; F227-L231 HydrophobicContact CZ-CG 4.06Å; F227-L231 WeakPolarHBondContact O-CG 3.4Å; F227-L231 PolarHBondContact O-N 3.14Å |
| 228 | C | 91.4 | Very high | 90.6 | Very high | 9 Ų | 9 | 56.3 Ų | 56.3 | 6% | 0.061 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -54.6 | -50 | 172.6 | -78.3 | 0 | 0 | 0 | 0 | 110.7 | I128 C131 I224 M225 Y230 L231 L232 | I128-C228 VanDerWaalsContact CG1-SG 3.53Å; C131-C228 WeakPolarHBondContact SG-CA 3.13Å; C131-C228 WeakPolarHBondContact SG-CB 3.02Å; C131-C228 PolarHBondContact SG-O 3.38Å; I224-C228 WeakPolarHBondContact O-CB 3.38Å; I224-C228 PolarHBondContact O-N 3.25Å; I224-C228 PolarHBondContact O-SG 3.37Å; M225-C228 PolarHBondContact O-N 3.48Å; C228-Y230 PolarHBondContact O-N 3.45Å; C228-L231 PolarHBondContact O-N 3.37Å; C228-L232 WeakPolarHBondContact O-CB 3.42Å; C228-L232 PolarHBondContact O-N 2.89Å |
| 229 | Y | 89.2 | Confident | 89.6 | Confident | 65 Ų | 65 | 56.6 Ų | 56.6 | 26% | 0.255 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -58.9 | -45.8 | 178 | 171 | -112.7 | 0 | 0 | 0 | 112.6 | M225 I226 F227 L231 L232 V233 V262 I263 | M225-Y229 VanDerWaalsContact O-CB 3.31Å; M225-Y229 WeakPolarHBondContact O-CB 3.48Å; M225-Y229 PolarHBondContact O-N 3.18Å; I226-Y229 PolarHBondContact O-N 3.42Å; F227-Y229 VanDerWaalsContact C-N 3.32Å; F227-Y229 PolarHBondContact O-N 3.3Å; Y229-L231 VanDerWaalsContact C-N 3.33Å; Y229-L231 PolarHBondContact O-N 2.87Å; Y229-L232 WeakPolarHBondContact O-CB 3.43Å; Y229-L232 PolarHBondContact O-N 2.84Å; Y229-V233 HydrophobicContact CD2-CG2 3.82Å; Y229-V233 HydrophobicContact CE1-CG2 4.08Å; Y229-V233 HydrophobicContact CE2-CG2 3.13Å; Y229-V233 HydrophobicContact CG-CG2 4.48Å; Y229-V233 WeakPolarHBondContact O-CG2 3.19Å; Y229-V233 PolarHBondContact O-N 3.12Å; Y229-V233 WeakPolarHBondContact OH-CG2 3.23Å; Y229-V262 HydrophobicContact CD2-CG1 4.33Å; Y229-I263 HydrophobicContact CD2-CG1 4Å; Y229-I263 HydrophobicContact CE2-CB 4.4Å; Y229-I263 HydrophobicContact CE2-CD1 3.73Å; Y229-I263 HydrophobicContact CE2-CG1 3.09Å; Y229-I263 VanDerWaalsContact CZ-CG1 3.42Å; Y229-I263 WeakPolarHBondContact OH-CD1 3.5Å; Y229-I263 VanDerWaalsContact OH-CG1 3.32Å; Y229-I263 WeakPolarHBondContact OH-CG1 3.41Å |
| 230 | Y | 91.8 | Very high | 88.2 | Confident | 129 Ų | 129 | 55.9 Ų | 55.9 | 51% | 0.506 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -55.5 | -47.9 | 175.1 | 167.2 | -106.6 | 0 | 0 | 0 | 111.8 | I226 F227 C228 L232 V233 R234 | I226-Y230 PolarHBondContact O-N 3.48Å; F227-Y230 WeakPolarHBondContact O-CB 3.36Å; F227-Y230 PolarHBondContact O-N 2.87Å; C228-Y230 PolarHBondContact O-N 3.45Å; Y230-L232 PolarHBondContact O-N 3.11Å; Y230-V233 PolarHBondContact O-N 3.42Å; Y230-R234 WeakPolarHBondContact O-CB 3.31Å; Y230-R234 PolarHBondContact O-N 3.3Å |
| 231 | L | 90.3 | Very high | 86.8 | Confident | 62 Ų | 62 | 61.6 Ų | 61.6 | 33% | 0.325 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61.9 | -42.7 | 176.6 | -67.4 | -176.9 | 0 | 0 | 0 | 112.2 | F227 C228 Y229 R234 Q235 | F227-L231 HydrophobicContact CD1-CD1 4.02Å; F227-L231 HydrophobicContact CD1-CG 4.48Å; F227-L231 HydrophobicContact CE1-CD1 3.47Å; F227-L231 VanDerWaalsContact CE1-CD1 3.47Å; F227-L231 HydrophobicContact CE1-CG 4.14Å; F227-L231 HydrophobicContact CE2-CD1 4.48Å; F227-L231 HydrophobicContact CE2-CD2 4.35Å; F227-L231 HydrophobicContact CE2-CG 4.34Å; F227-L231 HydrophobicContact CZ-CD1 3.74Å; F227-L231 HydrophobicContact CZ-CD2 4.15Å; F227-L231 HydrophobicContact CZ-CG 4.06Å; F227-L231 WeakPolarHBondContact O-CG 3.4Å; F227-L231 PolarHBondContact O-N 3.14Å; C228-L231 PolarHBondContact O-N 3.37Å; Y229-L231 VanDerWaalsContact C-N 3.33Å; Y229-L231 PolarHBondContact O-N 2.87Å; L231-R234 PolarHBondContact O-N 2.86Å; L231-Q235 VanDerWaalsContact O-CB 3.24Å; L231-Q235 WeakPolarHBondContact O-CB 3.3Å; L231-Q235 PolarHBondContact O-N 3.4Å |
| 232 | L | 87.2 | Confident | 85.1 | Confident | 1 Ų | 1 | 69.5 Ų | 69.5 | 1% | 0.005 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -60.3 | -48.2 | 177.3 | -176.1 | 150.1 | 0 | 0 | 0 | 110.9 | R130 C228 Y229 Y230 Q235 V236 K259 V262 | R130-L232 HydrophobicContact CB-CD1 4.01Å; C228-L232 WeakPolarHBondContact O-CB 3.42Å; C228-L232 PolarHBondContact O-N 2.89Å; Y229-L232 WeakPolarHBondContact O-CB 3.43Å; Y229-L232 PolarHBondContact O-N 2.84Å; Y230-L232 PolarHBondContact O-N 3.11Å; L232-Q235 PolarHBondContact O-N 2.89Å; L232-V236 HydrophobicContact CD2-CG2 4.27Å; L232-V236 WeakPolarHBondContact O-CB 3.42Å; L232-V236 VanDerWaalsContact O-CG2 3.26Å; L232-V236 WeakPolarHBondContact O-CG2 3.31Å; L232-V236 PolarHBondContact O-N 3.04Å; L232-K259 HydrophobicContact CD2-CB 4.14Å; L232-K259 HydrophobicContact CD2-CG 4.28Å; L232-V262 HydrophobicContact CD1-CB 4.42Å; L232-V262 HydrophobicContact CD1-CG1 4.38Å; L232-V262 HydrophobicContact CD1-CG2 4.04Å |
| 233 | V | 87.8 | Confident | 83.1 | Confident | 22 Ų | 22 | 72.7 Ų | 72.7 | 13% | 0.133 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -64.1 | -48.2 | 179.5 | 172.7 | 0 | 0 | 0 | 0 | 111.4 | Y229 Y230 Q235 V236 I237 K259 | Y229-V233 HydrophobicContact CD2-CG2 3.82Å; Y229-V233 HydrophobicContact CE1-CG2 4.08Å; Y229-V233 HydrophobicContact CE2-CG2 3.13Å; Y229-V233 HydrophobicContact CG-CG2 4.48Å; Y229-V233 WeakPolarHBondContact O-CG2 3.19Å; Y229-V233 PolarHBondContact O-N 3.12Å; Y229-V233 WeakPolarHBondContact OH-CG2 3.23Å; Y230-V233 PolarHBondContact O-N 3.42Å; V233-Q235 VanDerWaalsContact C-N 3.29Å; V233-Q235 PolarHBondContact O-N 3.01Å; V233-V236 PolarHBondContact O-N 2.81Å; V233-I237 HydrophobicContact CG1-CD1 3.64Å; V233-I237 HydrophobicContact CG1-CG1 4.32Å; V233-I237 WeakPolarHBondContact O-CG1 3.37Å; V233-I237 PolarHBondContact O-N 3.35Å; V233-K259 HydrophobicContact CG2-CD 4.31Å; V233-K259 HydrophobicContact CG2-CG 4.45Å |
| 234 | R | 88.2 | Confident | 81.2 | Confident | 140 Ų | 140 | 77.9 Ų | 77.9 | 53% | 0.528 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -56.7 | -46.6 | 177.7 | -177.2 | -179.4 | 168.2 | -164.4 | -1.3 | 110.6 | Y230 L231 V236 I237 M238 | Y230-R234 WeakPolarHBondContact O-CB 3.31Å; Y230-R234 PolarHBondContact O-N 3.3Å; L231-R234 PolarHBondContact O-N 2.86Å; R234-V236 PolarHBondContact O-N 3.25Å; R234-I237 PolarHBondContact O-N 2.84Å; R234-M238 HydrophobicContact CG-CG 4.33Å; R234-M238 WeakPolarHBondContact O-CB 3.33Å; R234-M238 WeakPolarHBondContact O-CG 3.23Å; R234-M238 PolarHBondContact O-N 3.1Å |
| 235 | Q | 83 | Confident | 79.4 | Confident | 37 Ų | 37 | 84.5 Ų | 84.5 | 17% | 0.173 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -64.5 | -40.2 | 179.2 | -179 | 63.3 | 17 | 0 | 0 | 112.1 | V134 L231 L232 V233 S239 | V134-Q235 HydrophobicContact CG1-CB 4.34Å; V134-Q235 HydrophobicContact CG1-CG 3.72Å; L231-Q235 VanDerWaalsContact O-CB 3.24Å; L231-Q235 WeakPolarHBondContact O-CB 3.3Å; L231-Q235 PolarHBondContact O-N 3.4Å; L232-Q235 PolarHBondContact O-N 2.89Å; V233-Q235 VanDerWaalsContact C-N 3.29Å; V233-Q235 PolarHBondContact O-N 3.01Å; Q235-S239 PolarHBondContact NE2-OG 3.24Å; Q235-S239 WeakPolarHBondContact O-CB 3.47Å; Q235-S239 PolarHBondContact O-N 3.33Å; Q235-S239 PolarHBondContact O-OG 2.69Å |
| 236 | V | 81 | Confident | 77.7 | Confident | 30 Ų | 30 | 91 Ų | 91 | 18% | 0.182 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -64.8 | -42.8 | 176.7 | 169.4 | 0 | 0 | 0 | 0 | 111.2 | V134 L232 V233 R234 S239 G240 Y255 | V134-V236 HydrophobicContact CG1-CG2 4.27Å; L232-V236 HydrophobicContact CD2-CG2 4.27Å; L232-V236 WeakPolarHBondContact O-CB 3.42Å; L232-V236 VanDerWaalsContact O-CG2 3.26Å; L232-V236 WeakPolarHBondContact O-CG2 3.31Å; L232-V236 PolarHBondContact O-N 3.04Å; V233-V236 PolarHBondContact O-N 2.81Å; R234-V236 PolarHBondContact O-N 3.25Å; V236-S239 PolarHBondContact O-N 2.94Å; V236-G240 PolarHBondContact O-N 2.85Å; V236-Y255 HydrophobicContact CG2-CD1 4.39Å |
| 237 | I | 83.5 | Confident | 76.2 | Confident | 78 Ų | 78 | 89.8 Ų | 89.8 | 40% | 0.4 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -64.8 | -49.2 | 177.3 | -67.1 | 169.7 | 0 | 0 | 0 | 110.7 | V233 R234 S239 G240 R241 | V233-I237 HydrophobicContact CG1-CD1 3.64Å; V233-I237 HydrophobicContact CG1-CG1 4.32Å; V233-I237 WeakPolarHBondContact O-CG1 3.37Å; V233-I237 PolarHBondContact O-N 3.35Å; R234-I237 PolarHBondContact O-N 2.84Å; I237-S239 VanDerWaalsContact C-N 3.31Å; I237-S239 PolarHBondContact O-N 2.81Å; I237-G240 PolarHBondContact O-N 3.19Å; I237-G240 VanDerWaalsContact O-N 3.15Å; I237-R241 PolarHBondContact O-N 3.42Å |
| 238 | M | 80.6 | Confident | 75 | Confident | 64 Ų | 64 | 88.5 Ų | 88.5 | 32% | 0.315 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.6 | -40.1 | 178.9 | -69.9 | -61.5 | -67.9 | 0 | 0 | 111.8 | R234 G240 R241 R242 | R234-M238 HydrophobicContact CG-CG 4.33Å; R234-M238 WeakPolarHBondContact O-CB 3.33Å; R234-M238 WeakPolarHBondContact O-CG 3.23Å; R234-M238 PolarHBondContact O-N 3.1Å; M238-G240 VanDerWaalsContact C-N 3.31Å; M238-G240 PolarHBondContact O-N 3.31Å; M238-R241 PolarHBondContact O-N 2.83Å; M238-R242 WeakPolarHBondContact O-CG 3.42Å; M238-R242 PolarHBondContact O-N 3.43Å |
| 239 | S | 74.5 | Confident | 74.2 | Confident | 21 Ų | 21 | 95.5 Ų | 95.5 | 15% | 0.147 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -67.6 | -32.4 | 176.8 | -57.5 | 0 | 0 | 0 | 0 | 112.5 | Q235 V236 I237 | Q235-S239 PolarHBondContact NE2-OG 3.24Å; Q235-S239 WeakPolarHBondContact O-CB 3.47Å; Q235-S239 PolarHBondContact O-N 3.33Å; Q235-S239 PolarHBondContact O-OG 2.69Å; V236-S239 PolarHBondContact O-N 2.94Å; I237-S239 VanDerWaalsContact C-N 3.31Å; I237-S239 PolarHBondContact O-N 2.81Å |
| 240 | G | 69.3 | Low | 73.5 | Confident | 53 Ų | 53 | 96.7 Ų | 96.7 | 55% | 0.546 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -67.3 | -35.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | V236 I237 M238 | V236-G240 PolarHBondContact O-N 2.85Å; I237-G240 PolarHBondContact O-N 3.19Å; I237-G240 VanDerWaalsContact O-N 3.15Å; M238-G240 VanDerWaalsContact C-N 3.31Å; M238-G240 PolarHBondContact O-N 3.31Å |
| 241 | R | 65.1 | Low | 72.6 | Confident | 192 Ų | 192 | 93.7 Ų | 93.7 | 73% | 0.725 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -73.6 | -39.9 | 177.6 | -69.8 | -179.5 | 178.9 | 175.7 | -1.2 | 113 | I237 M238 L243 | I237-R241 PolarHBondContact O-N 3.42Å; M238-R241 PolarHBondContact O-N 2.83Å; R241-L243 PolarHBondContact O-N 2.96Å |
| 242 | R | 60.5 | Low | 71.8 | Confident | 179 Ų | 179 | 99 Ų | 99 | 68% | 0.675 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -73.1 | -20 | -175.3 | -72 | -178.7 | -167.6 | -171.2 | -0.1 | 115.3 | M238 | M238-R242 WeakPolarHBondContact O-CG 3.42Å; M238-R242 PolarHBondContact O-N 3.43Å |
| 243 | L | 53.9 | Low | 71.4 | Confident | 75 Ų | 75 | 102.8 Ų | 102.8 | 39% | 0.393 | 49% | 0.487 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -134.4 | 45.8 | -163.9 | -75.4 | 160.6 | 0 | 0 | 0 | 113.7 | R241 K245 R247 | R241-L243 PolarHBondContact O-N 2.96Å; L243-K245 PolarHBondContact O-N 3.42Å; L243-R247 HydrophobicContact CB-CG 4.41Å; L243-R247 HydrophobicContact CD1-CG 4.3Å |
| 244 | K | 54.5 | Low | 71 | Confident | 211 Ų | 211 | 104.9 Ų | 104.9 | 92% | 0.917 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.5 | -14.5 | 172.5 | -109.4 | -176.4 | 179.3 | -177.5 | 0 | 114.1 | ||
| 245 | K | 56.5 | Low | 70.6 | Confident | 198 Ų | 198 | 99.8 Ų | 99.8 | 86% | 0.861 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.7 | -33.3 | -174 | -150.3 | 170.8 | -179.4 | 179.2 | 0 | 116.4 | L243 | L243-K245 PolarHBondContact O-N 3.42Š|
| 246 | N | 56 | Low | 70.5 | Confident | 137 Ų | 137 | 99 Ų | 99 | 73% | 0.733 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.5 | 0.6 | -164.1 | -72.3 | 5.1 | 0 | 0 | 0 | 117.4 | ||
| 247 | R | 63.2 | Low | 70.6 | Confident | 62 Ų | 62 | 101.8 Ų | 101.8 | 23% | 0.234 | 49% | 0.493 | C | S | . | . | S | Bend | trans | -92.1 | 130 | 170.9 | -78.2 | -151 | -163.9 | -130.2 | 12.7 | 111.5 | L243 Y255 | L243-R247 HydrophobicContact CB-CG 4.41Å; L243-R247 HydrophobicContact CD1-CG 4.3Å; R247-Y255 VanDerWaalsContact NH1-CE2 3.33Å; R247-Y255 PolarHBondContact NH1-OH 2.83Å |
| 248 | T | 67.6 | Low | 70.6 | Confident | 93 Ų | 93 | 99.8 Ų | 99.8 | 57% | 0.571 | 48% | 0.483 | S | S | * | . | trans | -56.2 | 138.3 | 169.1 | 51.5 | 0 | 0 | 0 | 0 | 110.4 | C250 M251 | T248-C250 PolarHBondContact O-N 3.49Å; T248-M251 PolarHBondContact O-N 3.32Å | ||
| 249 | K | 73.8 | Confident | 70.8 | Confident | 157 Ų | 157 | 99.5 Ų | 99.5 | 68% | 0.683 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -42.5 | -32.9 | 171.4 | -178 | 177.8 | 177 | 179.3 | 0 | 112.5 | N253 | K249-N253 VanDerWaalsContact O-CG 3.27Å; K249-N253 PolarHBondContact O-N 3.48Å; K249-N253 VanDerWaalsContact O-N 3.17Å; K249-N253 PolarHBondContact O-OD1 3.2Å |
| 250 | C | 74.9 | Confident | 71.4 | Confident | 89 Ų | 89 | 105 Ų | 105 | 60% | 0.601 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -55.5 | -51.7 | 174 | -173.2 | 0 | 0 | 0 | 0 | 113.8 | T248 R252 N253 S254 | T248-C250 PolarHBondContact O-N 3.49Å; C250-R252 PolarHBondContact O-N 3.44Å; C250-N253 PolarHBondContact O-N 2.99Å; C250-S254 PolarHBondContact O-N 2.99Å |
| 251 | M | 73.3 | Confident | 72.2 | Confident | 67 Ų | 67 | 102.9 Ų | 102.9 | 33% | 0.33 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -63.1 | -42.3 | -178.2 | -73.6 | -61.2 | -71.3 | 0 | 0 | 112 | T248 N253 S254 Y255 | T248-M251 PolarHBondContact O-N 3.32Å; M251-N253 VanDerWaalsContact C-N 3.32Å; M251-N253 PolarHBondContact O-N 3.4Å; M251-S254 WeakPolarHBondContact O-CB 3.4Å; M251-S254 PolarHBondContact O-N 2.91Å; M251-Y255 HydrophobicContact CE-CE2 3.84Å; M251-Y255 WeakPolarHBondContact O-CD2 3.32Å; M251-Y255 PolarHBondContact O-N 3.3Å |
| 252 | R | 74.5 | Confident | 73.2 | Confident | 174 Ų | 174 | 94.1 Ų | 94.1 | 66% | 0.657 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -59.1 | -44.6 | 176.7 | -175.5 | 176.1 | 68.3 | 176.3 | 1.5 | 111.5 | C250 S254 Y255 G256 | C250-R252 PolarHBondContact O-N 3.44Å; R252-S254 VanDerWaalsContact C-N 3.33Å; R252-S254 PolarHBondContact O-N 3.02Å; R252-Y255 PolarHBondContact O-N 3.49Å; R252-G256 PolarHBondContact O-N 3.45Å |
| 253 | N | 78.8 | Confident | 74.5 | Confident | 80 Ų | 80 | 87.8 Ų | 87.8 | 43% | 0.428 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -64.2 | -38.3 | 177.8 | -69.6 | -7.3 | 0 | 0 | 0 | 111.9 | K249 C250 M251 G256 R257 | K249-N253 VanDerWaalsContact O-CG 3.27Å; K249-N253 PolarHBondContact O-N 3.48Å; K249-N253 VanDerWaalsContact O-N 3.17Å; K249-N253 PolarHBondContact O-OD1 3.2Å; C250-N253 PolarHBondContact O-N 2.99Å; M251-N253 VanDerWaalsContact C-N 3.32Å; M251-N253 PolarHBondContact O-N 3.4Å; N253-G256 PolarHBondContact O-N 3.32Å; N253-R257 WeakPolarHBondContact O-CB 3.33Å; N253-R257 PolarHBondContact O-N 3Å |
| 254 | S | 77.7 | Confident | 76.2 | Confident | 65 Ų | 65 | 86.1 Ų | 86.1 | 46% | 0.455 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.6 | -49.3 | 175.9 | -171.1 | 0 | 0 | 0 | 0 | 112.2 | C250 M251 R252 G256 R257 L258 | C250-S254 PolarHBondContact O-N 2.99Å; M251-S254 WeakPolarHBondContact O-CB 3.4Å; M251-S254 PolarHBondContact O-N 2.91Å; R252-S254 VanDerWaalsContact C-N 3.33Å; R252-S254 PolarHBondContact O-N 3.02Å; S254-G256 PolarHBondContact O-N 2.92Å; S254-R257 WeakPolarHBondContact O-CB 3.47Å; S254-R257 PolarHBondContact O-N 3.44Å; S254-L258 PolarHBondContact O-N 3.01Å |
| 255 | Y | 80.3 | Confident | 77.8 | Confident | 33 Ų | 33 | 76.6 Ų | 76.6 | 13% | 0.129 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -63.3 | -40.6 | 176.2 | -73.2 | -67.1 | 0 | 0 | 0 | 112.8 | V134 V236 R247 M251 R252 R257 L258 K259 | V134-Y255 HydrophobicContact CB-CE1 4.29Å; V134-Y255 HydrophobicContact CG1-CD1 4.11Å; V134-Y255 HydrophobicContact CG1-CE1 3.79Å; V134-Y255 HydrophobicContact CG2-CD1 4.16Å; V134-Y255 HydrophobicContact CG2-CE1 3.98Å; V236-Y255 HydrophobicContact CG2-CD1 4.39Å; R247-Y255 VanDerWaalsContact NH1-CE2 3.33Å; R247-Y255 PolarHBondContact NH1-OH 2.83Å; M251-Y255 HydrophobicContact CE-CE2 3.84Å; M251-Y255 WeakPolarHBondContact O-CD2 3.32Å; M251-Y255 PolarHBondContact O-N 3.3Å; R252-Y255 PolarHBondContact O-N 3.49Å; Y255-R257 VanDerWaalsContact C-N 3.26Å; Y255-R257 PolarHBondContact O-N 2.86Å; Y255-L258 PolarHBondContact O-N 3.45Å; Y255-K259 WeakPolarHBondContact O-CB 3.33Å; Y255-K259 PolarHBondContact O-N 3.49Å |
| 256 | G | 82.1 | Confident | 79.4 | Confident | 21 Ų | 21 | 67.5 Ų | 67.5 | 22% | 0.216 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61 | -38 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | R252 N253 S254 R260 | R252-G256 PolarHBondContact O-N 3.45Å; N253-G256 PolarHBondContact O-N 3.32Å; S254-G256 PolarHBondContact O-N 2.92Å; G256-R260 WeakPolarHBondContact O-CG 3.42Å; G256-R260 PolarHBondContact O-N 3.35Å; G256-R260 VanDerWaalsContact O-N 3.13Å; G256-R260 PolarHBondContact O-NH1 3.49Å |
| 257 | R | 83.2 | Confident | 81.2 | Confident | 88 Ų | 88 | 63.9 Ų | 63.9 | 33% | 0.332 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -68.8 | -45.1 | 175.8 | -164.4 | -176 | -61.9 | 160 | -8.7 | 112 | N253 S254 Y255 K259 R260 M261 F320 S322 | N253-R257 WeakPolarHBondContact O-CB 3.33Å; N253-R257 PolarHBondContact O-N 3Å; S254-R257 WeakPolarHBondContact O-CB 3.47Å; S254-R257 PolarHBondContact O-N 3.44Å; Y255-R257 VanDerWaalsContact C-N 3.26Å; Y255-R257 PolarHBondContact O-N 2.86Å; R257-K259 VanDerWaalsContact C-N 3.35Å; R257-K259 PolarHBondContact O-N 3.37Å; R257-R260 PolarHBondContact O-N 2.97Å; R257-M261 WeakPolarHBondContact O-CB 3.01Å; R257-M261 PolarHBondContact O-N 3.37Å; R257-F320 WeakPolarHBondContact CD-O 3.16Å; R257-F320 HydrophobicContact CG-CB 4.18Å; R257-F320 HydrophobicContact CG-CD1 4.06Å; R257-F320 VanDerWaalsContact CG-O 3.23Å; R257-F320 WeakPolarHBondContact CG-O 3.4Å; R257-S322 PolarHBondContact NH1-OG 3.49Å |
| 258 | L | 82.5 | Confident | 82.6 | Confident | 36 Ų | 36 | 62.1 Ų | 62.1 | 19% | 0.188 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.9 | -44.5 | 174.9 | 176.2 | 62.3 | 0 | 0 | 0 | 111.5 | R130 V134 S254 Y255 R260 M261 V262 | R130-L258 HydrophobicContact CG-CD1 4.03Å; V134-L258 HydrophobicContact CG2-CD2 3.52Å; S254-L258 PolarHBondContact O-N 3.01Å; Y255-L258 PolarHBondContact O-N 3.45Å; L258-R260 PolarHBondContact O-N 2.96Å; L258-M261 WeakPolarHBondContact O-CB 3.34Å; L258-M261 PolarHBondContact O-N 2.67Å; L258-V262 HydrophobicContact CD1-CG2 4.02Å; L258-V262 HydrophobicContact CG-CG2 4.5Å; L258-V262 WeakPolarHBondContact O-CG2 3.21Å; L258-V262 PolarHBondContact O-N 2.99Å |
| 259 | K | 84.6 | Confident | 83.7 | Confident | 59 Ų | 59 | 57.7 Ų | 57.7 | 26% | 0.257 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -57.1 | -50 | 176.4 | 177.3 | 179.8 | 170.2 | 178.7 | 0 | 110.9 | L232 V233 Y255 R257 M261 V262 I263 | L232-K259 HydrophobicContact CD2-CB 4.14Å; L232-K259 HydrophobicContact CD2-CG 4.28Å; V233-K259 HydrophobicContact CG2-CD 4.31Å; V233-K259 HydrophobicContact CG2-CG 4.45Å; Y255-K259 WeakPolarHBondContact O-CB 3.33Å; Y255-K259 PolarHBondContact O-N 3.49Å; R257-K259 VanDerWaalsContact C-N 3.35Å; R257-K259 PolarHBondContact O-N 3.37Å; K259-M261 VanDerWaalsContact C-N 3.33Å; K259-M261 PolarHBondContact O-N 3.03Å; K259-V262 PolarHBondContact O-N 3.41Å; K259-I263 HydrophobicContact CD-CD1 4.49Å; K259-I263 HydrophobicContact CG-CD1 3.81Å; K259-I263 VanDerWaalsContact O-CG1 3.23Å; K259-I263 WeakPolarHBondContact O-CG1 3.23Å; K259-I263 PolarHBondContact O-N 3.14Å |
| 260 | R | 87.4 | Confident | 84.7 | Confident | 136 Ų | 136 | 52.3 Ų | 52.3 | 51% | 0.513 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -60.4 | -42.9 | 178.3 | -73.6 | -169.6 | -61.6 | -87.8 | 4.4 | 112.2 | G256 R257 L258 I263 S264 F320 | G256-R260 WeakPolarHBondContact O-CG 3.42Å; G256-R260 PolarHBondContact O-N 3.35Å; G256-R260 VanDerWaalsContact O-N 3.13Å; G256-R260 PolarHBondContact O-NH1 3.49Å; R257-R260 PolarHBondContact O-N 2.97Å; L258-R260 PolarHBondContact O-N 2.96Å; R260-I263 PolarHBondContact O-N 2.95Å; R260-S264 PolarHBondContact O-N 3.04Å; R260-S264 PolarHBondContact O-OG 3.48Å; R260-S264 VanDerWaalsContact O-OG 3.08Å; R260-F320 HydrophobicContact CB-CD1 4.13Å; R260-F320 HydrophobicContact CB-CE1 3.57Å; R260-F320 HydrophobicContact CB-CZ 4.12Å |
| 261 | M | 86.3 | Confident | 85.7 | Confident | 8 Ų | 8 | 54.3 Ų | 54.3 | 4% | 0.039 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -57.7 | -50.9 | 176.9 | -171.3 | -178.5 | 148.5 | 0 | 0 | 112.7 | R257 L258 K259 I263 S264 I265 Y317 F320 | R257-M261 WeakPolarHBondContact O-CB 3.01Å; R257-M261 PolarHBondContact O-N 3.37Å; L258-M261 WeakPolarHBondContact O-CB 3.34Å; L258-M261 PolarHBondContact O-N 2.67Å; K259-M261 VanDerWaalsContact C-N 3.33Å; K259-M261 PolarHBondContact O-N 3.03Å; M261-I263 VanDerWaalsContact C-N 3.34Å; M261-I263 PolarHBondContact O-N 3.1Å; M261-S264 PolarHBondContact O-N 3.35Å; M261-I265 HydrophobicContact CE-CD1 3.79Å; M261-I265 HydrophobicContact CG-CD1 4.09Å; M261-I265 WeakPolarHBondContact O-CG1 3.26Å; M261-I265 PolarHBondContact O-N 3.17Å; M261-Y317 HydrophobicContact CE-CD1 3.04Å; M261-Y317 HydrophobicContact CE-CE1 3.16Å; M261-Y317 HydrophobicContact CE-CG 4.02Å; M261-F320 HydrophobicContact CB-CB 3.45Å; M261-F320 VanDerWaalsContact CB-CB 3.45Å; M261-F320 HydrophobicContact CB-CD1 4.28Å; M261-F320 HydrophobicContact CB-CD2 3.71Å; M261-F320 HydrophobicContact CB-CG 3.56Å; M261-F320 HydrophobicContact CG-CB 3.54Å; M261-F320 HydrophobicContact CG-CD2 3.78Å; M261-F320 HydrophobicContact CG-CG 3.91Å; M261-F320 HydrophobicContact SD-CB 3.75Å |
| 262 | V | 85.8 | Confident | 86.7 | Confident | 8 Ų | 8 | 51.5 Ų | 51.5 | 5% | 0.048 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -65.3 | -40.2 | -178.2 | 174.8 | 0 | 0 | 0 | 0 | 110.6 | R130 Y229 L232 L258 K259 S264 I265 V266 | R130-V262 HydrophobicContact CB-CG2 4.38Å; R130-V262 HydrophobicContact CG-CG2 4.12Å; Y229-V262 HydrophobicContact CD2-CG1 4.33Å; L232-V262 HydrophobicContact CD1-CB 4.42Å; L232-V262 HydrophobicContact CD1-CG1 4.38Å; L232-V262 HydrophobicContact CD1-CG2 4.04Å; L258-V262 HydrophobicContact CD1-CG2 4.02Å; L258-V262 HydrophobicContact CG-CG2 4.5Å; L258-V262 WeakPolarHBondContact O-CG2 3.21Å; L258-V262 PolarHBondContact O-N 2.99Å; K259-V262 PolarHBondContact O-N 3.41Å; V262-S264 PolarHBondContact O-N 3.31Å; V262-I265 PolarHBondContact O-N 2.87Å; V262-V266 HydrophobicContact CG1-CG2 4.29Å; V262-V266 WeakPolarHBondContact O-CG2 3.19Å; V262-V266 PolarHBondContact O-N 2.86Å |
| 263 | I | 87.9 | Confident | 87.8 | Confident | 47 Ų | 47 | 43.3 Ų | 43.3 | 24% | 0.241 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -56.5 | -51.3 | 173.5 | -69.4 | 166.8 | 0 | 0 | 0 | 110.4 | Y229 K259 R260 M261 I265 V266 C267 | Y229-I263 HydrophobicContact CD2-CG1 4Å; Y229-I263 HydrophobicContact CE2-CB 4.4Å; Y229-I263 HydrophobicContact CE2-CD1 3.73Å; Y229-I263 HydrophobicContact CE2-CG1 3.09Å; Y229-I263 VanDerWaalsContact CZ-CG1 3.42Å; Y229-I263 WeakPolarHBondContact OH-CD1 3.5Å; Y229-I263 VanDerWaalsContact OH-CG1 3.32Å; Y229-I263 WeakPolarHBondContact OH-CG1 3.41Å; K259-I263 HydrophobicContact CD-CD1 4.49Å; K259-I263 HydrophobicContact CG-CD1 3.81Å; K259-I263 VanDerWaalsContact O-CG1 3.23Å; K259-I263 WeakPolarHBondContact O-CG1 3.23Å; K259-I263 PolarHBondContact O-N 3.14Å; R260-I263 PolarHBondContact O-N 2.95Å; M261-I263 VanDerWaalsContact C-N 3.34Å; M261-I263 PolarHBondContact O-N 3.1Å; I263-I265 VanDerWaalsContact C-N 3.3Å; I263-I265 PolarHBondContact O-N 3.01Å; I263-V266 PolarHBondContact O-N 3.06Å; I263-C267 VanDerWaalsContact O-CB 3.32Å; I263-C267 WeakPolarHBondContact O-CB 3.11Å; I263-C267 PolarHBondContact O-N 3.26Å; I263-C267 PolarHBondContact O-SG 3.4Å |
| 264 | S | 89.6 | Confident | 88.7 | Confident | 40 Ų | 40 | 41.8 Ų | 41.8 | 28% | 0.28 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.8 | -39.8 | -178.1 | -61.8 | 0 | 0 | 0 | 0 | 112.1 | R260 M261 V262 C268 | R260-S264 PolarHBondContact O-N 3.04Å; R260-S264 PolarHBondContact O-OG 3.48Å; R260-S264 VanDerWaalsContact O-OG 3.08Å; M261-S264 PolarHBondContact O-N 3.35Å; V262-S264 PolarHBondContact O-N 3.31Å; S264-C268 WeakPolarHBondContact O-CB 3.33Å; S264-C268 PolarHBondContact O-N 3.01Å |
| 265 | I | 89.1 | Confident | 89.6 | Confident | 10 Ų | 10 | 40.9 Ų | 40.9 | 5% | 0.051 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.4 | -49.8 | 177.5 | -67.4 | 168.3 | 0 | 0 | 0 | 110.7 | I123 M261 V262 I263 C268 Y269 L316 Y317 | I123-I265 HydrophobicContact CG2-CG2 3.64Å; M261-I265 HydrophobicContact CE-CD1 3.79Å; M261-I265 HydrophobicContact CG-CD1 4.09Å; M261-I265 WeakPolarHBondContact O-CG1 3.26Å; M261-I265 PolarHBondContact O-N 3.17Å; V262-I265 PolarHBondContact O-N 2.87Å; I263-I265 VanDerWaalsContact C-N 3.3Å; I263-I265 PolarHBondContact O-N 3.01Å; I265-C268 PolarHBondContact O-N 2.89Å; I265-Y269 WeakPolarHBondContact O-CB 2.78Å; I265-Y269 PolarHBondContact O-N 3.49Å; I265-L316 HydrophobicContact CB-CD1 4.3Å; I265-L316 HydrophobicContact CG1-CB 3.98Å; I265-L316 HydrophobicContact CG1-CD1 3.59Å; I265-L316 HydrophobicContact CG1-CG 4.41Å; I265-Y317 HydrophobicContact CD1-CE1 4.14Å |
| 266 | V | 89.7 | Confident | 90.3 | Very high | 8 Ų | 8 | 40.2 Ų | 40.2 | 5% | 0.048 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.2 | -44.2 | -179 | 174.8 | 0 | 0 | 0 | 0 | 111.2 | M225 V262 I263 Y269 L270 | M225-V266 HydrophobicContact CB-CG1 4.49Å; M225-V266 HydrophobicContact CB-CG2 4.24Å; V262-V266 HydrophobicContact CG1-CG2 4.29Å; V262-V266 WeakPolarHBondContact O-CG2 3.19Å; V262-V266 PolarHBondContact O-N 2.86Å; I263-V266 PolarHBondContact O-N 3.06Å; V266-Y269 PolarHBondContact O-N 3.48Å; V266-L270 HydrophobicContact CG1-CD1 3.99Å; V266-L270 HydrophobicContact CG1-CG 4.4Å; V266-L270 WeakPolarHBondContact O-CG 2.95Å; V266-L270 PolarHBondContact O-N 3.41Å |
| 267 | C | 92.2 | Very high | 91 | Very high | 61 Ų | 61 | 39.4 Ų | 39.4 | 41% | 0.412 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -64 | -45.5 | 177 | -69.9 | 0 | 0 | 0 | 0 | 111.8 | I263 Y269 L270 L271 | I263-C267 VanDerWaalsContact O-CB 3.32Å; I263-C267 WeakPolarHBondContact O-CB 3.11Å; I263-C267 PolarHBondContact O-N 3.26Å; I263-C267 PolarHBondContact O-SG 3.4Å; C267-Y269 VanDerWaalsContact C-N 3.32Å; C267-Y269 PolarHBondContact O-N 3.15Å; C267-L270 PolarHBondContact O-N 3.49Å; C267-L271 VanDerWaalsContact O-CB 3.31Å; C267-L271 WeakPolarHBondContact O-CB 3.36Å; C267-L271 WeakPolarHBondContact O-CG 3.42Å; C267-L271 PolarHBondContact O-N 2.99Å |
| 268 | C | 92.8 | Very high | 91.6 | Very high | 24 Ų | 24 | 39.6 Ų | 39.6 | 16% | 0.162 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.4 | -44.3 | 177.9 | -171.8 | 0 | 0 | 0 | 0 | 111.2 | S264 I265 C272 T312 L316 | S264-C268 WeakPolarHBondContact O-CB 3.33Å; S264-C268 PolarHBondContact O-N 3.01Å; I265-C268 PolarHBondContact O-N 2.89Å; C268-C272 WeakPolarHBondContact O-CB 3.02Å; C268-C272 PolarHBondContact O-N 3.35Å; C268-C272 PolarHBondContact O-SG 3.16Å; C268-T312 PolarHBondContact SG-OG1 3.33Å; C268-L316 HydrophobicContact CB-CD1 4.41Å |
| 269 | Y | 92.1 | Very high | 92.2 | Very high | 1 Ų | 1 | 38.3 Ų | 38.3 | 0% | 0.004 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -57 | -55.3 | 174.2 | 165.1 | -96.9 | 0 | 0 | 0 | 111.4 | V120 F218 S222 M225 I265 V266 C267 L271 C272 W273 | V120-Y269 HydrophobicContact CB-CE2 4.16Å; V120-Y269 HydrophobicContact CG1-CD2 4.49Å; V120-Y269 HydrophobicContact CG1-CE2 3.49Å; V120-Y269 VanDerWaalsContact CG1-CE2 3.49Å; V120-Y269 WeakPolarHBondContact CG1-OH 3.31Å; V120-Y269 HydrophobicContact CG2-CD2 4.45Å; V120-Y269 HydrophobicContact CG2-CE2 3.73Å; F218-Y269 HydrophobicContact CD2-CE1 4.37Å; F218-Y269 AromaticContact CD2-CZ 3.87Å; F218-Y269 VanDerWaalsContact CD2-OH 3.23Å; F218-Y269 WeakPolarHBondContact CD2-OH 2.88Å; F218-Y269 HydrophobicContact CE2-CE1 4.31Å; F218-Y269 PolarHBondContact O-OH 2.67Å; S222-Y269 WeakPolarHBondContact OG-CE1 3.48Å; S222-Y269 PolarHBondContact OG-OH 2.88Å; M225-Y269 HydrophobicContact CE-CD1 3.36Å; M225-Y269 HydrophobicContact CE-CD2 4.16Å; M225-Y269 HydrophobicContact CE-CE1 3.08Å; M225-Y269 HydrophobicContact CE-CE2 3.93Å; M225-Y269 HydrophobicContact CE-CG 3.91Å; M225-Y269 HydrophobicContact SD-CD1 3.99Å; M225-Y269 HydrophobicContact SD-CE1 4.29Å; M225-Y269 HydrophobicContact SD-CG 4.26Å; I265-Y269 WeakPolarHBondContact O-CB 2.78Å; I265-Y269 PolarHBondContact O-N 3.49Å; V266-Y269 PolarHBondContact O-N 3.48Å; C267-Y269 VanDerWaalsContact C-N 3.32Å; C267-Y269 PolarHBondContact O-N 3.15Å; Y269-L271 VanDerWaalsContact C-N 3.34Å; Y269-L271 PolarHBondContact O-N 3.38Å; Y269-C272 PolarHBondContact O-N 3.1Å; Y269-W273 HydrophobicContact CD2-CB 4.45Å; Y269-W273 AromaticContact CD2-CD1 3.17Å; Y269-W273 AromaticContact CD2-CG 3.89Å; Y269-W273 HydrophobicContact CD2-CG 3.89Å; Y269-W273 AromaticContact CD2-NE1 3.6Å; Y269-W273 HydrophobicContact CE2-CB 4.07Å; Y269-W273 AromaticContact CE2-CD1 3.31Å; Y269-W273 HydrophobicContact CE2-CD2 4.16Å; Y269-W273 AromaticContact CE2-CG 3.58Å; Y269-W273 HydrophobicContact CE2-CG 3.58Å; Y269-W273 AromaticContact CE2-NE1 3.68Å; Y269-W273 WeakPolarHBondContact O-CB 3.23Å; Y269-W273 VanDerWaalsContact O-CD1 3.3Å; Y269-W273 PolarHBondContact O-N 2.95Å |
| 270 | L | 94.5 | Very high | 92.6 | Very high | 44 Ų | 44 | 36.7 Ų | 36.7 | 23% | 0.23 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.9 | -41.3 | -177 | -69.2 | 175.2 | 0 | 0 | 0 | 111.9 | I226 V266 C267 C272 T274 | I226-L270 HydrophobicContact CD1-CD1 4.21Å; I226-L270 HydrophobicContact CG1-CD1 4.27Å; V266-L270 HydrophobicContact CG1-CD1 3.99Å; V266-L270 HydrophobicContact CG1-CG 4.4Å; V266-L270 WeakPolarHBondContact O-CG 2.95Å; V266-L270 PolarHBondContact O-N 3.41Å; C267-L270 PolarHBondContact O-N 3.49Å; L270-C272 VanDerWaalsContact C-N 3.32Å; L270-C272 PolarHBondContact O-N 3.34Å; L270-T274 WeakPolarHBondContact O-CB 3.41Å; L270-T274 PolarHBondContact O-N 2.85Å; L270-T274 PolarHBondContact O-OG1 2.9Å |
| 271 | L | 95.5 | Very high | 93 | Very high | 131 Ų | 131 | 32 Ų | 32 | 69% | 0.686 | 18% | 0.181 | S | C | * | . | H | α-helix | trans | -65.9 | -34.4 | 178.6 | -71.8 | 171.4 | 0 | 0 | 0 | 112.6 | C267 Y269 P275 | C267-L271 VanDerWaalsContact O-CB 3.31Å; C267-L271 WeakPolarHBondContact O-CB 3.36Å; C267-L271 WeakPolarHBondContact O-CG 3.42Å; C267-L271 PolarHBondContact O-N 2.99Å; Y269-L271 VanDerWaalsContact C-N 3.34Å; Y269-L271 PolarHBondContact O-N 3.38Å; L271-P275 WeakPolarHBondContact O-CD 3.43Å; L271-P275 WeakPolarHBondContact O-CG 3.24Å |
| 272 | C | 95.5 | Very high | 93.3 | Very high | 7 Ų | 7 | 35.6 Ų | 35.6 | 5% | 0.047 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -80.4 | -40.9 | 179.2 | -67.8 | 0 | 0 | 0 | 0 | 112.5 | C268 Y269 L270 L305 | C268-C272 WeakPolarHBondContact O-CB 3.02Å; C268-C272 PolarHBondContact O-N 3.35Å; C268-C272 PolarHBondContact O-SG 3.16Å; Y269-C272 PolarHBondContact O-N 3.1Å; L270-C272 VanDerWaalsContact C-N 3.32Å; L270-C272 PolarHBondContact O-N 3.34Å; C272-L305 HydrophobicContact CB-CB 4.12Å; C272-L305 WeakPolarHBondContact CB-O 3.37Å; C272-L305 WeakPolarHBondContact O-CB 3.17Å |
| 273 | W | 96.6 | Very high | 93.5 | Very high | 3 Ų | 3 | 38.1 Ų | 38.1 | 1% | 0.011 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -89.3 | -31.1 | -170.4 | -78.9 | 93.1 | 0 | 0 | 0 | 114.3 | K116 Y117 V120 F218 Y269 Y276 W277 P306 | K116-W273 HydrophobicContact CD-CH2 3.81Å; K116-W273 HydrophobicContact CD-CZ2 4.41Å; K116-W273 HydrophobicContact CD-CZ3 4.38Å; K116-W273 HydrophobicContact CG-CH2 3.49Å; K116-W273 VanDerWaalsContact CG-CH2 3.49Å; K116-W273 HydrophobicContact CG-CZ2 3.75Å; Y117-W273 AromaticContact CD1-CH2 3.63Å; Y117-W273 HydrophobicContact CD1-CH2 3.63Å; Y117-W273 AromaticContact CD1-CZ3 3.97Å; Y117-W273 HydrophobicContact CD1-CZ3 3.97Å; Y117-W273 AromaticContact CE1-CH2 3.64Å; Y117-W273 HydrophobicContact CE1-CH2 3.64Å; Y117-W273 AromaticContact CE1-CZ3 3.53Å; Y117-W273 HydrophobicContact CE1-CZ3 3.53Å; V120-W273 HydrophobicContact CG2-CD2 4.27Å; V120-W273 VanDerWaalsContact CG2-CE2 3.48Å; V120-W273 HydrophobicContact CG2-CH2 3.78Å; V120-W273 HydrophobicContact CG2-CZ2 3.19Å; F218-W273 HydrophobicContact CD2-CB 3.72Å; F218-W273 HydrophobicContact CE2-CB 3.65Å; Y269-W273 HydrophobicContact CD2-CB 4.45Å; Y269-W273 AromaticContact CD2-CD1 3.17Å; Y269-W273 AromaticContact CD2-CG 3.89Å; Y269-W273 HydrophobicContact CD2-CG 3.89Å; Y269-W273 AromaticContact CD2-NE1 3.6Å; Y269-W273 HydrophobicContact CE2-CB 4.07Å; Y269-W273 AromaticContact CE2-CD1 3.31Å; Y269-W273 HydrophobicContact CE2-CD2 4.16Å; Y269-W273 AromaticContact CE2-CG 3.58Å; Y269-W273 HydrophobicContact CE2-CG 3.58Å; Y269-W273 AromaticContact CE2-NE1 3.68Å; Y269-W273 WeakPolarHBondContact O-CB 3.23Å; Y269-W273 VanDerWaalsContact O-CD1 3.3Å; Y269-W273 PolarHBondContact O-N 2.95Å; W273-Y276 AromaticContact CE3-CD1 3.93Å; W273-Y276 HydrophobicContact CE3-CD1 3.93Å; W273-Y276 HydrophobicContact CE3-CE1 4.37Å; W273-Y276 HydrophobicContact CZ3-CD1 4.09Å; W273-Y276 HydrophobicContact CZ3-CE1 4.08Å; W273-Y276 WeakPolarHBondContact O-CB 3.4Å; W273-Y276 PolarHBondContact O-N 3.42Å; W273-W277 AromaticContact CE3-CD1 3.98Å; W273-W277 AromaticContact CE3-NE1 3.46Å; W273-W277 AromaticContact CZ3-NE1 3.79Å; W273-W277 VanDerWaalsContact O-CD1 3.24Å; W273-W277 PolarHBondContact O-N 2.85Å; W273-P306 HydrophobicContact CZ2-CB 4.26Å |
| 274 | T | 96.6 | Very high | 93.6 | Very high | 47 Ų | 47 | 36.5 Ų | 36.5 | 29% | 0.288 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -62.7 | -48 | -178.1 | -54.2 | 0 | 0 | 0 | 0 | 112.1 | F218 L270 Y276 W277 I278 | F218-T274 HydrophobicContact CZ-CG2 4.46Å; F218-T274 WeakPolarHBondContact CZ-OG1 3.33Å; L270-T274 WeakPolarHBondContact O-CB 3.41Å; L270-T274 PolarHBondContact O-N 2.85Å; L270-T274 PolarHBondContact O-OG1 2.9Å; T274-Y276 VanDerWaalsContact C-N 3.3Å; T274-Y276 PolarHBondContact O-N 2.94Å; T274-W277 PolarHBondContact O-N 2.83Å; T274-I278 HydrophobicContact CG2-CD1 3.63Å; T274-I278 HydrophobicContact CG2-CG1 4.19Å; T274-I278 WeakPolarHBondContact O-CG1 3.38Å; T274-I278 PolarHBondContact O-N 3.4Å |
| 275 | P | 96.8 | Very high | 93.7 | Very high | 47 Ų | 47 | 39.8 Ų | 39.8 | 31% | 0.305 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -63.8 | -36.5 | 177.9 | -20.2 | 33.4 | 0 | 0 | 0 | 112.5 | L271 W277 M279 I302 L305 | L271-P275 WeakPolarHBondContact O-CD 3.43Å; L271-P275 WeakPolarHBondContact O-CG 3.24Å; P275-W277 PolarHBondContact O-N 3.29Å; P275-M279 VanDerWaalsContact O-CB 3.29Å; P275-M279 WeakPolarHBondContact O-CB 3.37Å; P275-M279 PolarHBondContact O-N 2.88Å; P275-I302 HydrophobicContact CB-CG2 4.48Å; P275-L305 HydrophobicContact CB-CD1 3.76Å; P275-L305 HydrophobicContact CG-CD1 3.83Å |
| 276 | Y | 96.3 | Very high | 93.6 | Very high | 18 Ų | 18 | 42.8 Ų | 42.8 | 7% | 0.071 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -56.2 | -49.6 | 173.6 | 168.8 | -88.3 | 0 | 0 | 0 | 111.4 | K116 Y117 W273 T274 N280 H303 P306 | K116-Y276 PolarHBondContact NZ-OH 2.71Å; Y117-Y276 PolarHBondContact OH-OH 3.38Å; W273-Y276 AromaticContact CE3-CD1 3.93Å; W273-Y276 HydrophobicContact CE3-CD1 3.93Å; W273-Y276 HydrophobicContact CE3-CE1 4.37Å; W273-Y276 HydrophobicContact CZ3-CD1 4.09Å; W273-Y276 HydrophobicContact CZ3-CE1 4.08Å; W273-Y276 WeakPolarHBondContact O-CB 3.4Å; W273-Y276 PolarHBondContact O-N 3.42Å; T274-Y276 VanDerWaalsContact C-N 3.3Å; T274-Y276 PolarHBondContact O-N 2.94Å; Y276-N280 WeakPolarHBondContact CE2-ND2 3.22Å; Y276-N280 PolarHBondContact O-N 3.03Å; Y276-N280 VanDerWaalsContact O-N 3.09Å; Y276-N280 PolarHBondContact O-ND2 3.41Å; Y276-H303 AromaticContact CE2-CD2 3.73Å; Y276-H303 AromaticContact CE2-NE2 3.59Å; Y276-P306 HydrophobicContact CD2-CG 3.87Å; Y276-P306 HydrophobicContact CE2-CG 4.4Å; Y276-P306 HydrophobicContact CG-CG 4.09Å |
| 277 | W | 97 | Very high | 92.9 | Very high | 5 Ų | 5 | 47.3 Ų | 47.3 | 2% | 0.019 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -72.3 | -42.1 | -178.9 | -79.2 | 111.1 | 0 | 0 | 0 | 113.6 | Y117 T210 F214 F218 W273 T274 P275 M279 N280 L281 | Y117-W277 HydrophobicContact CE1-CH2 4.36Å; Y117-W277 AromaticContact CE1-CZ2 3.65Å; Y117-W277 HydrophobicContact CE1-CZ2 3.65Å; Y117-W277 AromaticContact CZ-CZ2 4Å; T210-W277 HydrophobicContact CG2-CZ3 4.4Å; F214-W277 VanDerWaalsContact CA-CZ3 3.49Å; F214-W277 HydrophobicContact CB-CD2 4.2Å; F214-W277 HydrophobicContact CB-CE3 3.59Å; F214-W277 HydrophobicContact CB-CH2 4.24Å; F214-W277 HydrophobicContact CB-CZ3 3.64Å; F214-W277 HydrophobicContact CD2-CB 3.74Å; F214-W277 AromaticContact CD2-CD2 3.77Å; F214-W277 HydrophobicContact CD2-CD2 3.77Å; F214-W277 AromaticContact CD2-CE3 3.81Å; F214-W277 HydrophobicContact CD2-CE3 3.81Å; F214-W277 AromaticContact CD2-CG 3.76Å; F214-W277 HydrophobicContact CD2-CG 3.76Å; F214-W277 HydrophobicContact CE2-CB 3.96Å; F214-W277 HydrophobicContact CE2-CG 4.33Å; F214-W277 HydrophobicContact CG-CD2 4.49Å; F214-W277 HydrophobicContact CG-CE3 4.19Å; F218-W277 HydrophobicContact CB-CD2 4.3Å; F218-W277 HydrophobicContact CB-CG 4.14Å; F218-W277 HydrophobicContact CB-CZ2 4.26Å; F218-W277 HydrophobicContact CD1-CB 4.28Å; F218-W277 AromaticContact CD1-CD1 3.62Å; F218-W277 AromaticContact CD1-CG 3.95Å; F218-W277 HydrophobicContact CD1-CG 3.95Å; F218-W277 AromaticContact CD2-CD1 3.39Å; F218-W277 HydrophobicContact CD2-CG 4.43Å; F218-W277 AromaticContact CD2-NE1 3.8Å; F218-W277 HydrophobicContact CE1-CB 4.4Å; F218-W277 HydrophobicContact CE1-CG 4.49Å; F218-W277 AromaticContact CG-CD1 3.16Å; F218-W277 AromaticContact CG-CG 3.92Å; F218-W277 HydrophobicContact CG-CG 3.92Å; F218-W277 AromaticContact CG-NE1 3.45Å; W273-W277 AromaticContact CE3-CD1 3.98Å; W273-W277 AromaticContact CE3-NE1 3.46Å; W273-W277 AromaticContact CZ3-NE1 3.79Å; W273-W277 VanDerWaalsContact O-CD1 3.24Å; W273-W277 PolarHBondContact O-N 2.85Å; T274-W277 PolarHBondContact O-N 2.83Å; P275-W277 PolarHBondContact O-N 3.29Å; W277-M279 VanDerWaalsContact C-N 3.28Å; W277-M279 PolarHBondContact O-N 3.27Å; W277-N280 PolarHBondContact O-N 2.83Å; W277-L281 WeakPolarHBondContact O-CB 3.48Å; W277-L281 VanDerWaalsContact O-CG 3.23Å; W277-L281 WeakPolarHBondContact O-CG 3.4Å; W277-L281 PolarHBondContact O-N 3.35Å |
| 278 | I | 95.6 | Very high | 92.3 | Very high | 91 Ų | 91 | 51.2 Ų | 51.2 | 47% | 0.467 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -56.3 | -47.6 | 175.7 | -70 | 172.9 | 0 | 0 | 0 | 110 | T274 L281 I282 | T274-I278 HydrophobicContact CG2-CD1 3.63Å; T274-I278 HydrophobicContact CG2-CG1 4.19Å; T274-I278 WeakPolarHBondContact O-CG1 3.38Å; T274-I278 PolarHBondContact O-N 3.4Å; I278-L281 PolarHBondContact O-N 3.27Å; I278-I282 HydrophobicContact CG2-CD1 3.7Å; I278-I282 HydrophobicContact CG2-CG1 4.45Å; I278-I282 VanDerWaalsContact O-CG1 3.29Å; I278-I282 WeakPolarHBondContact O-CG1 3.43Å; I278-I282 PolarHBondContact O-N 3Å |
| 279 | M | 93.6 | Very high | 91.7 | Very high | 10 Ų | 10 | 51.9 Ų | 51.9 | 5% | 0.049 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.7 | -45.3 | -179.2 | -171.2 | 64.4 | -174.7 | 0 | 0 | 112.3 | P275 W277 L281 I282 V283 L295 F299 I302 | P275-M279 VanDerWaalsContact O-CB 3.29Å; P275-M279 WeakPolarHBondContact O-CB 3.37Å; P275-M279 PolarHBondContact O-N 2.88Å; W277-M279 VanDerWaalsContact C-N 3.28Å; W277-M279 PolarHBondContact O-N 3.27Å; M279-L281 VanDerWaalsContact C-N 3.34Å; M279-L281 PolarHBondContact O-N 3.36Å; M279-I282 PolarHBondContact O-N 2.99Å; M279-V283 HydrophobicContact CE-CG2 3.78Å; M279-V283 HydrophobicContact CG-CG2 4.47Å; M279-V283 VanDerWaalsContact O-CG2 3.32Å; M279-V283 WeakPolarHBondContact O-CG2 3.5Å; M279-V283 PolarHBondContact O-N 3.42Å; M279-V283 HydrophobicContact SD-CG2 4.43Å; M279-L295 HydrophobicContact CE-CD1 3.58Å; M279-L295 HydrophobicContact CE-CD2 4.48Å; M279-L295 HydrophobicContact CE-CG 3.83Å; M279-F299 HydrophobicContact CE-CB 4.05Å; M279-F299 HydrophobicContact CE-CD2 3.94Å; M279-F299 HydrophobicContact CG-CD2 3.89Å; M279-I302 HydrophobicContact CB-CD1 3.82Å; M279-I302 HydrophobicContact CB-CG2 4.07Å; M279-I302 HydrophobicContact CG-CD1 3.87Å; M279-I302 HydrophobicContact SD-CD1 4.19Å |
| 280 | N | 94.4 | Very high | 91.2 | Very high | 25 Ų | 25 | 59.5 Ų | 59.5 | 13% | 0.134 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -62.8 | -40.1 | 177.5 | -82.3 | -82.3 | 0 | 0 | 0 | 111.8 | T210 Y276 W277 V283 V284 | T210-N280 HydrophobicContact CG2-CB 4.48Å; Y276-N280 WeakPolarHBondContact CE2-ND2 3.22Å; Y276-N280 PolarHBondContact O-N 3.03Å; Y276-N280 VanDerWaalsContact O-N 3.09Å; Y276-N280 PolarHBondContact O-ND2 3.41Å; W277-N280 PolarHBondContact O-N 2.83Å; N280-V283 PolarHBondContact O-N 3.33Å; N280-V284 WeakPolarHBondContact O-CB 3.26Å; N280-V284 VanDerWaalsContact O-CG2 3.25Å; N280-V284 WeakPolarHBondContact O-CG2 3.5Å; N280-V284 PolarHBondContact O-N 2.9Å |
| 281 | L | 95.6 | Very high | 90.6 | Very high | 38 Ų | 38 | 61.8 Ų | 61.8 | 20% | 0.199 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -64.5 | -43.3 | 175.5 | -70.7 | 168.7 | 0 | 0 | 0 | 111.9 | T210 F214 W277 I278 M279 F285 | T210-L281 HydrophobicContact CG2-CD2 4.17Å; F214-L281 HydrophobicContact CB-CD2 4.47Å; F214-L281 HydrophobicContact CD1-CD1 4.28Å; F214-L281 HydrophobicContact CD2-CD1 3.85Å; F214-L281 HydrophobicContact CE1-CD1 4.27Å; F214-L281 HydrophobicContact CE2-CD1 3.81Å; F214-L281 HydrophobicContact CG-CD1 4.07Å; F214-L281 HydrophobicContact CG-CD2 4.42Å; F214-L281 HydrophobicContact CZ-CD1 4.03Å; W277-L281 WeakPolarHBondContact O-CB 3.48Å; W277-L281 VanDerWaalsContact O-CG 3.23Å; W277-L281 WeakPolarHBondContact O-CG 3.4Å; W277-L281 PolarHBondContact O-N 3.35Å; I278-L281 PolarHBondContact O-N 3.27Å; M279-L281 VanDerWaalsContact C-N 3.34Å; M279-L281 PolarHBondContact O-N 3.36Å; L281-F285 HydrophobicContact CD2-CD2 4.21Å; L281-F285 HydrophobicContact CD2-CE2 3.88Å; L281-F285 WeakPolarHBondContact O-CB 3.46Å; L281-F285 WeakPolarHBondContact O-CD2 3.46Å; L281-F285 PolarHBondContact O-N 3.35Å |
| 282 | I | 92.8 | Very high | 90.2 | Very high | 83 Ų | 83 | 58.8 Ų | 58.8 | 43% | 0.426 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -62.1 | -48.4 | 177.4 | -70.2 | 168 | 0 | 0 | 0 | 110.7 | I278 M279 V284 N286 V289 | I278-I282 HydrophobicContact CG2-CD1 3.7Å; I278-I282 HydrophobicContact CG2-CG1 4.45Å; I278-I282 VanDerWaalsContact O-CG1 3.29Å; I278-I282 WeakPolarHBondContact O-CG1 3.43Å; I278-I282 PolarHBondContact O-N 3Å; M279-I282 PolarHBondContact O-N 2.99Å; I282-V284 PolarHBondContact O-N 3.47Å; I282-N286 WeakPolarHBondContact O-CB 3.44Å; I282-N286 PolarHBondContact O-N 3.08Å; I282-V289 HydrophobicContact CG2-CG2 4.34Å |
| 283 | V | 89.4 | Confident | 89.7 | Confident | 60 Ų | 60 | 61.4 Ų | 61.4 | 36% | 0.364 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | -176.7 | 171 | 0 | 0 | 0 | 0 | 111.5 | M279 N280 F299 | M279-V283 HydrophobicContact CE-CG2 3.78Å; M279-V283 HydrophobicContact CG-CG2 4.47Å; M279-V283 VanDerWaalsContact O-CG2 3.32Å; M279-V283 WeakPolarHBondContact O-CG2 3.5Å; M279-V283 PolarHBondContact O-N 3.42Å; M279-V283 HydrophobicContact SD-CG2 4.43Å; N280-V283 PolarHBondContact O-N 3.33Å; V283-F299 HydrophobicContact CG2-CD2 4.28Å; V283-F299 HydrophobicContact CG2-CE2 4.35Å |
| 284 | V | 90.7 | Very high | 89.3 | Confident | 13 Ų | 13 | 65.5 Ų | 65.5 | 8% | 0.079 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -71.7 | -43.4 | -177.4 | 169.2 | 0 | 0 | 0 | 0 | 111.8 | E206 H207 T210 N280 I282 | E206-V284 HydrophobicContact CG-CG1 4.36Å; E206-V284 HydrophobicContact CG-CG2 3.99Å; H207-V284 HydrophobicContact CB-CG1 4.24Å; H207-V284 PolarHBondContact NE2-O 2.85Å; T210-V284 HydrophobicContact CG2-CB 4.42Å; T210-V284 HydrophobicContact CG2-CG2 4.15Å; N280-V284 WeakPolarHBondContact O-CB 3.26Å; N280-V284 VanDerWaalsContact O-CG2 3.25Å; N280-V284 WeakPolarHBondContact O-CG2 3.5Å; N280-V284 PolarHBondContact O-N 2.9Å; I282-V284 PolarHBondContact O-N 3.47Å |
| 285 | F | 90.7 | Very high | 88.9 | Confident | 109 Ų | 109 | 65 Ų | 65 | 48% | 0.478 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -92.8 | -4.5 | -173 | -70.6 | -79.2 | 0 | 0 | 0 | 114.9 | H207 L211 L281 | H207-F285 HydrophobicContact CB-CE1 4.15Å; H207-F285 HydrophobicContact CB-CZ 4.24Å; H207-F285 AromaticContact CD2-CD1 3.74Å; H207-F285 AromaticContact CD2-CE1 3.7Å; L211-F285 HydrophobicContact CB-CZ 4.37Å; L281-F285 HydrophobicContact CD2-CD2 4.21Å; L281-F285 HydrophobicContact CD2-CE2 3.88Å; L281-F285 WeakPolarHBondContact O-CB 3.46Å; L281-F285 WeakPolarHBondContact O-CD2 3.46Å; L281-F285 PolarHBondContact O-N 3.35Å |
| 286 | N | 87.6 | Confident | 88.5 | Confident | 73 Ų | 73 | 70.1 Ų | 70.1 | 39% | 0.39 | 38% | 0.382 | S | S | . | . | trans | -116.7 | 89.1 | 177.9 | -171.8 | -7.8 | 0 | 0 | 0 | 111.3 | I282 N288 V289 | I282-N286 WeakPolarHBondContact O-CB 3.44Å; I282-N286 PolarHBondContact O-N 3.08Å; N286-N288 PolarHBondContact O-N 3.12Å; N286-N288 VanDerWaalsContact O-N 3.1Å; N286-N288 PolarHBondContact OD1-N 2.93Å; N286-N288 VanDerWaalsContact OD1-N 3.15Å; N286-V289 HydrophobicContact CB-CG2 3.53Å; N286-V289 VanDerWaalsContact ND2-CG2 3.33Å; N286-V289 WeakPolarHBondContact ND2-CG2 3.21Å; N286-V289 WeakPolarHBondContact O-CG2 3.27Å; N286-V289 PolarHBondContact O-N 3.13Å | ||
| 287 | A | 75.4 | Confident | 88.2 | Confident | 103 Ų | 103 | 72 Ų | 72 | 85% | 0.851 | 39% | 0.393 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -18.4 | 178 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 288 | N | 78.6 | Confident | 87.9 | Confident | 143 Ų | 143 | 76.6 Ų | 76.6 | 77% | 0.765 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.5 | 4.3 | -177.1 | -62.8 | -34.4 | 0 | 0 | 0 | 113.2 | N286 Q290 | N286-N288 PolarHBondContact O-N 3.12Å; N286-N288 VanDerWaalsContact O-N 3.1Å; N286-N288 PolarHBondContact OD1-N 2.93Å; N286-N288 VanDerWaalsContact OD1-N 3.15Å; N288-Q290 PolarHBondContact O-N 3.26Å |
| 289 | V | 81.1 | Confident | 87.7 | Confident | 38 Ų | 38 | 75.4 Ų | 75.4 | 23% | 0.23 | 41% | 0.407 | C | S | . | . | trans | -64.4 | 112.4 | 177.2 | 176.3 | 0 | 0 | 0 | 0 | 109.3 | I282 N286 V291 L295 | I282-V289 HydrophobicContact CG2-CG2 4.34Å; N286-V289 HydrophobicContact CB-CG2 3.53Å; N286-V289 VanDerWaalsContact ND2-CG2 3.33Å; N286-V289 WeakPolarHBondContact ND2-CG2 3.21Å; N286-V289 WeakPolarHBondContact O-CG2 3.27Å; N286-V289 PolarHBondContact O-N 3.13Å; V289-V291 PolarHBondContact O-N 3.42Å; V289-V291 VanDerWaalsContact O-N 3.17Å; V289-L295 HydrophobicContact CG1-CD2 3.25Å | ||
| 290 | Q | 81.3 | Confident | 87.7 | Confident | 162 Ų | 162 | 76.9 Ų | 76.9 | 76% | 0.757 | 42% | 0.416 | S | S | * | . | trans | -66.2 | 116.8 | 169.6 | -68.1 | -171.3 | -15.2 | 0 | 0 | 109.3 | N288 T292 | N288-Q290 PolarHBondContact O-N 3.26Å; Q290-T292 PolarHBondContact O-N 2.8Å | ||
| 291 | V | 80.8 | Confident | 87.6 | Confident | 91 Ų | 91 | 79.1 Ų | 79.1 | 55% | 0.552 | 43% | 0.43 | S | S | * | . | trans | -77.1 | 77 | -179.9 | -171.1 | 0 | 0 | 0 | 0 | 109.8 | V289 R296 | V289-V291 PolarHBondContact O-N 3.42Å; V289-V291 VanDerWaalsContact O-N 3.17Å; V291-R296 HydrophobicContact CG1-CG 3.56Å | ||
| 292 | T | 87.7 | Confident | 87.6 | Confident | 69 Ų | 69 | 78.3 Ų | 78.3 | 42% | 0.423 | 43% | 0.426 | S | S | . | . | trans | -69.2 | 158.9 | 174.2 | 66.7 | 0 | 0 | 0 | 0 | 111.4 | Q290 S294 L295 R296 | Q290-T292 PolarHBondContact O-N 2.8Å; T292-S294 VanDerWaalsContact C-N 3.28Å; T292-S294 PolarHBondContact O-N 3.06Å; T292-L295 PolarHBondContact O-N 2.84Å; T292-L295 VanDerWaalsContact O-N 3.16Å; T292-L295 WeakPolarHBondContact OG1-CB 3.24Å; T292-L295 PolarHBondContact OG1-N 3.43Å; T292-R296 WeakPolarHBondContact O-CG 3.2Å; T292-R296 PolarHBondContact O-N 3.21Å | ||
| 293 | T | 85.2 | Confident | 87.7 | Confident | 62 Ų | 62 | 76.2 Ų | 76.2 | 38% | 0.38 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -54.9 | -44.2 | 173.9 | -58.5 | 0 | 0 | 0 | 0 | 111.8 | L26 L30 L295 R296 I297 | L26-T293 HydrophobicContact CD1-CG2 4.4Å; L30-T293 HydrophobicContact CD1-CG2 3.72Å; T293-L295 VanDerWaalsContact C-N 3.33Å; T293-L295 PolarHBondContact O-N 3.18Å; T293-R296 WeakPolarHBondContact O-CB 3.18Å; T293-R296 PolarHBondContact O-N 3.49Å; T293-I297 HydrophobicContact CG2-CD1 4.1Å; T293-I297 WeakPolarHBondContact O-CG1 3.36Å; T293-I297 PolarHBondContact O-N 2.96Å |
| 294 | S | 87.6 | Confident | 88 | Confident | 88 Ų | 88 | 73.8 Ų | 73.8 | 62% | 0.615 | 40% | 0.399 | S | S | * | . | H | α-helix | trans | -60.4 | -41.4 | 177.8 | -52.7 | 0 | 0 | 0 | 0 | 112.1 | T292 I297 M298 | T292-S294 VanDerWaalsContact C-N 3.28Å; T292-S294 PolarHBondContact O-N 3.06Å; S294-I297 PolarHBondContact O-N 3.01Å; S294-M298 WeakPolarHBondContact O-CB 3.28Å; S294-M298 PolarHBondContact O-N 2.92Å |
| 295 | L | 88.3 | Confident | 88.3 | Confident | 38 Ų | 38 | 75.3 Ų | 75.3 | 20% | 0.199 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -65.8 | -39.6 | 176.8 | -166 | 72 | 0 | 0 | 0 | 111.9 | M279 V289 T292 T293 M298 F299 | M279-L295 HydrophobicContact CE-CD1 3.58Å; M279-L295 HydrophobicContact CE-CD2 4.48Å; M279-L295 HydrophobicContact CE-CG 3.83Å; V289-L295 HydrophobicContact CG1-CD2 3.25Å; T292-L295 PolarHBondContact O-N 2.84Å; T292-L295 VanDerWaalsContact O-N 3.16Å; T292-L295 WeakPolarHBondContact OG1-CB 3.24Å; T292-L295 PolarHBondContact OG1-N 3.43Å; T293-L295 VanDerWaalsContact C-N 3.33Å; T293-L295 PolarHBondContact O-N 3.18Å; L295-M298 PolarHBondContact O-N 2.92Å; L295-F299 WeakPolarHBondContact O-CB 3.21Å; L295-F299 PolarHBondContact O-N 2.83Å |
| 296 | R | 88 | Confident | 88.6 | Confident | 154 Ų | 154 | 70.3 Ų | 70.3 | 58% | 0.581 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -61.7 | -43 | 174.3 | -67.3 | 178.6 | 178.7 | -165.4 | -1.8 | 111.6 | V291 T292 T293 F299 N300 | V291-R296 HydrophobicContact CG1-CG 3.56Å; T292-R296 WeakPolarHBondContact O-CG 3.2Å; T292-R296 PolarHBondContact O-N 3.21Å; T293-R296 WeakPolarHBondContact O-CB 3.18Å; T293-R296 PolarHBondContact O-N 3.49Å; R296-F299 PolarHBondContact O-N 3.24Å; R296-N300 PolarHBondContact O-N 3.17Å; R296-N300 VanDerWaalsContact O-N 3.09Å; R296-N300 PolarHBondContact O-ND2 3.42Å |
| 297 | I | 89.9 | Confident | 89 | Confident | 57 Ų | 57 | 67.1 Ų | 67.1 | 29% | 0.292 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -63 | -48.2 | 176.9 | -66 | 169.5 | 0 | 0 | 0 | 109.7 | V33 T293 S294 F299 N300 V301 | V33-I297 HydrophobicContact CG1-CG1 4.24Å; V33-I297 HydrophobicContact CG1-CG2 4.11Å; V33-I297 HydrophobicContact CG2-CD1 4.26Å; T293-I297 HydrophobicContact CG2-CD1 4.1Å; T293-I297 WeakPolarHBondContact O-CG1 3.36Å; T293-I297 PolarHBondContact O-N 2.96Å; S294-I297 PolarHBondContact O-N 3.01Å; I297-F299 VanDerWaalsContact C-N 3.34Å; I297-F299 PolarHBondContact O-N 3.2Å; I297-N300 PolarHBondContact O-N 2.9Å; I297-V301 HydrophobicContact CG2-CG2 4.44Å; I297-V301 WeakPolarHBondContact O-CG2 3.4Å; I297-V301 PolarHBondContact O-N 3Å |
| 298 | M | 92.2 | Very high | 89.9 | Confident | 101 Ų | 101 | 64.4 Ų | 64.4 | 50% | 0.498 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -57.8 | -45.5 | 177.5 | -175 | -174.8 | -64.3 | 0 | 0 | 111.9 | S294 L295 N300 V301 I302 | S294-M298 WeakPolarHBondContact O-CB 3.28Å; S294-M298 PolarHBondContact O-N 2.92Å; L295-M298 PolarHBondContact O-N 2.92Å; M298-N300 VanDerWaalsContact C-N 3.34Å; M298-N300 PolarHBondContact O-N 3.21Å; M298-V301 PolarHBondContact O-N 2.83Å; M298-I302 HydrophobicContact CG-CD1 3.73Å; M298-I302 HydrophobicContact CG-CG1 4.33Å; M298-I302 WeakPolarHBondContact O-CB 3.33Å; M298-I302 VanDerWaalsContact O-CG1 3.3Å; M298-I302 WeakPolarHBondContact O-CG1 3.4Å; M298-I302 PolarHBondContact O-N 3.19Å; M298-I302 HydrophobicContact SD-CD1 4.32Å |
| 299 | F | 91.6 | Very high | 90.6 | Very high | 67 Ų | 67 | 57.7 Ų | 57.7 | 29% | 0.294 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -57.7 | -46.2 | 176.5 | -174 | -90.6 | 0 | 0 | 0 | 111.6 | M279 V283 L295 R296 I297 V301 I302 H303 | M279-F299 HydrophobicContact CE-CB 4.05Å; M279-F299 HydrophobicContact CE-CD2 3.94Å; M279-F299 HydrophobicContact CG-CD2 3.89Å; V283-F299 HydrophobicContact CG2-CD2 4.28Å; V283-F299 HydrophobicContact CG2-CE2 4.35Å; L295-F299 WeakPolarHBondContact O-CB 3.21Å; L295-F299 PolarHBondContact O-N 2.83Å; R296-F299 PolarHBondContact O-N 3.24Å; I297-F299 VanDerWaalsContact C-N 3.34Å; I297-F299 PolarHBondContact O-N 3.2Å; F299-V301 PolarHBondContact O-N 3.5Å; F299-I302 PolarHBondContact O-N 3.23Å; F299-H303 AromaticContact CD1-CE1 3.78Å; F299-H303 AromaticContact CD1-ND1 3.62Å; F299-H303 AromaticContact CD2-CE1 3.7Å; F299-H303 AromaticContact CE1-CE1 3.32Å; F299-H303 WeakPolarHBondContact CE1-CE1 3.3Å; F299-H303 AromaticContact CE1-ND1 3.53Å; F299-H303 AromaticContact CE1-NE2 3.83Å; F299-H303 AromaticContact CE2-CE1 3.25Å; F299-H303 WeakPolarHBondContact CE2-CE1 3.33Å; F299-H303 AromaticContact CG-CE1 3.97Å; F299-H303 AromaticContact CG-ND1 3.9Å; F299-H303 AromaticContact CZ-CE1 3.03Å; F299-H303 WeakPolarHBondContact CZ-CE1 3.32Å; F299-H303 AromaticContact CZ-ND1 3.75Å; F299-H303 AromaticContact CZ-NE2 3.51Å; F299-H303 PolarHBondContact O-N 2.66Å; F299-H303 VanDerWaalsContact O-N 3.07Å; F299-H303 PolarHBondContact O-ND1 2.98Å |
| 300 | N | 92 | Very high | 91.2 | Very high | 41 Ų | 41 | 56 Ų | 56 | 22% | 0.219 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 176.9 | -79.7 | -75.2 | 0 | 0 | 0 | 112.4 | L37 R93 R296 I297 M298 H303 | L37-N300 HydrophobicContact CD1-CB 3.97Å; R93-N300 PolarHBondContact NH2-OD1 2.98Å; R296-N300 PolarHBondContact O-N 3.17Å; R296-N300 VanDerWaalsContact O-N 3.09Å; R296-N300 PolarHBondContact O-ND2 3.42Å; I297-N300 PolarHBondContact O-N 2.9Å; M298-N300 VanDerWaalsContact C-N 3.34Å; M298-N300 PolarHBondContact O-N 3.21Å; N300-H303 PolarHBondContact O-N 3.37Å |
| 301 | V | 93.7 | Very high | 91.7 | Very high | 72 Ų | 72 | 48.4 Ų | 48.4 | 44% | 0.436 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -65.2 | -43.6 | 177.2 | 172.4 | 0 | 0 | 0 | 0 | 111.2 | L37 I297 M298 F299 H303 I304 | L37-V301 HydrophobicContact CD2-CG2 4.16Å; I297-V301 HydrophobicContact CG2-CG2 4.44Å; I297-V301 WeakPolarHBondContact O-CG2 3.4Å; I297-V301 PolarHBondContact O-N 3Å; M298-V301 PolarHBondContact O-N 2.83Å; F299-V301 PolarHBondContact O-N 3.5Å; V301-H303 VanDerWaalsContact C-N 3.28Å; V301-H303 PolarHBondContact O-N 2.86Å; V301-I304 VanDerWaalsContact O-CB 3.31Å; V301-I304 WeakPolarHBondContact O-CB 3.4Å; V301-I304 PolarHBondContact O-N 3.49Å; V301-I304 VanDerWaalsContact O-N 3.07Å |
| 302 | I | 95.6 | Very high | 92.2 | Very high | 21 Ų | 21 | 45.3 Ų | 45.3 | 11% | 0.108 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.6 | -36.3 | 179.1 | -73.8 | 173.8 | 0 | 0 | 0 | 111.4 | P275 M279 M298 F299 I304 L305 | P275-I302 HydrophobicContact CB-CG2 4.48Å; M279-I302 HydrophobicContact CB-CD1 3.82Å; M279-I302 HydrophobicContact CB-CG2 4.07Å; M279-I302 HydrophobicContact CG-CD1 3.87Å; M279-I302 HydrophobicContact SD-CD1 4.19Å; M298-I302 HydrophobicContact CG-CD1 3.73Å; M298-I302 HydrophobicContact CG-CG1 4.33Å; M298-I302 WeakPolarHBondContact O-CB 3.33Å; M298-I302 VanDerWaalsContact O-CG1 3.3Å; M298-I302 WeakPolarHBondContact O-CG1 3.4Å; M298-I302 PolarHBondContact O-N 3.19Å; M298-I302 HydrophobicContact SD-CD1 4.32Å; F299-I302 PolarHBondContact O-N 3.23Å; I302-I304 PolarHBondContact O-N 2.94Å; I302-L305 WeakPolarHBondContact O-CB 3.29Å; I302-L305 WeakPolarHBondContact O-CG 3.37Å; I302-L305 PolarHBondContact O-N 3.28Å; I302-L305 VanDerWaalsContact O-N 3.1Å |
| 303 | H | 94.5 | Very high | 92.2 | Very high | 38 Ų | 38 | 42.2 Ų | 42.2 | 18% | 0.176 | 22% | 0.221 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.3 | -10.7 | 177.1 | -77.2 | 69.8 | 0 | 0 | 0 | 113.9 | Y276 F299 N300 V301 Y307 | Y276-H303 AromaticContact CE2-CD2 3.73Å; Y276-H303 AromaticContact CE2-NE2 3.59Å; F299-H303 AromaticContact CD1-CE1 3.78Å; F299-H303 AromaticContact CD1-ND1 3.62Å; F299-H303 AromaticContact CD2-CE1 3.7Å; F299-H303 AromaticContact CE1-CE1 3.32Å; F299-H303 WeakPolarHBondContact CE1-CE1 3.3Å; F299-H303 AromaticContact CE1-ND1 3.53Å; F299-H303 AromaticContact CE1-NE2 3.83Å; F299-H303 AromaticContact CE2-CE1 3.25Å; F299-H303 WeakPolarHBondContact CE2-CE1 3.33Å; F299-H303 AromaticContact CG-CE1 3.97Å; F299-H303 AromaticContact CG-ND1 3.9Å; F299-H303 AromaticContact CZ-CE1 3.03Å; F299-H303 WeakPolarHBondContact CZ-CE1 3.32Å; F299-H303 AromaticContact CZ-ND1 3.75Å; F299-H303 AromaticContact CZ-NE2 3.51Å; F299-H303 PolarHBondContact O-N 2.66Å; F299-H303 VanDerWaalsContact O-N 3.07Å; F299-H303 PolarHBondContact O-ND1 2.98Å; N300-H303 PolarHBondContact O-N 3.37Å; V301-H303 VanDerWaalsContact C-N 3.28Å; V301-H303 PolarHBondContact O-N 2.86Å; H303-Y307 WeakPolarHBondContact O-CD2 3.45Å; H303-Y307 WeakPolarHBondContact O-CE2 3.24Å |
| 304 | I | 96.1 | Very high | 92.1 | Very high | 10 Ų | 10 | 39.5 Ų | 39.5 | 5% | 0.051 | 20% | 0.204 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -76.5 | -28.7 | 170.5 | -67.7 | 172.2 | 0 | 0 | 0 | 111.3 | L37 I40 Y41 L44 V301 I302 Y307 V308 | L37-I304 HydrophobicContact CD2-CD1 3.39Å; I40-I304 HydrophobicContact CG2-CD1 4.05Å; I40-I304 HydrophobicContact CG2-CG2 3.87Å; Y41-I304 HydrophobicContact CD1-CG1 4.47Å; Y41-I304 HydrophobicContact CE1-CD1 4.41Å; Y41-I304 HydrophobicContact CE1-CG1 3.67Å; Y41-I304 HydrophobicContact CE2-CD1 4.48Å; Y41-I304 HydrophobicContact CE2-CG1 4.44Å; L44-I304 HydrophobicContact CD1-CG2 3.48Å; L44-I304 VanDerWaalsContact CD1-CG2 3.48Å; V301-I304 VanDerWaalsContact O-CB 3.31Å; V301-I304 WeakPolarHBondContact O-CB 3.4Å; V301-I304 PolarHBondContact O-N 3.49Å; V301-I304 VanDerWaalsContact O-N 3.07Å; I302-I304 PolarHBondContact O-N 2.94Å; I304-Y307 WeakPolarHBondContact O-CA 3.34Å; I304-Y307 VanDerWaalsContact O-CB 3.29Å; I304-Y307 WeakPolarHBondContact O-CB 3.48Å; I304-Y307 PolarHBondContact O-N 3.18Å; I304-V308 HydrophobicContact CG2-CG2 4.11Å; I304-V308 PolarHBondContact O-N 2.77Å |
| 305 | L | 96.5 | Very high | 91.7 | Very high | 44 Ų | 44 | 39.1 Ų | 39.1 | 23% | 0.23 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -58.8 | -40.8 | -170.3 | -61.5 | 177.9 | 0 | 0 | 0 | 114.6 | C272 P275 I302 Y307 V308 S309 | C272-L305 HydrophobicContact CB-CB 4.12Å; C272-L305 WeakPolarHBondContact CB-O 3.37Å; C272-L305 WeakPolarHBondContact O-CB 3.17Å; P275-L305 HydrophobicContact CB-CD1 3.76Å; P275-L305 HydrophobicContact CG-CD1 3.83Å; I302-L305 WeakPolarHBondContact O-CB 3.29Å; I302-L305 WeakPolarHBondContact O-CG 3.37Å; I302-L305 PolarHBondContact O-N 3.28Å; I302-L305 VanDerWaalsContact O-N 3.1Å; L305-Y307 PolarHBondContact O-N 3.41Å; L305-V308 WeakPolarHBondContact O-CA 3.45Å; L305-V308 WeakPolarHBondContact O-CB 3.38Å; L305-V308 PolarHBondContact O-N 3.42Å; L305-S309 PolarHBondContact O-N 3.25Å |
| 306 | P | 96 | Very high | 91.3 | Very high | 4 Ų | 4 | 38.4 Ų | 38.4 | 3% | 0.026 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58.8 | -34.1 | 174.2 | -26.3 | 36.6 | 0 | 0 | 0 | 113.5 | F82 K116 W273 Y276 S309 C310 | F82-P306 HydrophobicContact CE1-CB 4.34Å; F82-P306 HydrophobicContact CZ-CB 4.3Å; K116-P306 HydrophobicContact CD-CB 3.78Å; K116-P306 HydrophobicContact CD-CG 4.28Å; K116-P306 HydrophobicContact CG-CB 4.02Å; W273-P306 HydrophobicContact CZ2-CB 4.26Å; Y276-P306 HydrophobicContact CD2-CG 3.87Å; Y276-P306 HydrophobicContact CE2-CG 4.4Å; Y276-P306 HydrophobicContact CG-CG 4.09Å; P306-S309 WeakPolarHBondContact O-CB 3.32Å; P306-S309 PolarHBondContact O-N 2.81Å; P306-C310 PolarHBondContact O-N 3.04Å; P306-C310 VanDerWaalsContact O-N 3.17Å |
| 307 | Y | 95.9 | Very high | 90.7 | Very high | 7 Ų | 7 | 31.8 Ų | 31.8 | 3% | 0.027 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -67.1 | -37.3 | 173.2 | -61.6 | -85.1 | 0 | 0 | 0 | 111.5 | Y41 F82 L86 E112 H303 I304 L305 S309 C310 V311 | Y41-Y307 HydrophobicContact CE1-CD2 4.23Å; Y41-Y307 HydrophobicContact CE1-CE2 4.22Å; F82-Y307 HydrophobicContact CD1-CD1 4.2Å; F82-Y307 HydrophobicContact CD1-CE1 4.43Å; F82-Y307 HydrophobicContact CD2-CD1 4.3Å; F82-Y307 AromaticContact CD2-CE1 3.72Å; F82-Y307 HydrophobicContact CD2-CE1 3.72Å; F82-Y307 AromaticContact CE1-CD1 3.64Å; F82-Y307 HydrophobicContact CE1-CD1 3.64Å; F82-Y307 AromaticContact CE1-CE1 3.93Å; F82-Y307 HydrophobicContact CE1-CE1 3.93Å; F82-Y307 HydrophobicContact CE1-CG 4.01Å; F82-Y307 AromaticContact CE2-CD1 3.75Å; F82-Y307 HydrophobicContact CE2-CD1 3.75Å; F82-Y307 AromaticContact CE2-CE1 3.11Å; F82-Y307 HydrophobicContact CE2-CE1 3.11Å; F82-Y307 HydrophobicContact CE2-CE2 4.13Å; F82-Y307 HydrophobicContact CE2-CG 4.49Å; F82-Y307 AromaticContact CE2-CZ 3.33Å; F82-Y307 WeakPolarHBondContact CE2-OH 3.13Å; F82-Y307 HydrophobicContact CG-CD1 4.49Å; F82-Y307 HydrophobicContact CG-CE1 4.33Å; F82-Y307 AromaticContact CZ-CD1 3.38Å; F82-Y307 HydrophobicContact CZ-CD1 3.38Å; F82-Y307 AromaticContact CZ-CD2 3.97Å; F82-Y307 HydrophobicContact CZ-CD2 3.97Å; F82-Y307 AromaticContact CZ-CE1 3.23Å; F82-Y307 HydrophobicContact CZ-CE1 3.23Å; F82-Y307 AromaticContact CZ-CE2 3.82Å; F82-Y307 HydrophobicContact CZ-CE2 3.82Å; F82-Y307 AromaticContact CZ-CG 3.76Å; F82-Y307 HydrophobicContact CZ-CG 3.76Å; F82-Y307 AromaticContact CZ-CZ 3.45Å; F82-Y307 VanDerWaalsContact CZ-CZ 3.45Å; L86-Y307 HydrophobicContact CD1-CD1 4.1Å; L86-Y307 HydrophobicContact CD2-CD1 3.62Å; L86-Y307 HydrophobicContact CD2-CE1 3.35Å; L86-Y307 HydrophobicContact CD2-CE2 4.46Å; L86-Y307 HydrophobicContact CD2-CG 4.26Å; L86-Y307 HydrophobicContact CG-CD1 4.06Å; L86-Y307 HydrophobicContact CG-CE1 3.97Å; E112-Y307 PolarHBondContact OE1-OH 3.03Å; H303-Y307 WeakPolarHBondContact O-CD2 3.45Å; H303-Y307 WeakPolarHBondContact O-CE2 3.24Å; I304-Y307 WeakPolarHBondContact O-CA 3.34Å; I304-Y307 VanDerWaalsContact O-CB 3.29Å; I304-Y307 WeakPolarHBondContact O-CB 3.48Å; I304-Y307 PolarHBondContact O-N 3.18Å; L305-Y307 PolarHBondContact O-N 3.41Å; Y307-S309 VanDerWaalsContact C-N 3.29Å; Y307-S309 PolarHBondContact O-N 3.45Å; Y307-C310 PolarHBondContact O-N 3.45Å; Y307-C310 PolarHBondContact O-SG 3.33Å; Y307-V311 WeakPolarHBondContact O-CG1 3.5Å; Y307-V311 PolarHBondContact O-N 2.98Å |
| 308 | V | 95.5 | Very high | 89.6 | Confident | 46 Ų | 46 | 30.4 Ų | 30.4 | 28% | 0.279 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -61 | -41.2 | 172.4 | -177.6 | 0 | 0 | 0 | 0 | 110.7 | L44 I304 L305 C310 V311 T312 | L44-V308 HydrophobicContact CD1-CG2 4.5Å; L44-V308 HydrophobicContact CD2-CG2 4.05Å; I304-V308 HydrophobicContact CG2-CG2 4.11Å; I304-V308 PolarHBondContact O-N 2.77Å; L305-V308 WeakPolarHBondContact O-CA 3.45Å; L305-V308 WeakPolarHBondContact O-CB 3.38Å; L305-V308 PolarHBondContact O-N 3.42Å; V308-C310 VanDerWaalsContact C-N 3.33Å; V308-C310 PolarHBondContact O-N 2.91Å; V308-V311 WeakPolarHBondContact O-CG2 3.39Å; V308-T312 HydrophobicContact CG1-CG2 4.28Å; V308-T312 WeakPolarHBondContact O-CG2 3.23Å; V308-T312 PolarHBondContact O-N 3.07Å; V308-T312 PolarHBondContact O-OG1 2.95Å |
| 309 | S | 94 | Very high | 88.3 | Confident | 2 Ų | 2 | 30.4 Ų | 30.4 | 1% | 0.014 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -61.4 | -37.7 | 177.1 | -168.5 | 0 | 0 | 0 | 0 | 112.9 | L305 P306 Y307 T312 | L305-S309 PolarHBondContact O-N 3.25Å; P306-S309 WeakPolarHBondContact O-CB 3.32Å; P306-S309 PolarHBondContact O-N 2.81Å; Y307-S309 VanDerWaalsContact C-N 3.29Å; Y307-S309 PolarHBondContact O-N 3.45Å; S309-T312 PolarHBondContact O-OG1 3.31Å |
| 310 | C | 92.6 | Very high | 86.9 | Confident | 1 Ų | 1 | 29.2 Ų | 29.2 | 1% | 0.007 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -77.5 | -34.7 | -176.8 | 76.6 | 0 | 0 | 0 | 0 | 113 | N51 D79 F82 P306 Y307 V308 | N51-C310 PolarHBondContact ND2-O 3.44Å; D79-C310 HydrophobicContact CB-CB 3.97Å; D79-C310 WeakPolarHBondContact OD1-CB 3.44Å; F82-C310 HydrophobicContact CD1-CB 4.04Å; F82-C310 HydrophobicContact CE1-CB 4.47Å; P306-C310 PolarHBondContact O-N 3.04Å; P306-C310 VanDerWaalsContact O-N 3.17Å; Y307-C310 PolarHBondContact O-N 3.45Å; Y307-C310 PolarHBondContact O-SG 3.33Å; V308-C310 VanDerWaalsContact C-N 3.33Å; V308-C310 PolarHBondContact O-N 2.91Å |
| 311 | V | 92 | Very high | 85.4 | Confident | 3 Ų | 3 | 29.6 Ų | 29.6 | 2% | 0.018 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -79.3 | -21.5 | -178.7 | -55.3 | 0 | 0 | 0 | 0 | 113.2 | L44 L47 I83 Y307 V308 | L44-V311 HydrophobicContact CD2-CG1 4.4Å; L44-V311 HydrophobicContact CD2-CG2 3.71Å; L44-V311 WeakPolarHBondContact O-CG1 3.43Å; L47-V311 HydrophobicContact CB-CB 4.08Å; L47-V311 HydrophobicContact CB-CG1 4.47Å; L47-V311 HydrophobicContact CB-CG2 4.35Å; L47-V311 HydrophobicContact CD1-CG2 4.45Å; I83-V311 HydrophobicContact CG2-CG1 4.21Å; Y307-V311 WeakPolarHBondContact O-CG1 3.5Å; Y307-V311 PolarHBondContact O-N 2.98Å; V308-V311 WeakPolarHBondContact O-CG2 3.39Å |
| 312 | T | 90.8 | Very high | 83.4 | Confident | 27 Ų | 27 | 29.3 Ų | 29.3 | 17% | 0.166 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -76.6 | -23.7 | 179.3 | 50 | 0 | 0 | 0 | 0 | 112.6 | C268 V308 S309 L315 L316 | C268-T312 PolarHBondContact SG-OG1 3.33Å; V308-T312 HydrophobicContact CG1-CG2 4.28Å; V308-T312 WeakPolarHBondContact O-CG2 3.23Å; V308-T312 PolarHBondContact O-N 3.07Å; V308-T312 PolarHBondContact O-OG1 2.95Å; S309-T312 PolarHBondContact O-OG1 3.31Å; T312-L315 WeakPolarHBondContact O-CB 3.29Å; T312-L315 PolarHBondContact O-N 3.38Å; T312-L315 VanDerWaalsContact O-N 3.15Å; T312-L316 WeakPolarHBondContact O-CG 3.26Å; T312-L316 PolarHBondContact O-N 3.05Å |
| 313 | N | 88.2 | Confident | 81.5 | Confident | 4 Ų | 4 | 34.7 Ų | 34.7 | 2% | 0.021 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -50 | -62.2 | 179.6 | -76 | -24.3 | 0 | 0 | 0 | 112.1 | L75 D79 L315 L316 Y317 | L75-N313 HydrophobicContact CD2-CB 4.45Å; D79-N313 PolarHBondContact OD2-ND2 3.26Å; N313-L315 VanDerWaalsContact C-N 3.29Å; N313-L315 PolarHBondContact O-N 3.35Å; N313-L316 PolarHBondContact O-N 3.04Å; N313-L316 VanDerWaalsContact O-N 3.1Å; N313-Y317 VanDerWaalsContact C-CD2 3.42Å; N313-Y317 HydrophobicContact CB-CD2 4.38Å; N313-Y317 HydrophobicContact CB-CE2 4.01Å; N313-Y317 WeakPolarHBondContact O-CD2 3.39Å; N313-Y317 PolarHBondContact O-N 3.17Å |
| 314 | P | 83.4 | Confident | 79.4 | Confident | 5 Ų | 5 | 35.2 Ų | 35.2 | 3% | 0.032 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -49.7 | -44.9 | 175 | -33.4 | 38.2 | 0 | 0 | 0 | 114.5 | S50 N51 I54 L316 Y317 A318 | S50-P314 WeakPolarHBondContact OG-CB 3.36Å; S50-P314 WeakPolarHBondContact OG-CG 3.39Å; N51-P314 HydrophobicContact CB-CG 4.44Å; N51-P314 VanDerWaalsContact CG-CG 3.46Å; N51-P314 WeakPolarHBondContact OD1-CD 3.24Å; N51-P314 WeakPolarHBondContact OD1-CG 3.48Å; I54-P314 HydrophobicContact CD1-CB 3.5Å; I54-P314 HydrophobicContact CD1-CG 3.67Å; P314-L316 VanDerWaalsContact C-N 3.32Å; P314-L316 PolarHBondContact O-N 3.07Å; P314-Y317 PolarHBondContact O-N 2.93Å; P314-A318 WeakPolarHBondContact O-CB 3.26Å; P314-A318 PolarHBondContact O-N 2.73Å |
| 315 | L | 78.4 | Confident | 77.4 | Confident | 80 Ų | 80 | 38.9 Ų | 38.9 | 42% | 0.419 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -61.3 | -44.7 | -178.9 | -62.9 | 174.7 | 0 | 0 | 0 | 110.1 | T312 N313 A318 L319 | T312-L315 WeakPolarHBondContact O-CB 3.29Å; T312-L315 PolarHBondContact O-N 3.38Å; T312-L315 VanDerWaalsContact O-N 3.15Å; N313-L315 VanDerWaalsContact C-N 3.29Å; N313-L315 PolarHBondContact O-N 3.35Å; L315-A318 PolarHBondContact O-N 3.03Å; L315-L319 VanDerWaalsContact O-CB 3.25Å; L315-L319 WeakPolarHBondContact O-CB 3.46Å; L315-L319 WeakPolarHBondContact O-CD1 3.26Å; L315-L319 WeakPolarHBondContact O-CG 3.22Å; L315-L319 PolarHBondContact O-N 3.24Å |
| 316 | L | 80.9 | Confident | 75.3 | Confident | 22 Ų | 22 | 40.7 Ų | 40.7 | 12% | 0.115 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -66.4 | -44.2 | 176.8 | -64 | 176.1 | 0 | 0 | 0 | 111.6 | I265 C268 T312 N313 P314 A318 F320 | I265-L316 HydrophobicContact CB-CD1 4.3Å; I265-L316 HydrophobicContact CG1-CB 3.98Å; I265-L316 HydrophobicContact CG1-CD1 3.59Å; I265-L316 HydrophobicContact CG1-CG 4.41Å; C268-L316 HydrophobicContact CB-CD1 4.41Å; T312-L316 WeakPolarHBondContact O-CG 3.26Å; T312-L316 PolarHBondContact O-N 3.05Å; N313-L316 PolarHBondContact O-N 3.04Å; N313-L316 VanDerWaalsContact O-N 3.1Å; P314-L316 VanDerWaalsContact C-N 3.32Å; P314-L316 PolarHBondContact O-N 3.07Å; L316-A318 VanDerWaalsContact C-N 3.32Å; L316-A318 PolarHBondContact O-N 3Å; L316-F320 HydrophobicContact CD2-CE2 4.06Å; L316-F320 VanDerWaalsContact O-CD2 3.24Å; L316-F320 WeakPolarHBondContact O-CD2 3.43Å; L316-F320 PolarHBondContact O-N 3.08Å |
| 317 | Y | 74.2 | Confident | 73.5 | Confident | 16 Ų | 16 | 41.3 Ų | 41.3 | 6% | 0.063 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.4 | -42.3 | 174.7 | -69.5 | -70.2 | 0 | 0 | 0 | 111.9 | I72 L75 L126 M261 I265 N313 P314 T321 | I72-Y317 HydrophobicContact CD1-CD1 4.06Å; I72-Y317 HydrophobicContact CD1-CE1 4.12Å; I72-Y317 HydrophobicContact CG1-CE1 4.3Å; L75-Y317 HydrophobicContact CD2-CE2 3.95Å; L126-Y317 VanDerWaalsContact CD1-OH 3.24Å; L126-Y317 WeakPolarHBondContact CD1-OH 3.42Å; M261-Y317 HydrophobicContact CE-CD1 3.04Å; M261-Y317 HydrophobicContact CE-CE1 3.16Å; M261-Y317 HydrophobicContact CE-CG 4.02Å; I265-Y317 HydrophobicContact CD1-CE1 4.14Å; N313-Y317 VanDerWaalsContact C-CD2 3.42Å; N313-Y317 HydrophobicContact CB-CD2 4.38Å; N313-Y317 HydrophobicContact CB-CE2 4.01Å; N313-Y317 WeakPolarHBondContact O-CD2 3.39Å; N313-Y317 PolarHBondContact O-N 3.17Å; P314-Y317 PolarHBondContact O-N 2.93Å; Y317-T321 WeakPolarHBondContact O-CB 3.24Å; Y317-T321 PolarHBondContact O-N 3.29Å; Y317-T321 PolarHBondContact O-OG1 2.92Å |
| 318 | A | 68.5 | Low | 71.5 | Confident | 27 Ų | 27 | 44.3 Ų | 44.3 | 22% | 0.223 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -69.7 | -44.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | P314 L315 L316 F320 F324 K325 | P314-A318 WeakPolarHBondContact O-CB 3.26Å; P314-A318 PolarHBondContact O-N 2.73Å; L315-A318 PolarHBondContact O-N 3.03Å; L316-A318 VanDerWaalsContact C-N 3.32Å; L316-A318 PolarHBondContact O-N 3Å; A318-F320 VanDerWaalsContact C-N 3.28Å; A318-F320 PolarHBondContact O-N 3.47Å; A318-F324 VanDerWaalsContact CA-CD1 3.46Å; A318-F324 HydrophobicContact CB-CD1 3.46Å; A318-F324 VanDerWaalsContact CB-CD1 3.46Å; A318-F324 HydrophobicContact CB-CE1 3.58Å; A318-K325 WeakPolarHBondContact O-CE 3.04Å; A318-K325 WeakPolarHBondContact O-CG 3.27Å |
| 319 | L | 64.8 | Low | 69.7 | Low | 101 Ų | 101 | 47.9 Ų | 47.9 | 53% | 0.529 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -64.2 | -34.3 | -178.6 | -73.6 | 171.2 | 0 | 0 | 0 | 112.2 | L315 K325 | L315-L319 VanDerWaalsContact O-CB 3.25Å; L315-L319 WeakPolarHBondContact O-CB 3.46Å; L315-L319 WeakPolarHBondContact O-CD1 3.26Å; L315-L319 WeakPolarHBondContact O-CG 3.22Å; L315-L319 PolarHBondContact O-N 3.24Å; L319-K325 VanDerWaalsContact C-CE 3.48Å; L319-K325 WeakPolarHBondContact O-CE 3.19Å; L319-K325 PolarHBondContact O-NZ 3.12Å |
| 320 | F | 60.8 | Low | 68 | Low | 42 Ų | 42 | 49.8 Ų | 49.8 | 18% | 0.184 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -108.4 | -7.8 | -173.4 | -64.2 | -72.4 | 0 | 0 | 0 | 115.5 | R257 R260 M261 L316 A318 | R257-F320 WeakPolarHBondContact CD-O 3.16Å; R257-F320 HydrophobicContact CG-CB 4.18Å; R257-F320 HydrophobicContact CG-CD1 4.06Å; R257-F320 VanDerWaalsContact CG-O 3.23Å; R257-F320 WeakPolarHBondContact CG-O 3.4Å; R260-F320 HydrophobicContact CB-CD1 4.13Å; R260-F320 HydrophobicContact CB-CE1 3.57Å; R260-F320 HydrophobicContact CB-CZ 4.12Å; M261-F320 HydrophobicContact CB-CB 3.45Å; M261-F320 VanDerWaalsContact CB-CB 3.45Å; M261-F320 HydrophobicContact CB-CD1 4.28Å; M261-F320 HydrophobicContact CB-CD2 3.71Å; M261-F320 HydrophobicContact CB-CG 3.56Å; M261-F320 HydrophobicContact CG-CB 3.54Å; M261-F320 HydrophobicContact CG-CD2 3.78Å; M261-F320 HydrophobicContact CG-CG 3.91Å; M261-F320 HydrophobicContact SD-CB 3.75Å; L316-F320 HydrophobicContact CD2-CE2 4.06Å; L316-F320 VanDerWaalsContact O-CD2 3.24Å; L316-F320 WeakPolarHBondContact O-CD2 3.43Å; L316-F320 PolarHBondContact O-N 3.08Å; A318-F320 VanDerWaalsContact C-N 3.28Å; A318-F320 PolarHBondContact O-N 3.47Å |
| 321 | T | 61.7 | Low | 66.5 | Low | 50 Ų | 50 | 53 Ų | 53 | 31% | 0.307 | 28% | 0.279 | S | S | . | . | trans | -105.2 | 107.2 | 175.4 | -47.6 | 0 | 0 | 0 | 0 | 110 | Y317 H323 F324 K325 | Y317-T321 WeakPolarHBondContact O-CB 3.24Å; Y317-T321 PolarHBondContact O-N 3.29Å; Y317-T321 PolarHBondContact O-OG1 2.92Å; T321-H323 HydrophobicContact CG2-CB 4.07Å; T321-H323 PolarHBondContact O-N 3.17Å; T321-F324 HydrophobicContact CG2-CB 4.23Å; T321-F324 PolarHBondContact O-N 3.22Å; T321-K325 PolarHBondContact O-N 2.85Å | ||
| 322 | S | 51.9 | Low | 65 | Low | 66 Ų | 66 | 57.1 Ų | 57.1 | 46% | 0.462 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -58.6 | -34.8 | 177.3 | 42.7 | 0 | 0 | 0 | 0 | 112.6 | R257 K325 E326 | R257-S322 PolarHBondContact NH1-OG 3.49Å; S322-K325 PolarHBondContact O-N 3.42Å; S322-E326 WeakPolarHBondContact O-CB 3.5Å; S322-E326 PolarHBondContact O-N 3.35Å |
| 323 | H | 53.9 | Low | 63.8 | Low | 133 Ų | 133 | 64.8 Ų | 64.8 | 62% | 0.616 | 34% | 0.34 | S | S | * | . | H | α-helix | trans | -62.6 | -41.8 | 174.8 | -175.4 | -82.5 | 0 | 0 | 0 | 111.7 | T321 E326 V327 | T321-H323 HydrophobicContact CG2-CB 4.07Å; T321-H323 PolarHBondContact O-N 3.17Å; H323-E326 PolarHBondContact O-N 3.22Å; H323-V327 WeakPolarHBondContact O-CB 3.17Å; H323-V327 VanDerWaalsContact O-CG2 3.24Å; H323-V327 WeakPolarHBondContact O-CG2 3.46Å; H323-V327 PolarHBondContact O-N 3.45Å |
| 324 | F | 50.8 | Low | 62 | Low | 49 Ų | 49 | 67.9 Ų | 67.9 | 22% | 0.215 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -67.7 | -44.1 | 176.9 | -167 | -92.1 | 0 | 0 | 0 | 111.3 | I54 A318 T321 E326 V327 V328 | I54-F324 HydrophobicContact CD1-CE2 4.31Å; I54-F324 HydrophobicContact CD1-CZ 3.87Å; I54-F324 HydrophobicContact CG1-CE2 3.94Å; I54-F324 HydrophobicContact CG1-CZ 3.68Å; A318-F324 VanDerWaalsContact CA-CD1 3.46Å; A318-F324 HydrophobicContact CB-CD1 3.46Å; A318-F324 VanDerWaalsContact CB-CD1 3.46Å; A318-F324 HydrophobicContact CB-CE1 3.58Å; T321-F324 HydrophobicContact CG2-CB 4.23Å; T321-F324 PolarHBondContact O-N 3.22Å; F324-E326 PolarHBondContact O-N 2.94Å; F324-V327 PolarHBondContact O-N 2.85Å; F324-V328 HydrophobicContact CD1-CG2 3.62Å; F324-V328 HydrophobicContact CE1-CG2 3.3Å; F324-V328 HydrophobicContact CE2-CG2 4.39Å; F324-V328 HydrophobicContact CG-CG2 4.34Å; F324-V328 HydrophobicContact CZ-CG2 3.73Å; F324-V328 WeakPolarHBondContact O-CB 3.41Å; F324-V328 WeakPolarHBondContact O-CG2 3.35Å; F324-V328 PolarHBondContact O-N 3.04Å |
| 325 | K | 53.8 | Low | 60.4 | Low | 87 Ų | 87 | 69.7 Ų | 69.7 | 38% | 0.378 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -55.9 | -40.4 | 174 | -65.6 | -167.8 | 179.7 | -179.3 | 0 | 112.3 | A318 L319 T321 S322 R329 | A318-K325 WeakPolarHBondContact O-CE 3.04Å; A318-K325 WeakPolarHBondContact O-CG 3.27Å; L319-K325 VanDerWaalsContact C-CE 3.48Å; L319-K325 WeakPolarHBondContact O-CE 3.19Å; L319-K325 PolarHBondContact O-NZ 3.12Å; T321-K325 PolarHBondContact O-N 2.85Å; S322-K325 PolarHBondContact O-N 3.42Å; K325-R329 VanDerWaalsContact O-CB 3.28Å; K325-R329 WeakPolarHBondContact O-CB 3.12Å; K325-R329 PolarHBondContact O-N 2.91Å |
| 326 | E | 54 | Low | 59 | Low | 83 Ų | 83 | 70.4 Ų | 70.4 | 39% | 0.388 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -75.3 | -39.3 | -179.7 | -171.2 | 157.5 | 163.3 | 0 | 0 | 112.8 | S322 H323 F324 R329 K330 | S322-E326 WeakPolarHBondContact O-CB 3.5Å; S322-E326 PolarHBondContact O-N 3.35Å; H323-E326 PolarHBondContact O-N 3.22Å; F324-E326 PolarHBondContact O-N 2.94Å; E326-R329 PolarHBondContact O-N 2.94Å; E326-K330 HydrophobicContact CG-CD 4.11Å; E326-K330 HydrophobicContact CG-CG 4.46Å; E326-K330 WeakPolarHBondContact O-CB 3.49Å; E326-K330 VanDerWaalsContact O-CG 3.3Å; E326-K330 WeakPolarHBondContact O-CG 3.45Å; E326-K330 PolarHBondContact O-N 3.34Å; E326-K330 WeakPolarHBondContact OE1-CE 3.41Å; E326-K330 IonicContact OE1-NZ 2.73Å; E326-K330 PolarHBondContact OE1-NZ 3.03Å |
| 327 | V | 57.6 | Low | 57.4 | Low | 17 Ų | 17 | 74.4 Ų | 74.4 | 10% | 0.103 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -62.4 | -46.3 | 172.8 | 167.5 | 0 | 0 | 0 | 0 | 111.1 | F57 H323 F324 K330 A331 | F57-V327 HydrophobicContact CD2-CG1 4.49Å; F57-V327 HydrophobicContact CE1-CG1 4.01Å; F57-V327 HydrophobicContact CE2-CG1 3.57Å; F57-V327 HydrophobicContact CZ-CG1 3.3Å; H323-V327 WeakPolarHBondContact O-CB 3.17Å; H323-V327 VanDerWaalsContact O-CG2 3.24Å; H323-V327 WeakPolarHBondContact O-CG2 3.46Å; H323-V327 PolarHBondContact O-N 3.45Å; F324-V327 PolarHBondContact O-N 2.85Å; V327-K330 PolarHBondContact O-N 3.4Å; V327-A331 VanDerWaalsContact O-CB 3.32Å; V327-A331 WeakPolarHBondContact O-CB 3.43Å; V327-A331 PolarHBondContact O-N 3.28Å |
| 328 | V | 54.2 | Low | 56.3 | Low | 70 Ų | 70 | 78.9 Ų | 78.9 | 42% | 0.424 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -63.2 | -45 | 175.6 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | F324 K330 A331 A332 | F324-V328 HydrophobicContact CD1-CG2 3.62Å; F324-V328 HydrophobicContact CE1-CG2 3.3Å; F324-V328 HydrophobicContact CE2-CG2 4.39Å; F324-V328 HydrophobicContact CG-CG2 4.34Å; F324-V328 HydrophobicContact CZ-CG2 3.73Å; F324-V328 WeakPolarHBondContact O-CB 3.41Å; F324-V328 WeakPolarHBondContact O-CG2 3.35Å; F324-V328 PolarHBondContact O-N 3.04Å; V328-K330 VanDerWaalsContact C-N 3.33Å; V328-K330 PolarHBondContact O-N 3.24Å; V328-A331 PolarHBondContact O-N 3.44Å; V328-A332 VanDerWaalsContact O-CB 3.23Å; V328-A332 WeakPolarHBondContact O-CB 3.49Å; V328-A332 PolarHBondContact O-N 3.17Å |
| 329 | R | 57.5 | Low | 55.1 | Low | 120 Ų | 120 | 83.4 Ų | 83.4 | 45% | 0.453 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -59.2 | -41.6 | 174.3 | -99.3 | -176 | -90.6 | 115 | -6.5 | 112.6 | K325 E326 R333 | K325-R329 VanDerWaalsContact O-CB 3.28Å; K325-R329 WeakPolarHBondContact O-CB 3.12Å; K325-R329 PolarHBondContact O-N 2.91Å; E326-R329 PolarHBondContact O-N 2.94Å; R329-R333 WeakPolarHBondContact O-CB 3.5Å; R329-R333 WeakPolarHBondContact O-CG 3.46Å; R329-R333 PolarHBondContact O-N 2.99Å; R329-R333 VanDerWaalsContact O-N 3.1Å |
| 330 | K | 57.8 | Low | 54.2 | Low | 42 Ų | 42 | 81.5 Ų | 81.5 | 18% | 0.183 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -72.3 | -38.3 | 179.8 | -75.9 | 178 | -179.3 | 170.5 | 0 | 112.1 | E326 V327 V328 R333 S335 | E326-K330 HydrophobicContact CG-CD 4.11Å; E326-K330 HydrophobicContact CG-CG 4.46Å; E326-K330 WeakPolarHBondContact O-CB 3.49Å; E326-K330 VanDerWaalsContact O-CG 3.3Å; E326-K330 WeakPolarHBondContact O-CG 3.45Å; E326-K330 PolarHBondContact O-N 3.34Å; E326-K330 WeakPolarHBondContact OE1-CE 3.41Å; E326-K330 IonicContact OE1-NZ 2.73Å; E326-K330 PolarHBondContact OE1-NZ 3.03Å; V327-K330 PolarHBondContact O-N 3.4Å; V328-K330 VanDerWaalsContact C-N 3.33Å; V328-K330 PolarHBondContact O-N 3.24Å; K330-R333 PolarHBondContact O-N 3.18Å; K330-S335 PolarHBondContact O-N 3.49Å; K330-S335 PolarHBondContact O-OG 3.32Å |
| 331 | A | 60.8 | Low | 53.4 | Low | 68 Ų | 68 | 83.5 Ų | 83.5 | 56% | 0.562 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -64.5 | -44.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | V327 V328 R333 G334 | V327-A331 VanDerWaalsContact O-CB 3.32Å; V327-A331 WeakPolarHBondContact O-CB 3.43Å; V327-A331 PolarHBondContact O-N 3.28Å; V328-A331 PolarHBondContact O-N 3.44Å; A331-R333 VanDerWaalsContact C-N 3.25Å; A331-R333 PolarHBondContact O-N 3.29Å; A331-G334 PolarHBondContact O-N 3.35Å; A331-G334 VanDerWaalsContact O-N 3.16Å |
| 332 | A | 61.4 | Low | 52.2 | Low | 90 Ų | 90 | 87.1 Ų | 87.1 | 74% | 0.744 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -65.2 | -26.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | V328 G334 | V328-A332 VanDerWaalsContact O-CB 3.23Å; V328-A332 WeakPolarHBondContact O-CB 3.49Å; V328-A332 PolarHBondContact O-N 3.17Å; A332-G334 VanDerWaalsContact C-N 3.3Å |
| 333 | R | 65.8 | Low | 51.6 | Low | 189 Ų | 189 | 88.3 Ų | 88.3 | 71% | 0.713 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.9 | 5.3 | 176 | -74.2 | 176 | -175.1 | -175.6 | -1.1 | 114 | R329 K330 A331 S335 | R329-R333 WeakPolarHBondContact O-CB 3.5Å; R329-R333 WeakPolarHBondContact O-CG 3.46Å; R329-R333 PolarHBondContact O-N 2.99Å; R329-R333 VanDerWaalsContact O-N 3.1Å; K330-R333 PolarHBondContact O-N 3.18Å; A331-R333 VanDerWaalsContact C-N 3.25Å; A331-R333 PolarHBondContact O-N 3.29Å; R333-S335 PolarHBondContact O-N 3.26Å |
| 334 | G | 50.4 | Low | 50.8 | Low | 69 Ų | 69 | 90 Ų | 90 | 71% | 0.711 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.5 | 20 | -179 | 0 | 0 | 0 | 0 | 0 | 114.2 | A331 A332 S336 | A331-G334 PolarHBondContact O-N 3.35Å; A331-G334 VanDerWaalsContact O-N 3.16Å; A332-G334 VanDerWaalsContact C-N 3.3Å; G334-S336 PolarHBondContact O-N 3.35Å |
| 335 | S | 49.2 | Very low | 50.1 | Low | 43 Ų | 43 | 90.5 Ų | 90.5 | 30% | 0.301 | 50% | 0.498 | S | S | . | . | trans | -68.1 | 124.2 | -172.1 | -43.3 | 0 | 0 | 0 | 0 | 110.7 | K330 R333 | K330-S335 PolarHBondContact O-N 3.49Å; K330-S335 PolarHBondContact O-OG 3.32Å; R333-S335 PolarHBondContact O-N 3.26Å | ||
| 336 | S | 48.3 | Very low | 49.2 | Very low | 94 Ų | 94 | 91.2 Ų | 91.2 | 66% | 0.657 | 51% | 0.505 | S | S | * | . | trans | -64.7 | 158 | -178.2 | 66 | 0 | 0 | 0 | 0 | 113.3 | G334 V338 | G334-S336 PolarHBondContact O-N 3.35Å; S336-V338 PolarHBondContact O-N 3.43Å | ||
| 337 | L | 49.2 | Very low | 48.1 | Very low | 106 Ų | 106 | 90.4 Ų | 90.4 | 56% | 0.555 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | -17.3 | -163.6 | -149.5 | 80.5 | 0 | 0 | 0 | 116.5 | Q339 L340 | L337-Q339 VanDerWaalsContact C-N 3.34Å; L337-Q339 PolarHBondContact O-N 3.06Å; L337-L340 PolarHBondContact O-N 3.29Å |
| 338 | V | 50.1 | Low | 47 | Very low | 111 Ų | 111 | 100.2 Ų | 100.2 | 67% | 0.673 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -68 | -31.6 | -172.3 | -179 | 0 | 0 | 0 | 0 | 112.4 | S336 T341 | S336-V338 PolarHBondContact O-N 3.43Å; V338-T341 PolarHBondContact O-OG1 2.7Å |
| 339 | Q | 44.1 | Very low | 45.9 | Very low | 121 Ų | 121 | 105 Ų | 105 | 57% | 0.565 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -79.7 | -17.7 | -179.8 | -73.4 | -175.3 | -11.6 | 0 | 0 | 114.1 | L337 | L337-Q339 VanDerWaalsContact C-N 3.34Å; L337-Q339 PolarHBondContact O-N 3.06Å |
| 340 | L | 44.6 | Very low | 44.6 | Very low | 62 Ų | 62 | 107.8 Ų | 107.8 | 33% | 0.325 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -84.5 | -29.3 | -178.3 | -94.6 | 141.2 | 0 | 0 | 0 | 112.9 | L337 | L337-L340 PolarHBondContact O-N 3.29Å |
| 341 | T | 44.2 | Very low | 43.5 | Very low | 84 Ų | 84 | 113.1 Ų | 113.1 | 52% | 0.515 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -76.4 | -29.1 | 177.3 | 47.6 | 0 | 0 | 0 | 0 | 112.7 | V338 L343 K344 | V338-T341 PolarHBondContact O-OG1 2.7Å; T341-L343 PolarHBondContact O-N 3.38Å; T341-L343 VanDerWaalsContact O-N 3.08Å; T341-K344 PolarHBondContact O-N 3Å |
| 342 | H | 37.7 | Very low | 42.2 | Very low | 125 Ų | 125 | 124.8 Ų | 124.8 | 58% | 0.579 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -60.9 | -22 | 179.7 | -143.8 | -83.4 | 0 | 0 | 0 | 113.4 | S345 I346 | H342-S345 WeakPolarHBondContact O-CB 3.44Å; H342-S345 PolarHBondContact O-N 3.21Å; H342-I346 WeakPolarHBondContact O-CG1 3.47Å; H342-I346 PolarHBondContact O-N 3.08Å |
| 343 | L | 38.8 | Very low | 41.3 | Very low | 91 Ų | 91 | 126.6 Ų | 126.6 | 48% | 0.476 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -83.7 | -15.1 | 175.4 | -80.8 | 159.6 | 0 | 0 | 0 | 114.6 | T341 S345 I346 G347 | T341-L343 PolarHBondContact O-N 3.38Å; T341-L343 VanDerWaalsContact O-N 3.08Å; L343-S345 PolarHBondContact O-N 3.29Å; L343-I346 HydrophobicContact CD2-CB 4.26Å; L343-I346 HydrophobicContact CD2-CD1 4.06Å; L343-G347 PolarHBondContact O-N 2.98Å |
| 344 | K | 37.4 | Very low | 40 | Very low | 169 Ų | 169 | 123.3 Ų | 123.3 | 74% | 0.735 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -67.1 | -26 | 165 | -85 | -177.3 | 177 | 175.7 | 0 | 111.5 | T341 | T341-K344 PolarHBondContact O-N 3Å |
| 345 | S | 35.2 | Very low | 39.4 | Very low | 60 Ų | 60 | 126.3 Ų | 126.3 | 42% | 0.42 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -79.7 | -47.6 | 176.4 | 151.4 | 0 | 0 | 0 | 0 | 111.5 | H342 L343 G347 R348 | H342-S345 WeakPolarHBondContact O-CB 3.44Å; H342-S345 PolarHBondContact O-N 3.21Å; L343-S345 PolarHBondContact O-N 3.29Å; S345-G347 VanDerWaalsContact C-N 3.31Å; S345-G347 PolarHBondContact O-N 3.13Å; S345-R348 PolarHBondContact O-N 3.33Å; S345-R348 VanDerWaalsContact O-N 3.13Å |
| 346 | I | 34.9 | Very low | 38.8 | Very low | 101 Ų | 101 | 131.2 Ų | 131.2 | 52% | 0.518 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -66.4 | -32.2 | -176.5 | -62.8 | 164.5 | 0 | 0 | 0 | 112.2 | H342 L343 R348 | H342-I346 WeakPolarHBondContact O-CG1 3.47Å; H342-I346 PolarHBondContact O-N 3.08Å; L343-I346 HydrophobicContact CD2-CB 4.26Å; L343-I346 HydrophobicContact CD2-CD1 4.06Å; I346-R348 VanDerWaalsContact C-N 3.27Å; I346-R348 PolarHBondContact O-N 3.3Å |
| 347 | G | 31.9 | Very low | 38.2 | Very low | 67 Ų | 67 | 133.5 Ų | 133.5 | 69% | 0.691 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | -13.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | L343 S345 | L343-G347 PolarHBondContact O-N 2.98Å; S345-G347 VanDerWaalsContact C-N 3.31Å; S345-G347 PolarHBondContact O-N 3.13Å |
| 348 | R | 32.7 | Very low | 37.5 | Very low | 222 Ų | 222 | 135.3 Ų | 135.3 | 84% | 0.838 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -13.9 | 178.5 | -78.3 | -170.7 | -171.3 | -176.8 | 3.1 | 114.2 | S345 I346 | S345-R348 PolarHBondContact O-N 3.33Å; S345-R348 VanDerWaalsContact O-N 3.13Å; I346-R348 VanDerWaalsContact C-N 3.27Å; I346-R348 PolarHBondContact O-N 3.3Å |
| 349 | F | 31.8 | Very low | 36.6 | Very low | 172 Ų | 172 | 137.1 Ų | 137.1 | 75% | 0.754 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -92.6 | 0.8 | -171.1 | -98.2 | -81.4 | 0 | 0 | 0 | 116.4 | ||
| 350 | H | 30 | Very low | 36 | Very low | 178 Ų | 178 | 138.3 Ų | 138.3 | 82% | 0.824 | 67% | 0.665 | S | S | * | * | S | Bend | trans | -132.1 | 57.3 | -180 | -87.3 | -6.2 | 0 | 0 | 0 | 113.6 | ||
| 351 | I | 35.1 | Very low | 35.3 | Very low | 153 Ų | 153 | 144.7 Ų | 144.7 | 79% | 0.785 | 69% | 0.693 | S | S | * | * | trans | -147.4 | 72.7 | 147.9 | -46.7 | 178.3 | 0 | 0 | 0 | 108 | ||||
| 352 | R | 34.4 | Very low | 34.5 | Very low | 314 Ų | 314 | 150.2 Ų | 150.2 | 100% | 1.185 | 71% | 0.709 | S | S | * | * | trans | -81.9 | 0 | 132.3 | -89.6 | -175.3 | 176.8 | -178.3 | -1 | 106.1 |
Retrieved 352 of 352 residues in 366 ms
(Link to these results)