| 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 | 55.8 | Low | 52.6 | Low | 223 Ų | 223 | 143.1 Ų | 143.1 | 100% | 1.099 | 68% | 0.684 | S | S | * | * | 0 | -14.4 | 0 | -87.5 | -178 | 169.5 | 0 | 0 | 115.3 | |||||
| 2 | A | 54.9 | Low | 52.8 | Low | 79 Ų | 79 | 139.3 Ų | 139.3 | 65% | 0.653 | 67% | 0.67 | S | S | * | * | trans | -78.6 | -28.5 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 3 | K | 51.1 | Low | 52.8 | Low | 174 Ų | 174 | 137 Ų | 137 | 76% | 0.757 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -70.5 | -44.5 | -176.3 | -163.1 | 168.9 | -179.8 | 179.1 | 0 | 112.7 | R5 R6 D7 | K3-R5 PolarHBondContact O-N 3.19Å; K3-R6 PolarHBondContact O-N 3.27Å; K3-R6 VanDerWaalsContact O-N 3.09Å; K3-D7 PolarHBondContact O-N 3.5Å |
| 4 | K | 46.2 | Very low | 53 | Low | 175 Ų | 175 | 136.4 Ų | 136.4 | 76% | 0.761 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -64.6 | -20.6 | 178.2 | -164.8 | 171.9 | -177 | 178.7 | 0 | 114.4 | V8 | K4-V8 WeakPolarHBondContact O-CG2 3.39Å |
| 5 | R | 49.7 | Very low | 53.2 | Low | 202 Ų | 202 | 130.9 Ų | 130.9 | 76% | 0.762 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -86.5 | -18.9 | 175.3 | -76.8 | -172 | 178.5 | -172.6 | 0.1 | 113.6 | K3 | K3-R5 PolarHBondContact O-N 3.19Å |
| 6 | R | 52.3 | Low | 53.4 | Low | 188 Ų | 188 | 126.6 Ų | 126.6 | 71% | 0.709 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -78.8 | -47.1 | 173.6 | -82.7 | -174.2 | -175 | 172.9 | 1.1 | 111 | K3 V8 R9 D10 | K3-R6 PolarHBondContact O-N 3.27Å; K3-R6 VanDerWaalsContact O-N 3.09Å; R6-V8 PolarHBondContact O-N 3.19Å; R6-R9 PolarHBondContact O-N 3.09Å; R6-D10 PolarHBondContact O-N 3.09Å |
| 7 | D | 51.5 | Low | 53.5 | Low | 101 Ų | 101 | 122.5 Ų | 122.5 | 54% | 0.54 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -60.9 | -32.2 | -177.9 | -60.6 | -31.4 | 0 | 0 | 0 | 113.1 | K3 A11 | K3-D7 PolarHBondContact O-N 3.5Å; D7-A11 PolarHBondContact O-N 3.01Å |
| 8 | V | 54.5 | Low | 53.6 | Low | 84 Ų | 84 | 118.2 Ų | 118.2 | 51% | 0.509 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -72.6 | -38.1 | 175.4 | 177.7 | 0 | 0 | 0 | 0 | 111.9 | K4 R6 A11 D12 | K4-V8 WeakPolarHBondContact O-CG2 3.39Å; R6-V8 PolarHBondContact O-N 3.19Å; V8-A11 PolarHBondContact O-N 3.4Å; V8-D12 PolarHBondContact O-N 3.03Å; V8-D12 VanDerWaalsContact O-N 3.09Å |
| 9 | R | 55 | Low | 53.6 | Low | 189 Ų | 189 | 119.3 Ų | 119.3 | 71% | 0.713 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -68.4 | -35.7 | 176.9 | -90.3 | -178.5 | -178.7 | 178.7 | -0.5 | 112.6 | R6 N13 | R6-R9 PolarHBondContact O-N 3.09Å; R9-N13 WeakPolarHBondContact O-CB 3.22Å; R9-N13 PolarHBondContact O-N 3.17Å |
| 10 | D | 53.4 | Low | 53.7 | Low | 100 Ų | 100 | 117.7 Ų | 117.7 | 54% | 0.535 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -72.5 | -34.9 | 179.5 | -67.2 | -28.9 | 0 | 0 | 0 | 111.3 | R6 L14 | R6-D10 PolarHBondContact O-N 3.09Å; D10-L14 WeakPolarHBondContact O-CB 3.48Å; D10-L14 PolarHBondContact O-N 2.99Å; D10-L14 VanDerWaalsContact O-N 3.08Å |
| 11 | A | 54.6 | Low | 53.7 | Low | 59 Ų | 59 | 118.9 Ų | 118.9 | 49% | 0.488 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -69.8 | -39.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | D7 V8 L14 S15 | D7-A11 PolarHBondContact O-N 3.01Å; V8-A11 PolarHBondContact O-N 3.4Å; A11-L14 PolarHBondContact O-N 3.47Å; A11-S15 PolarHBondContact O-N 3.01Å; A11-S15 PolarHBondContact O-OG 3.02Å |
| 12 | D | 54.8 | Low | 53.7 | Low | 97 Ų | 97 | 113.4 Ų | 113.4 | 52% | 0.519 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -67.1 | -37.6 | 175.1 | -78 | -18.7 | 0 | 0 | 0 | 111.7 | V8 S15 S16 | V8-D12 PolarHBondContact O-N 3.03Å; V8-D12 VanDerWaalsContact O-N 3.09Å; D12-S15 PolarHBondContact O-OG 3.44Å; D12-S16 VanDerWaalsContact O-CB 3.22Å; D12-S16 WeakPolarHBondContact O-CB 3.4Å; D12-S16 PolarHBondContact O-N 3.06Å |
| 13 | N | 53.2 | Low | 53.7 | Low | 110 Ų | 110 | 117.6 Ų | 117.6 | 59% | 0.588 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -67.5 | -39.4 | 175 | -87.2 | -13 | 0 | 0 | 0 | 112.4 | R9 S16 S17 | R9-N13 WeakPolarHBondContact O-CB 3.22Å; R9-N13 PolarHBondContact O-N 3.17Å; N13-S16 PolarHBondContact O-N 3.08Å; N13-S17 WeakPolarHBondContact O-CB 3.38Å; N13-S17 PolarHBondContact O-N 3.22Å; N13-S17 PolarHBondContact O-OG 2.96Å; N13-S17 VanDerWaalsContact O-OG 3.08Å |
| 14 | L | 55.3 | Low | 54.1 | Low | 128 Ų | 128 | 112.1 Ų | 112.1 | 67% | 0.67 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -68.5 | -37.3 | 178.8 | -138.5 | 78.4 | 0 | 0 | 0 | 112.4 | D10 A11 S17 A18 | D10-L14 WeakPolarHBondContact O-CB 3.48Å; D10-L14 PolarHBondContact O-N 2.99Å; D10-L14 VanDerWaalsContact O-N 3.08Å; A11-L14 PolarHBondContact O-N 3.47Å; L14-S17 WeakPolarHBondContact CA-OG 3.39Å; L14-S17 PolarHBondContact O-OG 3.06Å; L14-A18 VanDerWaalsContact O-CB 3.31Å; L14-A18 WeakPolarHBondContact O-CB 3.31Å; L14-A18 PolarHBondContact O-N 3.44Å |
| 15 | S | 55.3 | Low | 54.8 | Low | 55 Ų | 55 | 105.4 Ų | 105.4 | 39% | 0.385 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -72.5 | -36.2 | 175.9 | 62.8 | 0 | 0 | 0 | 0 | 112.3 | A11 D12 Q19 | A11-S15 PolarHBondContact O-N 3.01Å; A11-S15 PolarHBondContact O-OG 3.02Å; D12-S15 PolarHBondContact O-OG 3.44Å; S15-Q19 WeakPolarHBondContact O-CB 3.41Å; S15-Q19 WeakPolarHBondContact O-CG 3.37Å; S15-Q19 PolarHBondContact O-N 2.95Å |
| 16 | S | 56.6 | Low | 55.6 | Low | 62 Ų | 62 | 100.8 Ų | 100.8 | 43% | 0.434 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -65.3 | -44.1 | 173 | 178.6 | 0 | 0 | 0 | 0 | 112.4 | D12 N13 Q19 T20 | D12-S16 VanDerWaalsContact O-CB 3.22Å; D12-S16 WeakPolarHBondContact O-CB 3.4Å; D12-S16 PolarHBondContact O-N 3.06Å; N13-S16 PolarHBondContact O-N 3.08Å; S16-Q19 PolarHBondContact O-N 3.07Å; S16-T20 WeakPolarHBondContact O-CB 3.33Å; S16-T20 PolarHBondContact O-N 3.08Å; S16-T20 PolarHBondContact O-OG1 3.48Å |
| 17 | S | 56 | Low | 56.3 | Low | 56 Ų | 56 | 100.5 Ų | 100.5 | 39% | 0.392 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -65.5 | -42.7 | 176.3 | 56.5 | 0 | 0 | 0 | 0 | 111.8 | N13 L14 T20 E21 | N13-S17 WeakPolarHBondContact O-CB 3.38Å; N13-S17 PolarHBondContact O-N 3.22Å; N13-S17 PolarHBondContact O-OG 2.96Å; N13-S17 VanDerWaalsContact O-OG 3.08Å; L14-S17 WeakPolarHBondContact CA-OG 3.39Å; L14-S17 PolarHBondContact O-OG 3.06Å; S17-T20 PolarHBondContact O-N 2.93Å; S17-E21 PolarHBondContact O-N 3.4Å |
| 18 | A | 54.8 | Low | 56.9 | Low | 46 Ų | 46 | 100.2 Ų | 100.2 | 38% | 0.38 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.7 | -40.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L14 T20 V22 | L14-A18 VanDerWaalsContact O-CB 3.31Å; L14-A18 WeakPolarHBondContact O-CB 3.31Å; L14-A18 PolarHBondContact O-N 3.44Å; A18-T20 VanDerWaalsContact C-N 3.31Å; A18-T20 PolarHBondContact O-N 2.7Å; A18-V22 WeakPolarHBondContact O-CB 3.47Å; A18-V22 WeakPolarHBondContact O-CG2 3.46Å; A18-V22 PolarHBondContact O-N 3.03Å |
| 19 | Q | 54.3 | Low | 57.2 | Low | 139 Ų | 139 | 99 Ų | 99 | 65% | 0.65 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -67.7 | -31.7 | 174.5 | -78.2 | 179.3 | 7.3 | 0 | 0 | 112.8 | S15 S16 K23 | S15-Q19 WeakPolarHBondContact O-CB 3.41Å; S15-Q19 WeakPolarHBondContact O-CG 3.37Å; S15-Q19 PolarHBondContact O-N 2.95Å; S16-Q19 PolarHBondContact O-N 3.07Å; Q19-K23 WeakPolarHBondContact O-CB 3.48Å; Q19-K23 PolarHBondContact O-N 2.95Å |
| 20 | T | 54.2 | Low | 57.8 | Low | 87 Ų | 87 | 95.3 Ų | 95.3 | 53% | 0.534 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -72.3 | -42.3 | 177.6 | -55.1 | 0 | 0 | 0 | 0 | 111.1 | S16 S17 A18 K23 S24 | S16-T20 WeakPolarHBondContact O-CB 3.33Å; S16-T20 PolarHBondContact O-N 3.08Å; S16-T20 PolarHBondContact O-OG1 3.48Å; S17-T20 PolarHBondContact O-N 2.93Å; A18-T20 VanDerWaalsContact C-N 3.31Å; A18-T20 PolarHBondContact O-N 2.7Å; T20-K23 PolarHBondContact O-N 2.94Å; T20-S24 PolarHBondContact O-N 3.29Å; T20-S24 PolarHBondContact O-OG 3.27Å |
| 21 | E | 54.4 | Low | 58.5 | Low | 143 Ų | 143 | 95.2 Ų | 95.2 | 67% | 0.668 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -66.5 | -39.3 | 175.1 | -75.1 | -176.2 | 159.3 | 0 | 0 | 112.7 | S17 S24 G25 | S17-E21 PolarHBondContact O-N 3.4Å; E21-S24 WeakPolarHBondContact CA-OG 3.22Å; E21-S24 PolarHBondContact O-N 3.18Å; E21-S24 PolarHBondContact O-OG 3.02Å; E21-G25 PolarHBondContact O-N 2.94Å |
| 22 | V | 54.9 | Low | 58.8 | Low | 108 Ų | 108 | 97.8 Ų | 97.8 | 66% | 0.655 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.7 | -40.4 | 175.2 | 172.8 | 0 | 0 | 0 | 0 | 111 | A18 D26 | A18-V22 WeakPolarHBondContact O-CB 3.47Å; A18-V22 WeakPolarHBondContact O-CG2 3.46Å; A18-V22 PolarHBondContact O-N 3.03Å; V22-D26 PolarHBondContact O-N 3.42Å |
| 23 | K | 56.6 | Low | 58.9 | Low | 167 Ų | 167 | 99.8 Ų | 99.8 | 73% | 0.726 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -67 | -35.5 | 175 | -103 | -179.8 | 173.6 | 174.2 | 0 | 113.3 | Q19 T20 R27 | Q19-K23 WeakPolarHBondContact O-CB 3.48Å; Q19-K23 PolarHBondContact O-N 2.95Å; T20-K23 PolarHBondContact O-N 2.94Å; K23-R27 WeakPolarHBondContact O-CB 3.4Å; K23-R27 PolarHBondContact O-N 3.37Å |
| 24 | S | 58.6 | Low | 59.3 | Low | 58 Ų | 58 | 100.4 Ų | 100.4 | 41% | 0.406 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -71 | -42.2 | 177.3 | 62.2 | 0 | 0 | 0 | 0 | 111.5 | T20 E21 D26 R27 D28 | T20-S24 PolarHBondContact O-N 3.29Å; T20-S24 PolarHBondContact O-OG 3.27Å; E21-S24 WeakPolarHBondContact CA-OG 3.22Å; E21-S24 PolarHBondContact O-N 3.18Å; E21-S24 PolarHBondContact O-OG 3.02Å; S24-D26 PolarHBondContact O-N 2.95Å; S24-R27 PolarHBondContact O-N 2.97Å; S24-D28 PolarHBondContact O-N 3.32Å |
| 25 | G | 61.5 | Low | 59.4 | Low | 34 Ų | 34 | 96.5 Ų | 96.5 | 35% | 0.351 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.7 | -38.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | E21 S29 | E21-G25 PolarHBondContact O-N 2.94Å; G25-S29 WeakPolarHBondContact O-CB 3.32Å; G25-S29 PolarHBondContact O-N 2.67Å; G25-S29 PolarHBondContact O-OG 3.43Å |
| 26 | D | 66.6 | Low | 59.4 | Low | 105 Ų | 105 | 100.5 Ų | 100.5 | 56% | 0.561 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -72.2 | -33.8 | 178.4 | -152.3 | 21.5 | 0 | 0 | 0 | 112 | V22 S24 S29 Q30 | V22-D26 PolarHBondContact O-N 3.42Å; S24-D26 PolarHBondContact O-N 2.95Å; D26-S29 PolarHBondContact O-N 3.48Å; D26-Q30 WeakPolarHBondContact O-CG 3.46Å; D26-Q30 PolarHBondContact O-N 2.85Å |
| 27 | R | 66.8 | Low | 59.3 | Low | 182 Ų | 182 | 104.6 Ų | 104.6 | 69% | 0.687 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -71.5 | -41.7 | 176.2 | -149.7 | 172.6 | -154.9 | -177.1 | 3.3 | 112.3 | K23 S24 S29 Q30 L31 | K23-R27 WeakPolarHBondContact O-CB 3.4Å; K23-R27 PolarHBondContact O-N 3.37Å; S24-R27 PolarHBondContact O-N 2.97Å; R27-S29 VanDerWaalsContact C-N 3.31Å; R27-S29 PolarHBondContact O-N 3.49Å; R27-Q30 PolarHBondContact O-N 3.18Å; R27-L31 WeakPolarHBondContact O-CB 3.49Å; R27-L31 VanDerWaalsContact O-CG 3.28Å; R27-L31 WeakPolarHBondContact O-CG 3.46Å; R27-L31 PolarHBondContact O-N 2.95Å |
| 28 | D | 63 | Low | 59.3 | Low | 96 Ų | 96 | 106.1 Ų | 106.1 | 51% | 0.513 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -65.3 | -37.2 | 174.1 | -72.9 | -19.7 | 0 | 0 | 0 | 111.3 | S24 L31 L32 | S24-D28 PolarHBondContact O-N 3.32Å; D28-L31 PolarHBondContact O-N 3.09Å; D28-L32 WeakPolarHBondContact O-CB 3.45Å; D28-L32 VanDerWaalsContact O-CG 3.24Å; D28-L32 WeakPolarHBondContact O-CG 3.28Å; D28-L32 PolarHBondContact O-N 2.87Å |
| 29 | S | 62.1 | Low | 59.3 | Low | 58 Ų | 58 | 107.7 Ų | 107.7 | 41% | 0.406 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -66.3 | -37.9 | 175 | -59.5 | 0 | 0 | 0 | 0 | 112.7 | G25 D26 R27 K33 | G25-S29 WeakPolarHBondContact O-CB 3.32Å; G25-S29 PolarHBondContact O-N 2.67Å; G25-S29 PolarHBondContact O-OG 3.43Å; D26-S29 PolarHBondContact O-N 3.48Å; R27-S29 VanDerWaalsContact C-N 3.31Å; R27-S29 PolarHBondContact O-N 3.49Å; S29-K33 WeakPolarHBondContact O-CG 3.33Å; S29-K33 PolarHBondContact O-N 3.05Å; S29-K33 VanDerWaalsContact O-N 3.09Å |
| 30 | Q | 66.6 | Low | 59.4 | Low | 111 Ų | 111 | 102.5 Ų | 102.5 | 52% | 0.519 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -68.2 | -44.3 | 173.4 | -81.8 | -178.7 | -14.9 | 0 | 0 | 112 | D26 R27 L32 K33 E34 | D26-Q30 WeakPolarHBondContact O-CG 3.46Å; D26-Q30 PolarHBondContact O-N 2.85Å; R27-Q30 PolarHBondContact O-N 3.18Å; Q30-L32 VanDerWaalsContact C-N 3.32Å; Q30-L32 PolarHBondContact O-N 3.42Å; Q30-K33 PolarHBondContact O-N 2.94Å; Q30-E34 WeakPolarHBondContact O-CG 3.24Å; Q30-E34 PolarHBondContact O-N 3.43Å |
| 31 | L | 67.3 | Low | 59.7 | Low | 98 Ų | 98 | 100.3 Ų | 100.3 | 51% | 0.513 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.3 | -38.9 | 176.8 | -72.1 | 169.9 | 0 | 0 | 0 | 112 | R27 D28 A35 | R27-L31 WeakPolarHBondContact O-CB 3.49Å; R27-L31 VanDerWaalsContact O-CG 3.28Å; R27-L31 WeakPolarHBondContact O-CG 3.46Å; R27-L31 PolarHBondContact O-N 2.95Å; D28-L31 PolarHBondContact O-N 3.09Å; L31-A35 VanDerWaalsContact O-CB 3.22Å; L31-A35 WeakPolarHBondContact O-CB 3.28Å; L31-A35 PolarHBondContact O-N 3.44Å |
| 32 | L | 61.4 | Low | 60.5 | Low | 113 Ų | 113 | 96.6 Ų | 96.6 | 59% | 0.592 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.9 | -41.8 | 174 | -75.3 | 167.5 | 0 | 0 | 0 | 111.9 | D28 Q30 Q36 | D28-L32 WeakPolarHBondContact O-CB 3.45Å; D28-L32 VanDerWaalsContact O-CG 3.24Å; D28-L32 WeakPolarHBondContact O-CG 3.28Å; D28-L32 PolarHBondContact O-N 2.87Å; Q30-L32 VanDerWaalsContact C-N 3.32Å; Q30-L32 PolarHBondContact O-N 3.42Å; L32-Q36 WeakPolarHBondContact O-CB 3.35Å; L32-Q36 VanDerWaalsContact O-CG 3.28Å; L32-Q36 WeakPolarHBondContact O-CG 3.24Å; L32-Q36 PolarHBondContact O-N 3.47Å; L32-Q36 PolarHBondContact O-OE1 2.91Å |
| 33 | K | 58.3 | Low | 61.5 | Low | 140 Ų | 140 | 93.9 Ų | 93.9 | 61% | 0.609 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65 | -46.6 | 175.6 | -80.7 | 178.5 | -174.9 | 175.2 | 0 | 111.8 | S29 Q30 Q36 Q37 | S29-K33 WeakPolarHBondContact O-CG 3.33Å; S29-K33 PolarHBondContact O-N 3.05Å; S29-K33 VanDerWaalsContact O-N 3.09Å; Q30-K33 PolarHBondContact O-N 2.94Å; K33-Q36 PolarHBondContact O-N 3.35Å; K33-Q37 WeakPolarHBondContact O-CB 3.33Å; K33-Q37 PolarHBondContact O-N 3.25Å |
| 34 | E | 60.5 | Low | 62.6 | Low | 123 Ų | 123 | 95.1 Ų | 95.1 | 58% | 0.575 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.2 | -41.2 | 177.8 | -74.1 | -179.8 | 171.4 | 0 | 0 | 112 | Q30 Q37 S38 | Q30-E34 WeakPolarHBondContact O-CG 3.24Å; Q30-E34 PolarHBondContact O-N 3.43Å; E34-Q37 PolarHBondContact O-N 2.9Å; E34-S38 VanDerWaalsContact O-CB 3.24Å; E34-S38 WeakPolarHBondContact O-CB 3.22Å; E34-S38 PolarHBondContact O-N 3.46Å |
| 35 | A | 57.8 | Low | 63.7 | Low | 46 Ų | 46 | 97.8 Ų | 97.8 | 38% | 0.38 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.8 | -45.3 | 173 | 0 | 0 | 0 | 0 | 0 | 111.5 | L31 Q37 S38 I39 | L31-A35 VanDerWaalsContact O-CB 3.22Å; L31-A35 WeakPolarHBondContact O-CB 3.28Å; L31-A35 PolarHBondContact O-N 3.44Å; A35-Q37 VanDerWaalsContact C-N 3.33Å; A35-Q37 PolarHBondContact O-N 2.93Å; A35-S38 PolarHBondContact O-N 3.35Å; A35-I39 WeakPolarHBondContact O-CB 3.23Å; A35-I39 VanDerWaalsContact O-CD1 3.23Å; A35-I39 WeakPolarHBondContact O-CD1 3.45Å; A35-I39 WeakPolarHBondContact O-CG1 3.39Å; A35-I39 PolarHBondContact O-N 2.83Å |
| 36 | Q | 54.5 | Low | 64.8 | Low | 138 Ų | 138 | 97 Ų | 97 | 65% | 0.645 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64 | -36.2 | 176.1 | -77.4 | 176.6 | -52.5 | 0 | 0 | 112.6 | L32 K33 G40 | L32-Q36 WeakPolarHBondContact O-CB 3.35Å; L32-Q36 VanDerWaalsContact O-CG 3.28Å; L32-Q36 WeakPolarHBondContact O-CG 3.24Å; L32-Q36 PolarHBondContact O-N 3.47Å; L32-Q36 PolarHBondContact O-OE1 2.91Å; K33-Q36 PolarHBondContact O-N 3.35Å; Q36-G40 PolarHBondContact O-N 3.37Å |
| 37 | Q | 55.1 | Low | 65.6 | Low | 149 Ų | 149 | 96.9 Ų | 96.9 | 70% | 0.696 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -72.3 | -41.6 | 178.4 | -134.1 | 165.6 | -15 | 0 | 0 | 111.9 | K33 E34 A35 G40 G41 | K33-Q37 WeakPolarHBondContact O-CB 3.33Å; K33-Q37 PolarHBondContact O-N 3.25Å; E34-Q37 PolarHBondContact O-N 2.9Å; A35-Q37 VanDerWaalsContact C-N 3.33Å; A35-Q37 PolarHBondContact O-N 2.93Å; Q37-G40 PolarHBondContact O-N 2.93Å; Q37-G41 PolarHBondContact O-N 3Å |
| 38 | S | 56.6 | Low | 66.7 | Low | 87 Ų | 87 | 93.7 Ų | 93.7 | 61% | 0.608 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -60.7 | -45.7 | 172.1 | 169.5 | 0 | 0 | 0 | 0 | 111.9 | E34 A35 G40 G41 S42 | E34-S38 VanDerWaalsContact O-CB 3.24Å; E34-S38 WeakPolarHBondContact O-CB 3.22Å; E34-S38 PolarHBondContact O-N 3.46Å; A35-S38 PolarHBondContact O-N 3.35Å; S38-G40 PolarHBondContact O-N 3.49Å; S38-G41 PolarHBondContact O-N 3.49Å; S38-S42 PolarHBondContact O-N 3Å |
| 39 | I | 54.3 | Low | 68 | Low | 79 Ų | 79 | 92.6 Ų | 92.6 | 41% | 0.405 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.8 | -37.6 | 177.5 | -66.5 | 163 | 0 | 0 | 0 | 111.3 | A35 S42 T43 | A35-I39 WeakPolarHBondContact O-CB 3.23Å; A35-I39 VanDerWaalsContact O-CD1 3.23Å; A35-I39 WeakPolarHBondContact O-CD1 3.45Å; A35-I39 WeakPolarHBondContact O-CG1 3.39Å; A35-I39 PolarHBondContact O-N 2.83Å; I39-S42 PolarHBondContact O-N 2.95Å; I39-T43 PolarHBondContact O-N 3.27Å; I39-T43 VanDerWaalsContact O-N 3.08Å; I39-T43 PolarHBondContact O-OG1 3.32Å |
| 40 | G | 55.4 | Low | 69.3 | Low | 31 Ų | 31 | 92.6 Ų | 92.6 | 32% | 0.32 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -65.9 | -39.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q36 Q37 S38 R44 | Q36-G40 PolarHBondContact O-N 3.37Å; Q37-G40 PolarHBondContact O-N 2.93Å; S38-G40 PolarHBondContact O-N 3.49Å; G40-R44 WeakPolarHBondContact O-CG 3.07Å; G40-R44 PolarHBondContact O-N 2.94Å |
| 41 | G | 60.7 | Low | 70.5 | Confident | 41 Ų | 41 | 90 Ų | 90 | 42% | 0.423 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.9 | -42.7 | 173 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q37 S38 T43 R44 M45 | Q37-G41 PolarHBondContact O-N 3Å; S38-G41 PolarHBondContact O-N 3.49Å; G41-T43 PolarHBondContact O-N 3.07Å; G41-R44 PolarHBondContact O-N 3.49Å; G41-M45 PolarHBondContact O-N 3.33Å |
| 42 | S | 72.1 | Confident | 71.8 | Confident | 65 Ų | 65 | 90.8 Ų | 90.8 | 46% | 0.455 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.5 | -44.9 | 176.8 | -176.2 | 0 | 0 | 0 | 0 | 112.3 | S38 I39 R44 M45 S46 | S38-S42 PolarHBondContact O-N 3Å; I39-S42 PolarHBondContact O-N 2.95Å; S42-R44 PolarHBondContact O-N 2.93Å; S42-M45 PolarHBondContact O-N 3.47Å; S42-S46 PolarHBondContact O-N 3.17Å; S42-S46 PolarHBondContact O-OG 2.96Å; S42-S46 VanDerWaalsContact O-OG 3.05Å |
| 43 | T | 75.1 | Confident | 73.4 | Confident | 51 Ų | 51 | 88 Ų | 88 | 31% | 0.313 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.9 | -42.5 | 179.7 | -50.1 | 0 | 0 | 0 | 0 | 112.3 | I39 G41 M45 S46 L47 | I39-T43 PolarHBondContact O-N 3.27Å; I39-T43 VanDerWaalsContact O-N 3.08Å; I39-T43 PolarHBondContact O-OG1 3.32Å; G41-T43 PolarHBondContact O-N 3.07Å; T43-M45 VanDerWaalsContact C-N 3.33Å; T43-M45 PolarHBondContact O-N 3.47Å; T43-S46 PolarHBondContact O-N 3.42Å; T43-L47 WeakPolarHBondContact O-CG 3.37Å; T43-L47 PolarHBondContact O-N 3.03Å |
| 44 | R | 80.1 | Confident | 75.1 | Confident | 193 Ų | 193 | 85.8 Ų | 85.8 | 73% | 0.728 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -61.9 | -42.5 | 176.4 | -72.6 | 178.2 | -179.9 | -174.5 | 0.5 | 111.3 | G40 G41 S42 L47 L48 | G40-R44 WeakPolarHBondContact O-CG 3.07Å; G40-R44 PolarHBondContact O-N 2.94Å; G41-R44 PolarHBondContact O-N 3.49Å; S42-R44 PolarHBondContact O-N 2.93Å; R44-L47 PolarHBondContact O-N 3.08Å; R44-L48 WeakPolarHBondContact O-CG 3.34Å; R44-L48 PolarHBondContact O-N 3.46Å |
| 45 | M | 82.4 | Confident | 76.8 | Confident | 114 Ų | 114 | 82.2 Ų | 82.2 | 56% | 0.562 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -62.7 | -44.1 | 175.9 | -173.4 | 63.1 | 81.1 | 0 | 0 | 111.8 | G41 S42 T43 L47 L48 I49 | G41-M45 PolarHBondContact O-N 3.33Å; S42-M45 PolarHBondContact O-N 3.47Å; T43-M45 VanDerWaalsContact C-N 3.33Å; T43-M45 PolarHBondContact O-N 3.47Å; M45-L47 VanDerWaalsContact C-N 3.31Å; M45-L47 PolarHBondContact O-N 2.92Å; M45-L48 PolarHBondContact O-N 3.05Å; M45-I49 HydrophobicContact CG-CD1 4.11Å; M45-I49 WeakPolarHBondContact O-CG1 3.42Å; M45-I49 PolarHBondContact O-N 2.9Å |
| 46 | S | 83.4 | Confident | 78.6 | Confident | 18 Ų | 18 | 83.3 Ų | 83.3 | 13% | 0.126 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -61.2 | -38 | 176.4 | -54.5 | 0 | 0 | 0 | 0 | 112.7 | S42 T43 I49 L50 V163 | S42-S46 PolarHBondContact O-N 3.17Å; S42-S46 PolarHBondContact O-OG 2.96Å; S42-S46 VanDerWaalsContact O-OG 3.05Å; T43-S46 PolarHBondContact O-N 3.42Å; S46-I49 PolarHBondContact O-N 3.49Å; S46-L50 WeakPolarHBondContact O-CB 3.28Å; S46-L50 PolarHBondContact O-N 3.04Å; S46-V163 WeakPolarHBondContact O-CG2 3.44Å |
| 47 | L | 85.1 | Confident | 80.5 | Confident | 101 Ų | 101 | 78.5 Ų | 78.5 | 53% | 0.529 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -66.9 | -39.7 | 174.2 | -71.3 | 174.1 | 0 | 0 | 0 | 112.3 | T43 R44 M45 L50 A51 | T43-L47 WeakPolarHBondContact O-CG 3.37Å; T43-L47 PolarHBondContact O-N 3.03Å; R44-L47 PolarHBondContact O-N 3.08Å; M45-L47 VanDerWaalsContact C-N 3.31Å; M45-L47 PolarHBondContact O-N 2.92Å; L47-L50 PolarHBondContact O-N 3.38Å; L47-A51 WeakPolarHBondContact O-CB 3.33Å; L47-A51 PolarHBondContact O-N 3.28Å |
| 48 | L | 89.4 | Confident | 82.4 | Confident | 115 Ų | 115 | 73.1 Ų | 73.1 | 60% | 0.602 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -64 | -42.5 | 174.8 | -71.4 | 172.6 | 0 | 0 | 0 | 111.7 | R44 M45 L50 A51 L52 | R44-L48 WeakPolarHBondContact O-CG 3.34Å; R44-L48 PolarHBondContact O-N 3.46Å; M45-L48 PolarHBondContact O-N 3.05Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 3.35Å; L48-A51 PolarHBondContact O-N 2.88Å; L48-L52 WeakPolarHBondContact O-CB 3.36Å; L48-L52 PolarHBondContact O-N 2.87Å |
| 49 | I | 88.9 | Confident | 84.2 | Confident | 73 Ų | 73 | 72.3 Ų | 72.3 | 37% | 0.374 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -60.6 | -45.5 | 175 | -68 | 165.9 | 0 | 0 | 0 | 110.3 | M45 S46 A51 L52 I53 | M45-I49 HydrophobicContact CG-CD1 4.11Å; M45-I49 WeakPolarHBondContact O-CG1 3.42Å; M45-I49 PolarHBondContact O-N 2.9Å; S46-I49 PolarHBondContact O-N 3.49Å; I49-A51 PolarHBondContact O-N 3.26Å; I49-L52 PolarHBondContact O-N 3.4Å; I49-I53 HydrophobicContact CG2-CD1 3.82Å; I49-I53 HydrophobicContact CG2-CG1 4.46Å; I49-I53 WeakPolarHBondContact O-CG1 3.41Å; I49-I53 PolarHBondContact O-N 3.49Å |
| 50 | L | 90.3 | Very high | 86.1 | Confident | 58 Ų | 58 | 72.4 Ų | 72.4 | 30% | 0.304 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -61.1 | -44.9 | 177.2 | -176.8 | 63.1 | 0 | 0 | 0 | 111.8 | S46 L47 L48 L52 I53 F54 L159 V163 | S46-L50 WeakPolarHBondContact O-CB 3.28Å; S46-L50 PolarHBondContact O-N 3.04Å; L47-L50 PolarHBondContact O-N 3.38Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 3.35Å; L50-L52 VanDerWaalsContact C-N 3.33Å; L50-L52 PolarHBondContact O-N 2.92Å; L50-I53 PolarHBondContact O-N 3.31Å; L50-F54 WeakPolarHBondContact O-CB 3.32Å; L50-F54 PolarHBondContact O-N 3.49Å; L50-L159 HydrophobicContact CD1-CD1 4.13Å; L50-L159 HydrophobicContact CD1-CD2 3.95Å; L50-L159 HydrophobicContact CD1-CG 4.47Å; L50-V163 HydrophobicContact CB-CG2 4.36Å; L50-V163 HydrophobicContact CD2-CG1 4.43Å |
| 51 | A | 91.8 | Very high | 88 | Confident | 58 Ų | 58 | 72.9 Ų | 72.9 | 48% | 0.479 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -62.3 | -40.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L47 L48 I49 F54 A55 | L47-A51 WeakPolarHBondContact O-CB 3.33Å; L47-A51 PolarHBondContact O-N 3.28Å; L48-A51 PolarHBondContact O-N 2.88Å; I49-A51 PolarHBondContact O-N 3.26Å; A51-F54 PolarHBondContact O-N 3.29Å; A51-A55 WeakPolarHBondContact O-CB 3.47Å; A51-A55 PolarHBondContact O-N 3.43Å |
| 52 | L | 94.2 | Very high | 89.5 | Confident | 114 Ų | 114 | 77.4 Ų | 77.4 | 60% | 0.597 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -65 | -45.7 | 176.2 | -178 | 65.1 | 0 | 0 | 0 | 111.6 | L48 I49 L50 F54 A55 C56 | L48-L52 WeakPolarHBondContact O-CB 3.36Å; L48-L52 PolarHBondContact O-N 2.87Å; I49-L52 PolarHBondContact O-N 3.4Å; L50-L52 VanDerWaalsContact C-N 3.33Å; L50-L52 PolarHBondContact O-N 2.92Å; L52-F54 VanDerWaalsContact C-N 3.3Å; L52-F54 PolarHBondContact O-N 3.36Å; L52-A55 PolarHBondContact O-N 3.3Å; L52-C56 WeakPolarHBondContact O-CB 3.45Å; L52-C56 PolarHBondContact O-N 2.88Å; L52-C56 PolarHBondContact O-SG 3.48Å |
| 53 | I | 94.3 | Very high | 90.5 | Very high | 55 Ų | 55 | 78.7 Ų | 78.7 | 28% | 0.282 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 176.4 | -66.6 | 166.3 | 0 | 0 | 0 | 110.4 | I49 L50 C56 S57 F120 L159 | I49-I53 HydrophobicContact CG2-CD1 3.82Å; I49-I53 HydrophobicContact CG2-CG1 4.46Å; I49-I53 WeakPolarHBondContact O-CG1 3.41Å; I49-I53 PolarHBondContact O-N 3.49Å; L50-I53 PolarHBondContact O-N 3.31Å; I53-C56 PolarHBondContact O-N 3.48Å; I53-S57 WeakPolarHBondContact O-CB 3.4Å; I53-S57 PolarHBondContact O-N 3.3Å; I53-S57 PolarHBondContact O-OG 3.12Å; I53-S57 VanDerWaalsContact O-OG 3.09Å; I53-F120 HydrophobicContact CG2-CZ 4.44Å; I53-L159 HydrophobicContact CB-CD2 4.46Å; I53-L159 HydrophobicContact CD1-CD2 3.6Å; I53-L159 HydrophobicContact CG2-CD2 4.08Å |
| 54 | F | 94.9 | Very high | 91.3 | Very high | 93 Ų | 93 | 77.6 Ų | 77.6 | 41% | 0.408 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 175.6 | -174.4 | -90.1 | 0 | 0 | 0 | 111.8 | L50 A51 L52 C56 S57 A58 F116 F120 | L50-F54 WeakPolarHBondContact O-CB 3.32Å; L50-F54 PolarHBondContact O-N 3.49Å; A51-F54 PolarHBondContact O-N 3.29Å; L52-F54 VanDerWaalsContact C-N 3.3Å; L52-F54 PolarHBondContact O-N 3.36Å; F54-C56 PolarHBondContact O-N 3.17Å; F54-S57 PolarHBondContact O-N 2.99Å; F54-A58 VanDerWaalsContact O-CB 3.31Å; F54-A58 WeakPolarHBondContact O-CB 3.49Å; F54-A58 PolarHBondContact O-N 3.33Å; F54-F116 HydrophobicContact CE2-CE2 4.4Å; F54-F116 AromaticContact CE2-CZ 3.8Å; F54-F116 HydrophobicContact CE2-CZ 3.8Å; F54-F116 HydrophobicContact CZ-CZ 4.04Å; F54-F120 HydrophobicContact CB-CE1 4.02Å; F54-F120 HydrophobicContact CB-CZ 4.17Å; F54-F120 AromaticContact CD2-CD1 3.67Å; F54-F120 HydrophobicContact CD2-CD1 3.67Å; F54-F120 HydrophobicContact CD2-CD2 4.04Å; F54-F120 AromaticContact CD2-CE1 3.6Å; F54-F120 HydrophobicContact CD2-CE1 3.6Å; F54-F120 AromaticContact CD2-CE2 3.99Å; F54-F120 HydrophobicContact CD2-CE2 3.99Å; F54-F120 AromaticContact CD2-CG 3.9Å; F54-F120 HydrophobicContact CD2-CG 3.9Å; F54-F120 AromaticContact CD2-CZ 3.77Å; F54-F120 HydrophobicContact CD2-CZ 3.77Å; F54-F120 HydrophobicContact CE2-CD1 4.34Å; F54-F120 HydrophobicContact CE2-CD2 4.18Å; F54-F120 HydrophobicContact CE2-CE2 4.45Å; F54-F120 HydrophobicContact CE2-CG 4.14Å; F54-F120 HydrophobicContact CG-CE1 4.29Å; F54-F120 HydrophobicContact CG-CZ 4.36Å |
| 55 | A | 95.8 | Very high | 91.7 | Very high | 48 Ų | 48 | 76.7 Ų | 76.7 | 40% | 0.397 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.3 | -42 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A51 L52 A58 S59 | A51-A55 WeakPolarHBondContact O-CB 3.47Å; A51-A55 PolarHBondContact O-N 3.43Å; L52-A55 PolarHBondContact O-N 3.3Å; A55-A58 PolarHBondContact O-N 3.15Å; A55-S59 WeakPolarHBondContact O-CB 3.46Å; A55-S59 PolarHBondContact O-N 2.9Å; A55-S59 PolarHBondContact O-OG 2.74Å |
| 56 | C | 95.5 | Very high | 92.1 | Very high | 68 Ų | 68 | 80 Ų | 80 | 46% | 0.459 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -61.6 | -48.1 | 174 | -71.4 | 0 | 0 | 0 | 0 | 111.3 | L52 I53 F54 A58 S59 V60 | L52-C56 WeakPolarHBondContact O-CB 3.45Å; L52-C56 PolarHBondContact O-N 2.88Å; L52-C56 PolarHBondContact O-SG 3.48Å; I53-C56 PolarHBondContact O-N 3.48Å; F54-C56 PolarHBondContact O-N 3.17Å; C56-A58 PolarHBondContact O-N 2.61Å; C56-S59 WeakPolarHBondContact O-CB 3.45Å; C56-S59 PolarHBondContact O-N 3.43Å; C56-V60 PolarHBondContact O-N 2.82Å |
| 57 | S | 95.1 | Very high | 92.3 | Very high | 37 Ų | 37 | 84.7 Ų | 84.7 | 26% | 0.259 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -63.7 | -39.1 | 177.7 | -66.6 | 0 | 0 | 0 | 0 | 112.6 | I53 F54 S59 V60 M61 | I53-S57 WeakPolarHBondContact O-CB 3.4Å; I53-S57 PolarHBondContact O-N 3.3Å; I53-S57 PolarHBondContact O-OG 3.12Å; I53-S57 VanDerWaalsContact O-OG 3.09Å; F54-S57 PolarHBondContact O-N 2.99Å; S57-S59 VanDerWaalsContact C-N 3.32Å; S57-V60 PolarHBondContact O-N 2.76Å; S57-M61 WeakPolarHBondContact O-CG 3.39Å; S57-M61 PolarHBondContact O-N 2.9Å |
| 58 | A | 94.7 | Very high | 92.4 | Very high | 37 Ų | 37 | 82 Ų | 82 | 31% | 0.306 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -65.4 | -35.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | F54 A55 C56 M61 Y62 | F54-A58 VanDerWaalsContact O-CB 3.31Å; F54-A58 WeakPolarHBondContact O-CB 3.49Å; F54-A58 PolarHBondContact O-N 3.33Å; A55-A58 PolarHBondContact O-N 3.15Å; C56-A58 PolarHBondContact O-N 2.61Å; A58-M61 WeakPolarHBondContact O-CB 3.29Å; A58-M61 PolarHBondContact O-N 2.96Å; A58-Y62 WeakPolarHBondContact O-CB 3.44Å; A58-Y62 PolarHBondContact O-N 2.81Å |
| 59 | S | 94.8 | Very high | 92.2 | Very high | 69 Ų | 69 | 77.3 Ų | 77.3 | 48% | 0.483 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -65.2 | -41.3 | 174.2 | -57.7 | 0 | 0 | 0 | 0 | 111.5 | A55 C56 S57 Y62 L63 | A55-S59 WeakPolarHBondContact O-CB 3.46Å; A55-S59 PolarHBondContact O-N 2.9Å; A55-S59 PolarHBondContact O-OG 2.74Å; C56-S59 WeakPolarHBondContact O-CB 3.45Å; C56-S59 PolarHBondContact O-N 3.43Å; S57-S59 VanDerWaalsContact C-N 3.32Å; S59-Y62 WeakPolarHBondContact O-CB 3.1Å; S59-Y62 PolarHBondContact O-N 3.47Å; S59-L63 WeakPolarHBondContact O-CG 3.37Å; S59-L63 PolarHBondContact O-N 2.91Å |
| 60 | V | 94.4 | Very high | 91.9 | Very high | 82 Ų | 82 | 82.6 Ų | 82.6 | 50% | 0.497 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -61.1 | -44.8 | 172.4 | 173.7 | 0 | 0 | 0 | 0 | 110.8 | C56 S57 Y62 L63 V64 | C56-V60 PolarHBondContact O-N 2.82Å; S57-V60 PolarHBondContact O-N 2.76Å; V60-Y62 VanDerWaalsContact C-N 3.31Å; V60-Y62 PolarHBondContact O-N 3.48Å; V60-L63 PolarHBondContact O-N 2.92Å; V60-V64 WeakPolarHBondContact O-CG2 3.42Å; V60-V64 PolarHBondContact O-N 2.85Å |
| 61 | M | 94.7 | Very high | 91.5 | Very high | 41 Ų | 41 | 82 Ų | 82 | 20% | 0.202 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -60.4 | -40.3 | 175.3 | -75.3 | -58.1 | -59 | 0 | 0 | 112.4 | S57 A58 V64 Y65 A112 T113 F116 | S57-M61 WeakPolarHBondContact O-CG 3.39Å; S57-M61 PolarHBondContact O-N 2.9Å; A58-M61 WeakPolarHBondContact O-CB 3.29Å; A58-M61 PolarHBondContact O-N 2.96Å; M61-V64 PolarHBondContact O-N 3.18Å; M61-Y65 WeakPolarHBondContact O-CB 3.43Å; M61-Y65 PolarHBondContact O-N 3.44Å; M61-A112 HydrophobicContact SD-CB 3.96Å; M61-T113 HydrophobicContact CE-CG2 4.34Å; M61-T113 WeakPolarHBondContact CE-OG1 3.31Å; M61-F116 HydrophobicContact CG-CB 4.16Å; M61-F116 HydrophobicContact CG-CD2 3.65Å; M61-F116 HydrophobicContact CG-CE2 4.17Å; M61-F116 HydrophobicContact CG-CG 3.87Å; M61-F116 HydrophobicContact SD-CB 4.01Å; M61-F116 HydrophobicContact SD-CG 4.32Å |
| 62 | Y | 93.1 | Very high | 91.1 | Very high | 135 Ų | 135 | 85.4 Ų | 85.4 | 53% | 0.529 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.1 | -40.1 | 174.9 | 176.9 | -103.5 | 0 | 0 | 0 | 112.2 | A58 S59 V60 Y65 R66 | A58-Y62 WeakPolarHBondContact O-CB 3.44Å; A58-Y62 PolarHBondContact O-N 2.81Å; S59-Y62 WeakPolarHBondContact O-CB 3.1Å; S59-Y62 PolarHBondContact O-N 3.47Å; V60-Y62 VanDerWaalsContact C-N 3.31Å; V60-Y62 PolarHBondContact O-N 3.48Å; Y62-Y65 PolarHBondContact O-N 3.46Å; Y62-R66 WeakPolarHBondContact O-CB 3.35Å; Y62-R66 PolarHBondContact O-N 3.28Å |
| 63 | L | 93.2 | Very high | 90.4 | Very high | 93 Ų | 93 | 86.1 Ų | 86.1 | 49% | 0.487 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -64.5 | -42.2 | 174.4 | -70 | 175.1 | 0 | 0 | 0 | 111.8 | S59 V60 Y65 R66 N67 | S59-L63 WeakPolarHBondContact O-CG 3.37Å; S59-L63 PolarHBondContact O-N 2.91Å; V60-L63 PolarHBondContact O-N 2.92Å; L63-Y65 VanDerWaalsContact C-N 3.33Å; L63-Y65 PolarHBondContact O-N 3.29Å; L63-R66 PolarHBondContact O-N 3.45Å; L63-N67 WeakPolarHBondContact O-CB 3.29Å; L63-N67 PolarHBondContact O-N 2.84Å; L63-N67 PolarHBondContact O-ND2 2.92Å |
| 64 | V | 92 | Very high | 89.8 | Confident | 27 Ų | 27 | 87 Ų | 87 | 16% | 0.164 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -59.4 | -45.9 | 174.3 | 167.1 | 0 | 0 | 0 | 0 | 110.6 | V60 M61 N67 F68 V108 A109 A112 | V60-V64 WeakPolarHBondContact O-CG2 3.42Å; V60-V64 PolarHBondContact O-N 2.85Å; M61-V64 PolarHBondContact O-N 3.18Å; V64-N67 PolarHBondContact O-N 2.94Å; V64-F68 PolarHBondContact O-N 3.14Å; V64-F68 VanDerWaalsContact O-N 3.08Å; V64-V108 HydrophobicContact CG2-CG1 4.3Å; V64-A109 HydrophobicContact CG1-CB 3.7Å; V64-A112 HydrophobicContact CG2-CB 4.08Å |
| 65 | Y | 88.3 | Confident | 89.2 | Confident | 174 Ų | 174 | 82.9 Ų | 82.9 | 68% | 0.682 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -61.2 | -45.5 | 176.8 | 175.2 | -103.2 | 0 | 0 | 0 | 112.2 | M61 Y62 L63 N67 F68 | M61-Y65 WeakPolarHBondContact O-CB 3.43Å; M61-Y65 PolarHBondContact O-N 3.44Å; Y62-Y65 PolarHBondContact O-N 3.46Å; L63-Y65 VanDerWaalsContact C-N 3.33Å; L63-Y65 PolarHBondContact O-N 3.29Å; Y65-N67 VanDerWaalsContact C-N 3.34Å; Y65-N67 PolarHBondContact O-N 3.24Å; Y65-F68 VanDerWaalsContact O-CB 3.23Å; Y65-F68 WeakPolarHBondContact O-CB 3.3Å; Y65-F68 PolarHBondContact O-N 3.34Å; Y65-F68 VanDerWaalsContact O-N 3.15Å |
| 66 | R | 89.5 | Confident | 88.4 | Confident | 183 Ų | 183 | 85.5 Ų | 85.5 | 69% | 0.691 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -68 | -31 | -179.8 | -172.8 | 179.2 | 176.6 | 175.6 | 0.7 | 113.6 | Y62 L63 F68 | Y62-R66 WeakPolarHBondContact O-CB 3.35Å; Y62-R66 PolarHBondContact O-N 3.28Å; L63-R66 PolarHBondContact O-N 3.45Å; R66-F68 VanDerWaalsContact C-N 3.3Å |
| 67 | N | 88.3 | Confident | 87.7 | Confident | 118 Ų | 118 | 89.8 Ų | 89.8 | 63% | 0.631 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.1 | -2.7 | 175.8 | -73.9 | -84.6 | 0 | 0 | 0 | 112.6 | L63 V64 Y65 | L63-N67 WeakPolarHBondContact O-CB 3.29Å; L63-N67 PolarHBondContact O-N 2.84Å; L63-N67 PolarHBondContact O-ND2 2.92Å; V64-N67 PolarHBondContact O-N 2.94Å; Y65-N67 VanDerWaalsContact C-N 3.34Å; Y65-N67 PolarHBondContact O-N 3.24Å |
| 68 | F | 87.3 | Confident | 87.1 | Confident | 44 Ų | 44 | 92 Ų | 92 | 19% | 0.193 | 44% | 0.442 | C | S | . | . | S | Bend | trans | -69.4 | 139.9 | 175.7 | -158.7 | -95.5 | 0 | 0 | 0 | 109.3 | V64 Y65 R66 L71 V106 A109 | V64-F68 PolarHBondContact O-N 3.14Å; V64-F68 VanDerWaalsContact O-N 3.08Å; Y65-F68 VanDerWaalsContact O-CB 3.23Å; Y65-F68 WeakPolarHBondContact O-CB 3.3Å; Y65-F68 PolarHBondContact O-N 3.34Å; Y65-F68 VanDerWaalsContact O-N 3.15Å; R66-F68 VanDerWaalsContact C-N 3.3Å; F68-L71 HydrophobicContact CD1-CD1 4.43Å; F68-L71 HydrophobicContact CE1-CD1 4.37Å; F68-V106 HydrophobicContact CE2-CG2 4.06Å; F68-V106 HydrophobicContact CZ-CG2 4.05Å; F68-A109 HydrophobicContact CD2-CB 4Å; F68-A109 HydrophobicContact CE2-CB 4.01Å |
| 69 | P | 85.6 | Confident | 86.4 | Confident | 17 Ų | 17 | 93.4 Ų | 93.4 | 11% | 0.11 | 44% | 0.443 | C | S | . | . | P | Polyproline II helix | trans | -55.6 | 143.3 | -179.7 | -24.1 | 32.4 | 0 | 0 | 0 | 112.3 | L71 Y98 Y102 Q105 | P69-L71 PolarHBondContact O-N 3Å; P69-Y98 HydrophobicContact CB-CD1 3.88Å; P69-Y98 HydrophobicContact CB-CE1 3.79Å; P69-Y98 HydrophobicContact CG-CD1 4.25Å; P69-Y102 HydrophobicContact CB-CD1 4.36Å; P69-Y102 HydrophobicContact CB-CD2 3.69Å; P69-Y102 HydrophobicContact CB-CE1 4.33Å; P69-Y102 HydrophobicContact CB-CE2 3.66Å; P69-Y102 HydrophobicContact CB-CG 4.05Å; P69-Y102 HydrophobicContact CG-CD1 3.68Å; P69-Y102 HydrophobicContact CG-CD2 3.4Å; P69-Y102 HydrophobicContact CG-CE1 4.13Å; P69-Y102 HydrophobicContact CG-CE2 3.87Å; P69-Y102 HydrophobicContact CG-CG 3.28Å; P69-Q105 HydrophobicContact CG-CB 4.49Å |
| 70 | E | 82.2 | Confident | 85.8 | Confident | 184 Ų | 184 | 95 Ų | 95 | 86% | 0.86 | 44% | 0.442 | S | S | * | . | P | Polyproline II helix | trans | -60.2 | 128.9 | 178.2 | -72 | -179.2 | 176.1 | 0 | 0 | 110.7 | Y98 | E70-Y98 PolarHBondContact O-OH 3.25Š|
| 71 | L | 81.4 | Confident | 85 | Confident | 45 Ų | 45 | 97.3 Ų | 97.3 | 24% | 0.236 | 45% | 0.45 | C | S | . | . | P | Polyproline II helix | trans | -91.7 | 135.4 | 176.2 | -72.3 | 151.9 | 0 | 0 | 0 | 108.5 | F68 P69 E75 I79 V94 Y98 | F68-L71 HydrophobicContact CD1-CD1 4.43Å; F68-L71 HydrophobicContact CE1-CD1 4.37Å; P69-L71 PolarHBondContact O-N 3Å; L71-E75 HydrophobicContact CD2-CB 4.31Å; L71-I79 HydrophobicContact CD1-CD1 3.42Å; L71-I79 VanDerWaalsContact CD1-CD1 3.42Å; L71-I79 HydrophobicContact CD2-CD1 3.66Å; L71-I79 HydrophobicContact CG-CD1 4.19Å; L71-V94 HydrophobicContact CD2-CG1 4.05Å; L71-Y98 WeakPolarHBondContact CA-OH 3.39Å; L71-Y98 HydrophobicContact CD2-CD2 4.05Å; L71-Y98 HydrophobicContact CD2-CE1 4.07Å; L71-Y98 HydrophobicContact CD2-CE2 3.51Å |
| 72 | R | 84 | Confident | 84.3 | Confident | 130 Ų | 130 | 97.1 Ų | 97.1 | 49% | 0.491 | 45% | 0.452 | S | S | . | . | P | Polyproline II helix | trans | -65.1 | 148.8 | 169.6 | -60.2 | -179 | -65.6 | 148.9 | 10.6 | 109 | D74 E75 M76 | R72-D74 WeakPolarHBondContact CB-OD1 3.47Å; R72-D74 IonicContact CZ-OD1 3.5Å; R72-D74 IonicContact CZ-OD2 2.69Å; R72-D74 IonicContact NE-OD1 2.86Å; R72-D74 IonicContact NH2-OD2 3.6Å; R72-D74 PolarHBondContact O-N 3.32Å; R72-D74 VanDerWaalsContact O-N 3.14Å; R72-E75 HydrophobicContact CB-CG 4.43Å; R72-E75 IonicContact CZ-OE1 3.63Å; R72-E75 IonicContact CZ-OE2 3.63Å; R72-E75 IonicContact NE-OE1 3.85Å; R72-E75 IonicContact NE-OE2 3.63Å; R72-E75 PolarHBondContact NE-OE2 2.74Å; R72-E75 IonicContact NH2-OE1 3.81Å; R72-E75 PolarHBondContact NH2-OE1 2.94Å; R72-E75 IonicContact NH2-OE2 2.8Å; R72-E75 WeakPolarHBondContact O-CA 3.38Å; R72-E75 WeakPolarHBondContact O-CB 3.39Å; R72-E75 PolarHBondContact O-N 2.93Å; R72-M76 PolarHBondContact O-N 3.09Å |
| 73 | D | 79.7 | Confident | 83.7 | Confident | 128 Ų | 128 | 99.8 Ų | 99.8 | 68% | 0.684 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -55.9 | -35.9 | -175.6 | -64.7 | -43 | 0 | 0 | 0 | 112.5 | E75 M76 E77 | D73-E75 VanDerWaalsContact C-N 3.3Å; D73-E75 PolarHBondContact O-N 2.87Å; D73-M76 PolarHBondContact O-N 3.38Å; D73-E77 PolarHBondContact O-N 3.21Å |
| 74 | D | 80.8 | Confident | 83.2 | Confident | 73 Ų | 73 | 99.4 Ų | 99.4 | 39% | 0.39 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -70 | -21.5 | 176.2 | 71 | -63.9 | 0 | 0 | 0 | 114.3 | R72 K78 | R72-D74 WeakPolarHBondContact CB-OD1 3.47Å; R72-D74 IonicContact CZ-OD1 3.5Å; R72-D74 IonicContact CZ-OD2 2.69Å; R72-D74 IonicContact NE-OD1 2.86Å; R72-D74 IonicContact NH2-OD2 3.6Å; R72-D74 PolarHBondContact O-N 3.32Å; R72-D74 VanDerWaalsContact O-N 3.14Å; D74-K78 VanDerWaalsContact O-CE 3.26Å; D74-K78 WeakPolarHBondContact O-CE 3.39Å |
| 75 | E | 83.6 | Confident | 82.7 | Confident | 7 Ų | 7 | 103.1 Ų | 103.1 | 3% | 0.033 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -90.7 | -31 | 176.5 | -67.9 | 176.3 | 142.6 | 0 | 0 | 111.2 | L71 R72 D73 E77 K78 I79 V94 K97 Y98 | L71-E75 HydrophobicContact CD2-CB 4.31Å; R72-E75 HydrophobicContact CB-CG 4.43Å; R72-E75 IonicContact CZ-OE1 3.63Å; R72-E75 IonicContact CZ-OE2 3.63Å; R72-E75 IonicContact NE-OE1 3.85Å; R72-E75 IonicContact NE-OE2 3.63Å; R72-E75 PolarHBondContact NE-OE2 2.74Å; R72-E75 IonicContact NH2-OE1 3.81Å; R72-E75 PolarHBondContact NH2-OE1 2.94Å; R72-E75 IonicContact NH2-OE2 2.8Å; R72-E75 WeakPolarHBondContact O-CA 3.38Å; R72-E75 WeakPolarHBondContact O-CB 3.39Å; R72-E75 PolarHBondContact O-N 2.93Å; D73-E75 VanDerWaalsContact C-N 3.3Å; D73-E75 PolarHBondContact O-N 2.87Å; E75-E77 VanDerWaalsContact C-N 3.33Å; E75-E77 PolarHBondContact O-N 2.9Å; E75-K78 WeakPolarHBondContact O-CB 3.45Å; E75-K78 PolarHBondContact O-N 2.78Å; E75-K78 VanDerWaalsContact O-N 3.07Å; E75-I79 PolarHBondContact O-N 2.69Å; E75-V94 HydrophobicContact CB-CG1 4.11Å; E75-V94 HydrophobicContact CB-CG2 4.32Å; E75-V94 HydrophobicContact CG-CG2 4.29Å; E75-K97 IonicContact OE1-NZ 3.94Å; E75-K97 PolarHBondContact OE1-NZ 2.81Å; E75-K97 IonicContact OE2-NZ 2.69Å; E75-Y98 PolarHBondContact OE2-OH 2.91Å |
| 76 | M | 78.8 | Confident | 82.5 | Confident | 103 Ų | 103 | 100 Ų | 100 | 51% | 0.507 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -63.5 | -38.1 | 177.6 | -170.6 | 164.5 | 58 | 0 | 0 | 112.1 | R72 D73 K78 I79 | R72-M76 PolarHBondContact O-N 3.09Å; D73-M76 PolarHBondContact O-N 3.38Å; M76-K78 PolarHBondContact O-N 3.49Å; M76-I79 PolarHBondContact O-N 3.24Å; M76-I79 VanDerWaalsContact O-N 3.1Å |
| 77 | E | 81 | Confident | 82.3 | Confident | 159 Ų | 159 | 92.5 Ų | 92.5 | 74% | 0.743 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.5 | -24.1 | 173.9 | -69 | -170.4 | 162.2 | 0 | 0 | 113.5 | D73 E75 | D73-E77 PolarHBondContact O-N 3.21Å; E75-E77 VanDerWaalsContact C-N 3.33Å; E75-E77 PolarHBondContact O-N 2.9Å |
| 78 | K | 81.1 | Confident | 82.1 | Confident | 83 Ų | 83 | 87.9 Ų | 87.9 | 36% | 0.361 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | -16.1 | 179 | -59.9 | 169.9 | -171.9 | 158.9 | 0 | 112.3 | D74 E75 M76 K80 A90 V94 | D74-K78 VanDerWaalsContact O-CE 3.26Å; D74-K78 WeakPolarHBondContact O-CE 3.39Å; E75-K78 WeakPolarHBondContact O-CB 3.45Å; E75-K78 PolarHBondContact O-N 2.78Å; E75-K78 VanDerWaalsContact O-N 3.07Å; M76-K78 PolarHBondContact O-N 3.49Å; K78-K80 VanDerWaalsContact C-N 3.29Å; K78-K80 PolarHBondContact O-N 2.89Å; K78-A90 HydrophobicContact CB-CB 4.44Å; K78-A90 HydrophobicContact CD-CB 4.5Å; K78-A90 HydrophobicContact CG-CB 4.41Å; K78-V94 HydrophobicContact CB-CG2 4.05Å; K78-V94 HydrophobicContact CD-CG2 3.89Å |
| 79 | I | 81.5 | Confident | 82.1 | Confident | 66 Ų | 66 | 88 Ų | 88 | 34% | 0.338 | 43% | 0.429 | S | S | . | . | trans | -84.8 | 74.6 | 174.5 | -55.1 | -164 | 0 | 0 | 0 | 110 | L71 E75 M76 L91 V94 L95 | L71-I79 HydrophobicContact CD1-CD1 3.42Å; L71-I79 VanDerWaalsContact CD1-CD1 3.42Å; L71-I79 HydrophobicContact CD2-CD1 3.66Å; L71-I79 HydrophobicContact CG-CD1 4.19Å; E75-I79 PolarHBondContact O-N 2.69Å; M76-I79 PolarHBondContact O-N 3.24Å; M76-I79 VanDerWaalsContact O-N 3.1Å; I79-L91 HydrophobicContact CB-CD1 4.37Å; I79-L91 HydrophobicContact CG1-CD1 4.35Å; I79-L91 HydrophobicContact CG2-CD1 4.25Å; I79-V94 HydrophobicContact CD1-CG1 4.2Å; I79-V94 HydrophobicContact CG1-CG1 4.25Å; I79-L95 HydrophobicContact CD1-CD2 4.33Å | ||
| 80 | K | 80.5 | Confident | 82.2 | Confident | 104 Ų | 104 | 88.8 Ų | 88.8 | 45% | 0.452 | 44% | 0.436 | S | S | . | . | S | Bend | trans | -133.1 | 163.2 | 175.2 | 59.5 | -179.9 | 175.8 | 162.5 | 0 | 110.4 | K78 P82 D87 | K78-K80 VanDerWaalsContact C-N 3.29Å; K78-K80 PolarHBondContact O-N 2.89Å; K80-P82 WeakPolarHBondContact O-CD 3.47Å; K80-D87 VanDerWaalsContact CE-CG 3.41Å; K80-D87 WeakPolarHBondContact CE-OD1 3.3Å; K80-D87 WeakPolarHBondContact CE-OD2 3.44Å; K80-D87 VanDerWaalsContact NZ-CG 3.29Å; K80-D87 IonicContact NZ-OD1 3.2Å; K80-D87 PolarHBondContact NZ-OD1 3.47Å; K80-D87 IonicContact NZ-OD2 3.69Å; K80-D87 PolarHBondContact NZ-OD2 3.42Å |
| 81 | I | 77.9 | Confident | 82.4 | Confident | 129 Ų | 129 | 81.3 Ų | 81.3 | 66% | 0.662 | 40% | 0.402 | S | S | * | . | trans | -63.5 | 121 | 172.7 | -59.9 | 176.7 | 0 | 0 | 0 | 107.7 | K83 | I81-K83 PolarHBondContact O-N 3.01Š| ||
| 82 | P | 80.3 | Confident | 82.7 | Confident | 38 Ų | 38 | 79.3 Ų | 79.3 | 25% | 0.247 | 39% | 0.392 | C | S | . | . | trans | -70.7 | 129 | -173.7 | 26.9 | -32.4 | 0 | 0 | 0 | 110.8 | K80 D87 A88 L91 | K80-P82 WeakPolarHBondContact O-CD 3.47Å; P82-D87 HydrophobicContact CB-CB 3.84Å; P82-A88 HydrophobicContact CB-CB 3.8Å; P82-A88 HydrophobicContact CG-CB 4.3Å; P82-L91 HydrophobicContact CG-CD2 4.29Å | ||
| 83 | K | 81.7 | Confident | 83 | Confident | 191 Ų | 191 | 76.5 Ų | 76.5 | 83% | 0.83 | 39% | 0.389 | S | S | * | . | S | Bend | trans | -97.9 | -23.9 | 177.9 | -65.8 | -178.1 | -179.3 | 176.6 | 0 | 112.7 | I81 D87 | I81-K83 PolarHBondContact O-N 3.01Å; K83-D87 PolarHBondContact N-OD2 3.26Å |
| 84 | D | 82.5 | Confident | 83.4 | Confident | 85 Ų | 85 | 70.7 Ų | 70.7 | 46% | 0.455 | 36% | 0.359 | S | S | . | . | S | Bend | trans | -138.7 | -179 | 178.7 | 57.3 | 48.4 | 0 | 0 | 0 | 110.8 | D86 D87 A88 | D84-D86 VanDerWaalsContact C-N 3.33Å; D84-D86 PolarHBondContact OD1-N 2.87Å; D84-D87 WeakPolarHBondContact OD1-CB 3.3Å; D84-D87 PolarHBondContact OD1-N 3.33Å; D84-A88 PolarHBondContact O-N 2.92Å |
| 85 | M | 81.4 | Confident | 83.8 | Confident | 104 Ų | 104 | 68.2 Ų | 68.2 | 51% | 0.512 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -67.6 | -33.7 | -178.5 | -174.8 | 171.8 | 60.6 | 0 | 0 | 112.1 | A88 K89 L244 L247 | M85-A88 PolarHBondContact O-N 3.34Å; M85-K89 HydrophobicContact CG-CG 4.48Å; M85-K89 VanDerWaalsContact O-CG 3.29Å; M85-K89 WeakPolarHBondContact O-CG 3.43Å; M85-K89 PolarHBondContact O-N 3.48Å; M85-L244 HydrophobicContact CG-CD1 4.27Å; M85-L247 HydrophobicContact SD-CD1 4.44Å |
| 86 | D | 84.5 | Confident | 84.1 | Confident | 108 Ų | 108 | 68.7 Ų | 68.7 | 58% | 0.578 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -73.9 | -41 | -176.4 | -66 | -33.5 | 0 | 0 | 0 | 111.1 | D84 A88 K89 A90 | D84-D86 VanDerWaalsContact C-N 3.33Å; D84-D86 PolarHBondContact OD1-N 2.87Å; D86-A88 VanDerWaalsContact C-N 3.27Å; D86-A88 PolarHBondContact O-N 3.29Å; D86-K89 PolarHBondContact O-N 3.37Å; D86-A90 WeakPolarHBondContact O-CB 3.41Å; D86-A90 PolarHBondContact O-N 2.88Å |
| 87 | D | 84.6 | Confident | 84.6 | Confident | 27 Ų | 27 | 68.2 Ų | 68.2 | 14% | 0.144 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -56.7 | -42.7 | 168.9 | -80.9 | -12.6 | 0 | 0 | 0 | 111.1 | K80 P82 K83 D84 A90 L91 | K80-D87 VanDerWaalsContact CE-CG 3.41Å; K80-D87 WeakPolarHBondContact CE-OD1 3.3Å; K80-D87 WeakPolarHBondContact CE-OD2 3.44Å; K80-D87 VanDerWaalsContact NZ-CG 3.29Å; K80-D87 IonicContact NZ-OD1 3.2Å; K80-D87 PolarHBondContact NZ-OD1 3.47Å; K80-D87 IonicContact NZ-OD2 3.69Å; K80-D87 PolarHBondContact NZ-OD2 3.42Å; P82-D87 HydrophobicContact CB-CB 3.84Å; K83-D87 PolarHBondContact N-OD2 3.26Å; D84-D87 WeakPolarHBondContact OD1-CB 3.3Å; D84-D87 PolarHBondContact OD1-N 3.33Å; D87-A90 PolarHBondContact O-N 3.33Å; D87-L91 VanDerWaalsContact O-CB 3.3Å; D87-L91 WeakPolarHBondContact O-CB 3.27Å; D87-L91 PolarHBondContact O-N 2.85Å |
| 88 | A | 84.5 | Confident | 84.9 | Confident | 20 Ų | 20 | 61.4 Ų | 61.4 | 17% | 0.165 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -67 | -41.3 | 180 | 0 | 0 | 0 | 0 | 0 | 112.2 | P82 D84 M85 D86 G92 L244 | P82-A88 HydrophobicContact CB-CB 3.8Å; P82-A88 HydrophobicContact CG-CB 4.3Å; D84-A88 PolarHBondContact O-N 2.92Å; M85-A88 PolarHBondContact O-N 3.34Å; D86-A88 VanDerWaalsContact C-N 3.27Å; D86-A88 PolarHBondContact O-N 3.29Å; A88-G92 PolarHBondContact O-N 3.39Å; A88-L244 HydrophobicContact CB-CD1 4.33Å; A88-L244 HydrophobicContact CB-CD2 3.77Å |
| 89 | K | 86.6 | Confident | 85.4 | Confident | 48 Ų | 48 | 59 Ų | 59 | 21% | 0.209 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.7 | -48.9 | 173.3 | -69.2 | -178.5 | -179.8 | 174.9 | 0 | 110.6 | M85 D86 L91 G92 T93 L244 T248 | M85-K89 HydrophobicContact CG-CG 4.48Å; M85-K89 VanDerWaalsContact O-CG 3.29Å; M85-K89 WeakPolarHBondContact O-CG 3.43Å; M85-K89 PolarHBondContact O-N 3.48Å; D86-K89 PolarHBondContact O-N 3.37Å; K89-L91 PolarHBondContact O-N 3.18Å; K89-G92 PolarHBondContact O-N 3.14Å; K89-T93 PolarHBondContact O-N 2.73Å; K89-T93 PolarHBondContact O-OG1 2.93Å; K89-L244 HydrophobicContact CG-CD1 3.72Å; K89-T248 HydrophobicContact CB-CG2 4.23Å; K89-T248 WeakPolarHBondContact CG-OG1 3.38Å |
| 90 | A | 87.1 | Confident | 85.8 | Confident | 32 Ų | 32 | 61.2 Ų | 61.2 | 26% | 0.264 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -59.1 | -46.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | K78 D86 D87 T93 V94 | K78-A90 HydrophobicContact CB-CB 4.44Å; K78-A90 HydrophobicContact CD-CB 4.5Å; K78-A90 HydrophobicContact CG-CB 4.41Å; D86-A90 WeakPolarHBondContact O-CB 3.41Å; D86-A90 PolarHBondContact O-N 2.88Å; D87-A90 PolarHBondContact O-N 3.33Å; A90-T93 PolarHBondContact O-N 3.17Å; A90-V94 WeakPolarHBondContact O-CG2 3.46Å; A90-V94 PolarHBondContact O-N 2.97Å; A90-V94 VanDerWaalsContact O-N 3.11Å |
| 91 | L | 87.9 | Confident | 86.2 | Confident | 28 Ų | 28 | 60.8 Ų | 60.8 | 15% | 0.147 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59.2 | -48.6 | 174.8 | 178.2 | 65.6 | 0 | 0 | 0 | 111.4 | I79 P82 D87 K89 T93 V94 L95 | I79-L91 HydrophobicContact CB-CD1 4.37Å; I79-L91 HydrophobicContact CG1-CD1 4.35Å; I79-L91 HydrophobicContact CG2-CD1 4.25Å; P82-L91 HydrophobicContact CG-CD2 4.29Å; D87-L91 VanDerWaalsContact O-CB 3.3Å; D87-L91 WeakPolarHBondContact O-CB 3.27Å; D87-L91 PolarHBondContact O-N 2.85Å; K89-L91 PolarHBondContact O-N 3.18Å; L91-T93 PolarHBondContact O-N 2.95Å; L91-V94 PolarHBondContact O-N 3.19Å; L91-L95 HydrophobicContact CD1-CD1 3.79Å; L91-L95 HydrophobicContact CD1-CG 4.2Å; L91-L95 HydrophobicContact CG-CD1 3.92Å; L91-L95 WeakPolarHBondContact O-CB 3.49Å; L91-L95 WeakPolarHBondContact O-CG 3.25Å; L91-L95 PolarHBondContact O-N 3.24Å |
| 92 | G | 87.4 | Confident | 86.8 | Confident | 2 Ų | 2 | 59.1 Ų | 59.1 | 2% | 0.021 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -59.5 | -44.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | A88 K89 L95 S96 Y134 | A88-G92 PolarHBondContact O-N 3.39Å; K89-G92 PolarHBondContact O-N 3.14Å; G92-L95 PolarHBondContact O-N 2.66Å; G92-S96 VanDerWaalsContact O-CB 3.27Å; G92-S96 WeakPolarHBondContact O-CB 3.35Å; G92-S96 PolarHBondContact O-N 2.97Å; G92-Y134 VanDerWaalsContact C-CZ 3.48Å; G92-Y134 WeakPolarHBondContact O-CE1 3.47Å |
| 93 | T | 89.3 | Confident | 87.3 | Confident | 71 Ų | 71 | 61.8 Ų | 61.8 | 44% | 0.436 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -60.4 | -47.5 | 178.1 | -58.7 | 0 | 0 | 0 | 0 | 111.9 | K89 A90 L91 S96 K97 Y134 T248 | K89-T93 PolarHBondContact O-N 2.73Å; K89-T93 PolarHBondContact O-OG1 2.93Å; A90-T93 PolarHBondContact O-N 3.17Å; L91-T93 PolarHBondContact O-N 2.95Å; T93-S96 PolarHBondContact O-N 3.35Å; T93-K97 WeakPolarHBondContact O-CB 3.47Å; T93-K97 PolarHBondContact O-N 3.14Å; T93-Y134 PolarHBondContact N-OH 2.79Å; T93-T248 WeakPolarHBondContact OG1-CG2 3.47Å |
| 94 | V | 89.2 | Confident | 87.7 | Confident | 6 Ų | 6 | 57.2 Ų | 57.2 | 4% | 0.036 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -61.2 | -52 | 177.6 | 173.4 | 0 | 0 | 0 | 0 | 109.8 | L71 E75 K78 I79 A90 L91 S96 K97 Y98 | L71-V94 HydrophobicContact CD2-CG1 4.05Å; E75-V94 HydrophobicContact CB-CG1 4.11Å; E75-V94 HydrophobicContact CB-CG2 4.32Å; E75-V94 HydrophobicContact CG-CG2 4.29Å; K78-V94 HydrophobicContact CB-CG2 4.05Å; K78-V94 HydrophobicContact CD-CG2 3.89Å; I79-V94 HydrophobicContact CD1-CG1 4.2Å; I79-V94 HydrophobicContact CG1-CG1 4.25Å; A90-V94 WeakPolarHBondContact O-CG2 3.46Å; A90-V94 PolarHBondContact O-N 2.97Å; A90-V94 VanDerWaalsContact O-N 3.11Å; L91-V94 PolarHBondContact O-N 3.19Å; V94-S96 VanDerWaalsContact C-N 3.3Å; V94-S96 PolarHBondContact O-N 2.97Å; V94-K97 WeakPolarHBondContact O-CB 3.47Å; V94-K97 PolarHBondContact O-N 3.44Å; V94-Y98 HydrophobicContact CG1-CD2 4.05Å; V94-Y98 HydrophobicContact CG1-CE2 4.18Å; V94-Y98 WeakPolarHBondContact O-CD2 3.44Å; V94-Y98 PolarHBondContact O-N 3.48Å; V94-Y98 VanDerWaalsContact O-N 3.07Å |
| 95 | L | 87.9 | Confident | 88.1 | Confident | 22 Ų | 22 | 57 Ų | 57 | 12% | 0.115 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -64.5 | -33.2 | -177.8 | -68 | 177.1 | 0 | 0 | 0 | 113.1 | I79 L91 G92 Y98 K99 L131 L135 | I79-L95 HydrophobicContact CD1-CD2 4.33Å; L91-L95 HydrophobicContact CD1-CD1 3.79Å; L91-L95 HydrophobicContact CD1-CG 4.2Å; L91-L95 HydrophobicContact CG-CD1 3.92Å; L91-L95 WeakPolarHBondContact O-CB 3.49Å; L91-L95 WeakPolarHBondContact O-CG 3.25Å; L91-L95 PolarHBondContact O-N 3.24Å; G92-L95 PolarHBondContact O-N 2.66Å; L95-Y98 PolarHBondContact O-N 3.05Å; L95-K99 VanDerWaalsContact O-CB 3.22Å; L95-K99 WeakPolarHBondContact O-CB 3.48Å; L95-K99 PolarHBondContact O-N 3.44Å; L95-L131 HydrophobicContact CD1-CD1 3.63Å; L95-L131 HydrophobicContact CD1-CD2 3.75Å; L95-L131 HydrophobicContact CD1-CG 4.32Å; L95-L135 HydrophobicContact CB-CD1 4.44Å; L95-L135 HydrophobicContact CB-CD2 3.91Å |
| 96 | S | 89.7 | Confident | 88.7 | Confident | 17 Ų | 17 | 52.3 Ų | 52.3 | 12% | 0.119 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.3 | -45.6 | 174.2 | -168.5 | 0 | 0 | 0 | 0 | 111.8 | G92 T93 V94 Y98 K99 D100 | G92-S96 VanDerWaalsContact O-CB 3.27Å; G92-S96 WeakPolarHBondContact O-CB 3.35Å; G92-S96 PolarHBondContact O-N 2.97Å; T93-S96 PolarHBondContact O-N 3.35Å; V94-S96 VanDerWaalsContact C-N 3.3Å; V94-S96 PolarHBondContact O-N 2.97Å; S96-Y98 VanDerWaalsContact C-N 3.29Å; S96-Y98 PolarHBondContact O-N 3.13Å; S96-K99 PolarHBondContact O-N 3.45Å; S96-K99 VanDerWaalsContact O-N 3.15Å; S96-D100 PolarHBondContact O-N 2.93Å |
| 97 | K | 90.2 | Very high | 89.1 | Confident | 93 Ų | 93 | 49.3 Ų | 49.3 | 40% | 0.404 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -56.1 | -45.1 | 175.6 | 176.7 | -172.4 | 168.6 | -167 | 0 | 111.4 | E75 T93 V94 D100 T101 | E75-K97 IonicContact OE1-NZ 3.94Å; E75-K97 PolarHBondContact OE1-NZ 2.81Å; E75-K97 IonicContact OE2-NZ 2.69Å; T93-K97 WeakPolarHBondContact O-CB 3.47Å; T93-K97 PolarHBondContact O-N 3.14Å; V94-K97 WeakPolarHBondContact O-CB 3.47Å; V94-K97 PolarHBondContact O-N 3.44Å; K97-D100 PolarHBondContact O-N 3.49Å; K97-T101 PolarHBondContact O-N 3.29Å; K97-T101 PolarHBondContact O-OG1 3.34Å |
| 98 | Y | 87.1 | Confident | 89.5 | Confident | 16 Ų | 16 | 51.7 Ų | 51.7 | 6% | 0.063 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -71 | -35.6 | 177.8 | -84.4 | -95.4 | 0 | 0 | 0 | 112.5 | P69 E70 L71 E75 V94 L95 S96 D100 T101 Y102 | P69-Y98 HydrophobicContact CB-CD1 3.88Å; P69-Y98 HydrophobicContact CB-CE1 3.79Å; P69-Y98 HydrophobicContact CG-CD1 4.25Å; E70-Y98 PolarHBondContact O-OH 3.25Å; L71-Y98 WeakPolarHBondContact CA-OH 3.39Å; L71-Y98 HydrophobicContact CD2-CD2 4.05Å; L71-Y98 HydrophobicContact CD2-CE1 4.07Å; L71-Y98 HydrophobicContact CD2-CE2 3.51Å; E75-Y98 PolarHBondContact OE2-OH 2.91Å; V94-Y98 HydrophobicContact CG1-CD2 4.05Å; V94-Y98 HydrophobicContact CG1-CE2 4.18Å; V94-Y98 WeakPolarHBondContact O-CD2 3.44Å; V94-Y98 PolarHBondContact O-N 3.48Å; V94-Y98 VanDerWaalsContact O-N 3.07Å; L95-Y98 PolarHBondContact O-N 3.05Å; S96-Y98 VanDerWaalsContact C-N 3.29Å; S96-Y98 PolarHBondContact O-N 3.13Å; Y98-D100 VanDerWaalsContact C-N 3.3Å; Y98-D100 PolarHBondContact O-N 2.91Å; Y98-T101 PolarHBondContact O-N 2.98Å; Y98-Y102 AromaticContact CD1-CD2 3.94Å; Y98-Y102 HydrophobicContact CD1-CD2 3.94Å; Y98-Y102 HydrophobicContact CD1-CE2 4.29Å; Y98-Y102 HydrophobicContact CE1-CE2 4.43Å; Y98-Y102 CarbonylContact O-C 3.56Å; Y98-Y102 WeakPolarHBondContact O-CA 3.26Å; Y98-Y102 WeakPolarHBondContact O-CB 3.49Å; Y98-Y102 PolarHBondContact O-N 2.97Å |
| 99 | K | 90.9 | Very high | 90 | Very high | 33 Ų | 33 | 51.4 Ų | 51.4 | 14% | 0.143 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -64.9 | -33.7 | 175 | 169.8 | -98 | 170.1 | 179.8 | 0 | 112.1 | L95 S96 T101 Y103 V106 L135 Y136 | L95-K99 VanDerWaalsContact O-CB 3.22Å; L95-K99 WeakPolarHBondContact O-CB 3.48Å; L95-K99 PolarHBondContact O-N 3.44Å; S96-K99 PolarHBondContact O-N 3.45Å; S96-K99 VanDerWaalsContact O-N 3.15Å; K99-T101 VanDerWaalsContact C-N 3.33Å; K99-Y103 HydrophobicContact CD-CD2 4.34Å; K99-Y103 HydrophobicContact CG-CD2 4.02Å; K99-Y103 HydrophobicContact CG-CE2 4.45Å; K99-Y103 WeakPolarHBondContact O-CA 3.44Å; K99-Y103 WeakPolarHBondContact O-CB 3.2Å; K99-Y103 PolarHBondContact O-N 2.94Å; K99-V106 HydrophobicContact CB-CB 4.19Å; K99-V106 HydrophobicContact CB-CG1 4.05Å; K99-V106 HydrophobicContact CB-CG2 4.19Å; K99-L135 VanDerWaalsContact CE-O 3.3Å; K99-L135 WeakPolarHBondContact CE-O 3.42Å; K99-L135 PolarHBondContact NZ-O 2.9Å; K99-Y136 HydrophobicContact CG-CE1 4.29Å |
| 100 | D | 89.7 | Confident | 90.3 | Very high | 112 Ų | 112 | 49.6 Ų | 49.6 | 60% | 0.599 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -73.2 | -27.4 | 177.9 | -65.7 | -26.5 | 0 | 0 | 0 | 112.3 | S96 K97 Y98 | S96-D100 PolarHBondContact O-N 2.93Å; K97-D100 PolarHBondContact O-N 3.49Å; Y98-D100 VanDerWaalsContact C-N 3.3Å; Y98-D100 PolarHBondContact O-N 2.91Å |
| 101 | T | 89.5 | Confident | 90.7 | Very high | 94 Ų | 94 | 51.1 Ų | 51.1 | 58% | 0.577 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -93.1 | -36.4 | 178.7 | -48 | 0 | 0 | 0 | 0 | 112.9 | K97 Y98 K99 | K97-T101 PolarHBondContact O-N 3.29Å; K97-T101 PolarHBondContact O-OG1 3.34Å; Y98-T101 PolarHBondContact O-N 2.98Å; K99-T101 VanDerWaalsContact C-N 3.33Å |
| 102 | Y | 90.5 | Very high | 91.1 | Very high | 95 Ų | 95 | 50.8 Ų | 50.8 | 37% | 0.373 | 27% | 0.265 | S | S | . | . | S | Bend | trans | -132.4 | 52.6 | -170.4 | -58.3 | -77.6 | 0 | 0 | 0 | 111.1 | P69 Y98 T104 Q105 V106 | P69-Y102 HydrophobicContact CB-CD1 4.36Å; P69-Y102 HydrophobicContact CB-CD2 3.69Å; P69-Y102 HydrophobicContact CB-CE1 4.33Å; P69-Y102 HydrophobicContact CB-CE2 3.66Å; P69-Y102 HydrophobicContact CB-CG 4.05Å; P69-Y102 HydrophobicContact CG-CD1 3.68Å; P69-Y102 HydrophobicContact CG-CD2 3.4Å; P69-Y102 HydrophobicContact CG-CE1 4.13Å; P69-Y102 HydrophobicContact CG-CE2 3.87Å; P69-Y102 HydrophobicContact CG-CG 3.28Å; Y98-Y102 AromaticContact CD1-CD2 3.94Å; Y98-Y102 HydrophobicContact CD1-CD2 3.94Å; Y98-Y102 HydrophobicContact CD1-CE2 4.29Å; Y98-Y102 HydrophobicContact CE1-CE2 4.43Å; Y98-Y102 CarbonylContact O-C 3.56Å; Y98-Y102 WeakPolarHBondContact O-CA 3.26Å; Y98-Y102 WeakPolarHBondContact O-CB 3.49Å; Y98-Y102 PolarHBondContact O-N 2.97Å; Y102-T104 VanDerWaalsContact C-N 3.34Å; Y102-T104 PolarHBondContact O-N 2.62Å; Y102-Q105 PolarHBondContact O-N 3.17Å; Y102-Q105 PolarHBondContact O-OE1 3.35Å; Y102-V106 PolarHBondContact O-N 2.83Å |
| 103 | Y | 90.9 | Very high | 91.5 | Very high | 93 Ų | 93 | 52.8 Ų | 52.8 | 37% | 0.365 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -50.8 | -49.4 | -173.4 | -175.6 | -92.1 | 0 | 0 | 0 | 113.4 | K99 Q105 V106 L107 Y136 L140 | K99-Y103 HydrophobicContact CD-CD2 4.34Å; K99-Y103 HydrophobicContact CG-CD2 4.02Å; K99-Y103 HydrophobicContact CG-CE2 4.45Å; K99-Y103 WeakPolarHBondContact O-CA 3.44Å; K99-Y103 WeakPolarHBondContact O-CB 3.2Å; K99-Y103 PolarHBondContact O-N 2.94Å; Y103-Q105 PolarHBondContact O-N 3.45Å; Y103-V106 PolarHBondContact O-N 3.29Å; Y103-L107 HydrophobicContact CE1-CD2 4.01Å; Y103-L107 VanDerWaalsContact O-CB 3.32Å; Y103-L107 WeakPolarHBondContact O-CB 3.41Å; Y103-L107 PolarHBondContact O-N 3.5Å; Y103-Y136 HydrophobicContact CD2-CE1 4.47Å; Y103-Y136 HydrophobicContact CE2-CD1 4.04Å; Y103-Y136 AromaticContact CE2-CE1 3.63Å; Y103-Y136 HydrophobicContact CE2-CE1 3.63Å; Y103-Y136 AromaticContact CZ-CE1 3.84Å; Y103-L140 WeakPolarHBondContact OH-CD2 3.34Å |
| 104 | T | 91.2 | Very high | 91.8 | Very high | 95 Ų | 95 | 49.8 Ų | 49.8 | 58% | 0.583 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -64.5 | -42.6 | -177.3 | -54.2 | 0 | 0 | 0 | 0 | 111.8 | Y102 L107 V108 | Y102-T104 VanDerWaalsContact C-N 3.34Å; Y102-T104 PolarHBondContact O-N 2.62Å; T104-L107 PolarHBondContact O-N 2.96Å; T104-V108 HydrophobicContact CG2-CG2 4.37Å; T104-V108 WeakPolarHBondContact O-CB 3.32Å; T104-V108 VanDerWaalsContact O-CG2 3.29Å; T104-V108 WeakPolarHBondContact O-CG2 3.37Å; T104-V108 PolarHBondContact O-N 3.36Å |
| 105 | Q | 90.9 | Very high | 92.1 | Very high | 80 Ų | 80 | 50.5 Ų | 50.5 | 37% | 0.374 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64.2 | -45.4 | 179.6 | -66.3 | 81.9 | -13.1 | 0 | 0 | 110.8 | P69 Y102 Y103 V108 A109 | P69-Q105 HydrophobicContact CG-CB 4.49Å; Y102-Q105 PolarHBondContact O-N 3.17Å; Y102-Q105 PolarHBondContact O-OE1 3.35Å; Y103-Q105 PolarHBondContact O-N 3.45Å; Q105-V108 PolarHBondContact O-N 2.76Å; Q105-A109 VanDerWaalsContact O-CB 3.26Å; Q105-A109 WeakPolarHBondContact O-CB 3.43Å; Q105-A109 PolarHBondContact O-N 3.15Å |
| 106 | V | 92.4 | Very high | 92.5 | Very high | 7 Ų | 7 | 51 Ų | 51 | 4% | 0.042 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -65.2 | -40 | 177 | 179.9 | 0 | 0 | 0 | 0 | 111.3 | F68 K99 Y102 Y103 A109 Y110 L135 | F68-V106 HydrophobicContact CE2-CG2 4.06Å; F68-V106 HydrophobicContact CZ-CG2 4.05Å; K99-V106 HydrophobicContact CB-CB 4.19Å; K99-V106 HydrophobicContact CB-CG1 4.05Å; K99-V106 HydrophobicContact CB-CG2 4.19Å; Y102-V106 PolarHBondContact O-N 2.83Å; Y103-V106 PolarHBondContact O-N 3.29Å; V106-A109 PolarHBondContact O-N 2.82Å; V106-Y110 VanDerWaalsContact O-CB 3.24Å; V106-Y110 WeakPolarHBondContact O-CB 3.3Å; V106-Y110 PolarHBondContact O-N 2.99Å; V106-L135 HydrophobicContact CG1-CD1 4.27Å |
| 107 | L | 93.6 | Very high | 92.8 | Very high | 45 Ų | 45 | 51.6 Ų | 51.6 | 24% | 0.236 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.1 | -45.2 | 177.4 | -176 | 64 | 0 | 0 | 0 | 112.2 | Y103 T104 Y110 F111 Y136 L144 | Y103-L107 HydrophobicContact CE1-CD2 4.01Å; Y103-L107 VanDerWaalsContact O-CB 3.32Å; Y103-L107 WeakPolarHBondContact O-CB 3.41Å; Y103-L107 PolarHBondContact O-N 3.5Å; T104-L107 PolarHBondContact O-N 2.96Å; L107-Y110 PolarHBondContact O-N 2.79Å; L107-F111 VanDerWaalsContact O-CB 3.3Å; L107-F111 WeakPolarHBondContact O-CB 3.21Å; L107-F111 PolarHBondContact O-N 3.15Å; L107-Y136 WeakPolarHBondContact CA-OH 3.47Å; L107-Y136 HydrophobicContact CD1-CE1 4.26Å; L107-L144 HydrophobicContact CD1-CD1 3.69Å; L107-L144 HydrophobicContact CD1-CD2 4.06Å |
| 108 | V | 93.7 | Very high | 93 | Very high | 77 Ų | 77 | 47.6 Ų | 47.6 | 47% | 0.467 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -63.7 | -44.1 | 176.2 | 168.8 | 0 | 0 | 0 | 0 | 110.6 | V64 T104 Q105 F111 A112 | V64-V108 HydrophobicContact CG2-CG1 4.3Å; T104-V108 HydrophobicContact CG2-CG2 4.37Å; T104-V108 WeakPolarHBondContact O-CB 3.32Å; T104-V108 VanDerWaalsContact O-CG2 3.29Å; T104-V108 WeakPolarHBondContact O-CG2 3.37Å; T104-V108 PolarHBondContact O-N 3.36Å; Q105-V108 PolarHBondContact O-N 2.76Å; V108-F111 PolarHBondContact O-N 3.16Å; V108-A112 VanDerWaalsContact O-CB 3.23Å; V108-A112 WeakPolarHBondContact O-CB 3.41Å; V108-A112 PolarHBondContact O-N 3.29Å |
| 109 | A | 93.3 | Very high | 93.5 | Very high | 14 Ų | 14 | 47.3 Ų | 47.3 | 12% | 0.116 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62 | -44.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | V64 F68 Q105 V106 T113 | V64-A109 HydrophobicContact CG1-CB 3.7Å; F68-A109 HydrophobicContact CD2-CB 4Å; F68-A109 HydrophobicContact CE2-CB 4.01Å; Q105-A109 VanDerWaalsContact O-CB 3.26Å; Q105-A109 WeakPolarHBondContact O-CB 3.43Å; Q105-A109 PolarHBondContact O-N 3.15Å; V106-A109 PolarHBondContact O-N 2.82Å; A109-T113 VanDerWaalsContact O-CB 3.26Å; A109-T113 WeakPolarHBondContact O-CB 3.37Å; A109-T113 PolarHBondContact O-N 3.35Å; A109-T113 PolarHBondContact O-OG1 3.1Å |
| 110 | Y | 94.2 | Very high | 93.7 | Very high | 10 Ų | 10 | 47.5 Ų | 47.5 | 4% | 0.039 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -56.8 | -52.6 | 173.4 | 171.5 | -91.8 | 0 | 0 | 0 | 111.5 | V106 L107 T113 Y114 L128 S132 L144 V145 | V106-Y110 VanDerWaalsContact O-CB 3.24Å; V106-Y110 WeakPolarHBondContact O-CB 3.3Å; V106-Y110 PolarHBondContact O-N 2.99Å; L107-Y110 PolarHBondContact O-N 2.79Å; Y110-T113 PolarHBondContact O-N 3.5Å; Y110-Y114 HydrophobicContact CE1-CD2 4.35Å; Y110-Y114 HydrophobicContact CE2-CD2 4.33Å; Y110-Y114 AromaticContact CZ-CD2 3.83Å; Y110-Y114 WeakPolarHBondContact O-CB 3.46Å; Y110-Y114 PolarHBondContact O-N 3.33Å; Y110-L128 HydrophobicContact CD2-CB 4.48Å; Y110-L128 HydrophobicContact CD2-CD2 4.29Å; Y110-L128 HydrophobicContact CE2-CB 3.83Å; Y110-L128 HydrophobicContact CE2-CD2 4.45Å; Y110-L128 WeakPolarHBondContact CE2-O 3.47Å; Y110-S132 WeakPolarHBondContact OH-CB 3.42Å; Y110-L144 HydrophobicContact CE1-CB 4.22Å; Y110-V145 VanDerWaalsContact OH-CG2 3.29Å; Y110-V145 WeakPolarHBondContact OH-CG2 3.49Å |
| 111 | F | 95.8 | Very high | 93.8 | Very high | 64 Ų | 64 | 44 Ų | 44 | 28% | 0.281 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -63.9 | -47.2 | -176 | -168.7 | -93.7 | 0 | 0 | 0 | 111.8 | L107 V108 Y114 I115 L147 C148 L151 | L107-F111 VanDerWaalsContact O-CB 3.3Å; L107-F111 WeakPolarHBondContact O-CB 3.21Å; L107-F111 PolarHBondContact O-N 3.15Å; V108-F111 PolarHBondContact O-N 3.16Å; F111-Y114 PolarHBondContact O-N 3.31Å; F111-I115 HydrophobicContact CD1-CD1 3.66Å; F111-I115 HydrophobicContact CD1-CG1 4.45Å; F111-I115 HydrophobicContact CE1-CD1 3.16Å; F111-I115 HydrophobicContact CE1-CG1 4.31Å; F111-I115 HydrophobicContact CE2-CD1 4.33Å; F111-I115 HydrophobicContact CG-CD1 4.45Å; F111-I115 HydrophobicContact CZ-CD1 3.56Å; F111-I115 WeakPolarHBondContact O-CB 3.36Å; F111-I115 WeakPolarHBondContact O-CG1 3.37Å; F111-I115 PolarHBondContact O-N 3.49Å; F111-L147 HydrophobicContact CE2-CD2 4.15Å; F111-L147 HydrophobicContact CE2-CG 4.34Å; F111-C148 WeakPolarHBondContact CD2-SG 3.26Å; F111-C148 VanDerWaalsContact CE2-SG 3.57Å; F111-L151 HydrophobicContact CE1-CD1 4.47Å; F111-L151 HydrophobicContact CE2-CD1 4.41Å; F111-L151 HydrophobicContact CZ-CD1 3.63Å |
| 112 | A | 95.8 | Very high | 93.8 | Very high | 21 Ų | 21 | 42.4 Ų | 42.4 | 17% | 0.174 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.9 | -46.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | M61 V64 V108 Y114 I115 F116 | M61-A112 HydrophobicContact SD-CB 3.96Å; V64-A112 HydrophobicContact CG2-CB 4.08Å; V108-A112 VanDerWaalsContact O-CB 3.23Å; V108-A112 WeakPolarHBondContact O-CB 3.41Å; V108-A112 PolarHBondContact O-N 3.29Å; A112-Y114 PolarHBondContact O-N 3.43Å; A112-I115 PolarHBondContact O-N 3.38Å; A112-F116 WeakPolarHBondContact O-CB 3.37Å; A112-F116 PolarHBondContact O-N 2.94Å |
| 113 | T | 95.1 | Very high | 93.7 | Very high | 43 Ų | 43 | 43.6 Ų | 43.6 | 26% | 0.264 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -61.8 | -45.7 | 177.8 | -52.3 | 0 | 0 | 0 | 0 | 111 | M61 A109 Y110 F116 L117 L128 | M61-T113 HydrophobicContact CE-CG2 4.34Å; M61-T113 WeakPolarHBondContact CE-OG1 3.31Å; A109-T113 VanDerWaalsContact O-CB 3.26Å; A109-T113 WeakPolarHBondContact O-CB 3.37Å; A109-T113 PolarHBondContact O-N 3.35Å; A109-T113 PolarHBondContact O-OG1 3.1Å; Y110-T113 PolarHBondContact O-N 3.5Å; T113-F116 PolarHBondContact O-N 3.32Å; T113-L117 HydrophobicContact CG2-CD1 4.26Å; T113-L117 HydrophobicContact CG2-CG 4.43Å; T113-L117 WeakPolarHBondContact O-CG 3.37Å; T113-L117 PolarHBondContact O-N 2.84Å; T113-L128 HydrophobicContact CG2-CD1 4.04Å |
| 114 | Y | 95.6 | Very high | 93.4 | Very high | 8 Ų | 8 | 40 Ų | 40 | 3% | 0.031 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60.6 | -51.2 | -179.9 | -158.4 | -58 | 0 | 0 | 0 | 111.1 | Y110 F111 A112 F116 L117 Q118 L128 S129 V145 C148 | Y110-Y114 HydrophobicContact CE1-CD2 4.35Å; Y110-Y114 HydrophobicContact CE2-CD2 4.33Å; Y110-Y114 AromaticContact CZ-CD2 3.83Å; Y110-Y114 WeakPolarHBondContact O-CB 3.46Å; Y110-Y114 PolarHBondContact O-N 3.33Å; F111-Y114 PolarHBondContact O-N 3.31Å; A112-Y114 PolarHBondContact O-N 3.43Å; Y114-F116 VanDerWaalsContact C-N 3.31Å; Y114-F116 PolarHBondContact O-N 2.98Å; Y114-L117 PolarHBondContact O-N 3.42Å; Y114-Q118 HydrophobicContact CD1-CB 4.48Å; Y114-Q118 WeakPolarHBondContact O-CB 3.48Å; Y114-Q118 PolarHBondContact O-N 3.44Å; Y114-L128 VanDerWaalsContact CA-CD1 3.49Å; Y114-L128 HydrophobicContact CD2-CB 3.64Å; Y114-L128 HydrophobicContact CD2-CD1 3.87Å; Y114-L128 HydrophobicContact CD2-CG 4.43Å; Y114-L128 HydrophobicContact CE2-CB 3.95Å; Y114-L128 HydrophobicContact CG-CD1 4.03Å; Y114-S129 PolarHBondContact OH-OG 2.66Å; Y114-V145 HydrophobicContact CE2-CG1 4.35Å; Y114-V145 HydrophobicContact CE2-CG2 4.4Å; Y114-C148 HydrophobicContact CD1-CB 3.44Å; Y114-C148 VanDerWaalsContact CD1-CB 3.44Å; Y114-C148 HydrophobicContact CD2-CB 4.09Å; Y114-C148 HydrophobicContact CE1-CB 4.01Å; Y114-C148 HydrophobicContact CG-CB 3.52Å |
| 115 | I | 96.9 | Very high | 93.3 | Very high | 22 Ų | 22 | 36.4 Ų | 36.4 | 11% | 0.113 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -61.7 | -42 | 179.3 | -72.4 | -175.5 | 0 | 0 | 0 | 110.7 | F111 A112 Q118 T119 C148 L151 F155 | F111-I115 HydrophobicContact CD1-CD1 3.66Å; F111-I115 HydrophobicContact CD1-CG1 4.45Å; F111-I115 HydrophobicContact CE1-CD1 3.16Å; F111-I115 HydrophobicContact CE1-CG1 4.31Å; F111-I115 HydrophobicContact CE2-CD1 4.33Å; F111-I115 HydrophobicContact CG-CD1 4.45Å; F111-I115 HydrophobicContact CZ-CD1 3.56Å; F111-I115 WeakPolarHBondContact O-CB 3.36Å; F111-I115 WeakPolarHBondContact O-CG1 3.37Å; F111-I115 PolarHBondContact O-N 3.49Å; A112-I115 PolarHBondContact O-N 3.38Å; I115-Q118 PolarHBondContact O-N 3.47Å; I115-T119 WeakPolarHBondContact O-CB 3.49Å; I115-T119 PolarHBondContact O-N 2.98Å; I115-T119 PolarHBondContact O-OG1 2.96Å; I115-C148 HydrophobicContact CG1-CB 4.48Å; I115-L151 HydrophobicContact CD1-CB 4Å; I115-L151 HydrophobicContact CD1-CD1 4.2Å; I115-F155 HydrophobicContact CG2-CD2 3.67Å; I115-F155 HydrophobicContact CG2-CE2 3.79Å |
| 116 | F | 96.5 | Very high | 93.3 | Very high | 33 Ų | 33 | 37.6 Ų | 37.6 | 15% | 0.145 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.2 | -53.3 | 177.7 | -179.6 | -90.6 | 0 | 0 | 0 | 111.3 | F54 M61 A112 T113 Y114 Q118 T119 F120 I122 | F54-F116 HydrophobicContact CE2-CE2 4.4Å; F54-F116 AromaticContact CE2-CZ 3.8Å; F54-F116 HydrophobicContact CE2-CZ 3.8Å; F54-F116 HydrophobicContact CZ-CZ 4.04Å; M61-F116 HydrophobicContact CG-CB 4.16Å; M61-F116 HydrophobicContact CG-CD2 3.65Å; M61-F116 HydrophobicContact CG-CE2 4.17Å; M61-F116 HydrophobicContact CG-CG 3.87Å; M61-F116 HydrophobicContact SD-CB 4.01Å; M61-F116 HydrophobicContact SD-CG 4.32Å; A112-F116 WeakPolarHBondContact O-CB 3.37Å; A112-F116 PolarHBondContact O-N 2.94Å; T113-F116 PolarHBondContact O-N 3.32Å; Y114-F116 VanDerWaalsContact C-N 3.31Å; Y114-F116 PolarHBondContact O-N 2.98Å; F116-Q118 VanDerWaalsContact C-N 3.27Å; F116-Q118 PolarHBondContact O-N 3.22Å; F116-T119 PolarHBondContact O-N 3.08Å; F116-F120 HydrophobicContact CD1-CD2 4.37Å; F116-F120 AromaticContact CD2-CD2 3.8Å; F116-F120 HydrophobicContact CD2-CD2 3.8Å; F116-F120 AromaticContact CD2-CE2 3.6Å; F116-F120 HydrophobicContact CD2-CE2 3.6Å; F116-F120 HydrophobicContact CE1-CD2 4.25Å; F116-F120 AromaticContact CE2-CD2 3.67Å; F116-F120 HydrophobicContact CE2-CD2 3.67Å; F116-F120 AromaticContact CE2-CE2 3.46Å; F116-F120 HydrophobicContact CE2-CE2 3.46Å; F116-F120 VanDerWaalsContact CE2-CE2 3.46Å; F116-F120 HydrophobicContact CG-CD2 4.15Å; F116-F120 HydrophobicContact CG-CE2 4.35Å; F116-F120 AromaticContact CZ-CD2 3.9Å; F116-F120 HydrophobicContact CZ-CD2 3.9Å; F116-F120 HydrophobicContact CZ-CE2 4.13Å; F116-F120 VanDerWaalsContact O-CD2 3.25Å; F116-F120 WeakPolarHBondContact O-CD2 3.35Å; F116-F120 PolarHBondContact O-N 3.44Å; F116-F120 VanDerWaalsContact O-N 3.17Å; F116-I122 HydrophobicContact CD1-CD1 4.21Å; F116-I122 HydrophobicContact CE1-CD1 3.65Å; F116-I122 HydrophobicContact CZ-CD1 4.46Å |
| 117 | L | 94.7 | Very high | 93.2 | Very high | 28 Ų | 28 | 42.6 Ų | 42.6 | 15% | 0.147 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -56.7 | -45 | 178.4 | -68.3 | 177.8 | 0 | 0 | 0 | 111.1 | T113 Y114 A121 I122 L128 | T113-L117 HydrophobicContact CG2-CD1 4.26Å; T113-L117 HydrophobicContact CG2-CG 4.43Å; T113-L117 WeakPolarHBondContact O-CG 3.37Å; T113-L117 PolarHBondContact O-N 2.84Å; Y114-L117 PolarHBondContact O-N 3.42Å; L117-A121 PolarHBondContact O-N 3.33Å; L117-A121 VanDerWaalsContact O-N 3.1Å; L117-I122 HydrophobicContact CB-CB 4.47Å; L117-I122 HydrophobicContact CD2-CB 3.7Å; L117-I122 HydrophobicContact CD2-CD1 4.35Å; L117-I122 HydrophobicContact CD2-CG2 3.54Å; L117-I122 PolarHBondContact O-N 2.87Å; L117-L128 HydrophobicContact CD1-CD1 3.86Å |
| 118 | Q | 95.7 | Very high | 93.1 | Very high | 9 Ų | 9 | 41.6 Ų | 41.6 | 4% | 0.042 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -75.1 | -32.1 | -175.1 | -165.6 | 59.5 | 4.2 | 0 | 0 | 113.6 | Y114 I115 F116 A121 A153 C156 | Y114-Q118 HydrophobicContact CD1-CB 4.48Å; Y114-Q118 WeakPolarHBondContact O-CB 3.48Å; Y114-Q118 PolarHBondContact O-N 3.44Å; I115-Q118 PolarHBondContact O-N 3.47Å; F116-Q118 VanDerWaalsContact C-N 3.27Å; F116-Q118 PolarHBondContact O-N 3.22Å; Q118-A121 PolarHBondContact O-N 3.48Å; Q118-A153 HydrophobicContact CG-CB 4.41Å; Q118-C156 WeakPolarHBondContact O-CB 3.21Å |
| 119 | T | 95.9 | Very high | 93.2 | Very high | 10 Ų | 10 | 38.2 Ų | 38.2 | 6% | 0.061 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -63.9 | -44.1 | 175.6 | -62.1 | 0 | 0 | 0 | 0 | 111.1 | I115 F116 G152 F155 C156 L159 | I115-T119 WeakPolarHBondContact O-CB 3.49Å; I115-T119 PolarHBondContact O-N 2.98Å; I115-T119 PolarHBondContact O-OG1 2.96Å; F116-T119 PolarHBondContact O-N 3.08Å; T119-G152 WeakPolarHBondContact CA-O 3.37Å; T119-F155 HydrophobicContact CG2-CB 3.64Å; T119-F155 WeakPolarHBondContact OG1-CB 3.49Å; T119-C156 WeakPolarHBondContact O-CA 3.19Å; T119-C156 VanDerWaalsContact O-CB 3.26Å; T119-C156 WeakPolarHBondContact O-CB 3.21Å; T119-C156 PolarHBondContact O-SG 2.91Å; T119-L159 HydrophobicContact CG2-CD1 3.68Å |
| 120 | F | 94.8 | Very high | 93.2 | Very high | 38 Ų | 38 | 40 Ų | 40 | 17% | 0.167 | 22% | 0.221 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | 11.9 | -177.4 | -61.4 | -65.7 | 0 | 0 | 0 | 113.7 | I53 F54 F116 I122 L159 | I53-F120 HydrophobicContact CG2-CZ 4.44Å; F54-F120 HydrophobicContact CB-CE1 4.02Å; F54-F120 HydrophobicContact CB-CZ 4.17Å; F54-F120 AromaticContact CD2-CD1 3.67Å; F54-F120 HydrophobicContact CD2-CD1 3.67Å; F54-F120 HydrophobicContact CD2-CD2 4.04Å; F54-F120 AromaticContact CD2-CE1 3.6Å; F54-F120 HydrophobicContact CD2-CE1 3.6Å; F54-F120 AromaticContact CD2-CE2 3.99Å; F54-F120 HydrophobicContact CD2-CE2 3.99Å; F54-F120 AromaticContact CD2-CG 3.9Å; F54-F120 HydrophobicContact CD2-CG 3.9Å; F54-F120 AromaticContact CD2-CZ 3.77Å; F54-F120 HydrophobicContact CD2-CZ 3.77Å; F54-F120 HydrophobicContact CE2-CD1 4.34Å; F54-F120 HydrophobicContact CE2-CD2 4.18Å; F54-F120 HydrophobicContact CE2-CE2 4.45Å; F54-F120 HydrophobicContact CE2-CG 4.14Å; F54-F120 HydrophobicContact CG-CE1 4.29Å; F54-F120 HydrophobicContact CG-CZ 4.36Å; F116-F120 HydrophobicContact CD1-CD2 4.37Å; F116-F120 AromaticContact CD2-CD2 3.8Å; F116-F120 HydrophobicContact CD2-CD2 3.8Å; F116-F120 AromaticContact CD2-CE2 3.6Å; F116-F120 HydrophobicContact CD2-CE2 3.6Å; F116-F120 HydrophobicContact CE1-CD2 4.25Å; F116-F120 AromaticContact CE2-CD2 3.67Å; F116-F120 HydrophobicContact CE2-CD2 3.67Å; F116-F120 AromaticContact CE2-CE2 3.46Å; F116-F120 HydrophobicContact CE2-CE2 3.46Å; F116-F120 VanDerWaalsContact CE2-CE2 3.46Å; F116-F120 HydrophobicContact CG-CD2 4.15Å; F116-F120 HydrophobicContact CG-CE2 4.35Å; F116-F120 AromaticContact CZ-CD2 3.9Å; F116-F120 HydrophobicContact CZ-CD2 3.9Å; F116-F120 HydrophobicContact CZ-CE2 4.13Å; F116-F120 VanDerWaalsContact O-CD2 3.25Å; F116-F120 WeakPolarHBondContact O-CD2 3.35Å; F116-F120 PolarHBondContact O-N 3.44Å; F116-F120 VanDerWaalsContact O-N 3.17Å; F120-I122 HydrophobicContact CB-CD1 3.87Å; F120-I122 HydrophobicContact CB-CG1 3.87Å; F120-I122 PolarHBondContact O-N 2.96Å; F120-L159 HydrophobicContact CD1-CD1 4.13Å; F120-L159 HydrophobicContact CE1-CD1 3.88Å |
| 121 | A | 91.8 | Very high | 93.1 | Very high | 37 Ų | 37 | 41.1 Ų | 41.1 | 31% | 0.306 | 23% | 0.228 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 54.7 | 31.5 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | L117 Q118 W206 | L117-A121 PolarHBondContact O-N 3.33Å; L117-A121 VanDerWaalsContact O-N 3.1Å; Q118-A121 PolarHBondContact O-N 3.48Å; A121-W206 HydrophobicContact CB-CB 3.56Å |
| 122 | I | 91.4 | Very high | 93.1 | Very high | 61 Ų | 61 | 38.1 Ų | 38.1 | 31% | 0.313 | 21% | 0.214 | S | C | . | . | trans | -81.2 | 128.2 | 179.7 | -56.5 | 171.7 | 0 | 0 | 0 | 108.5 | F116 L117 F120 | F116-I122 HydrophobicContact CD1-CD1 4.21Å; F116-I122 HydrophobicContact CE1-CD1 3.65Å; F116-I122 HydrophobicContact CZ-CD1 4.46Å; L117-I122 HydrophobicContact CB-CB 4.47Å; L117-I122 HydrophobicContact CD2-CB 3.7Å; L117-I122 HydrophobicContact CD2-CD1 4.35Å; L117-I122 HydrophobicContact CD2-CG2 3.54Å; L117-I122 PolarHBondContact O-N 2.87Å; F120-I122 HydrophobicContact CB-CD1 3.87Å; F120-I122 HydrophobicContact CB-CG1 3.87Å; F120-I122 PolarHBondContact O-N 2.96Å | ||
| 123 | P | 86.7 | Confident | 93 | Very high | 121 Ų | 121 | 37.3 Ų | 37.3 | 79% | 0.786 | 21% | 0.208 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.9 | 137.2 | 176.4 | 27.6 | -33.9 | 0 | 0 | 0 | 110.6 | ||
| 124 | G | 85 | Confident | 93 | Very high | 17 Ų | 17 | 35.9 Ų | 35.9 | 18% | 0.175 | 20% | 0.198 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 147.8 | -14.1 | 176 | 0 | 0 | 0 | 0 | 0 | 115.3 | I126 F127 | G124-I126 PolarHBondContact O-N 2.8Å; G124-I126 VanDerWaalsContact O-N 3.13Å; G124-F127 WeakPolarHBondContact O-CB 3.33Å; G124-F127 PolarHBondContact O-N 3.32Å |
| 125 | S | 89.9 | Confident | 92.8 | Very high | 20 Ų | 20 | 35.9 Ų | 35.9 | 14% | 0.14 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.1 | -26.2 | -179.6 | 52.6 | 0 | 0 | 0 | 0 | 114.2 | F127 L128 S129 | S125-F127 VanDerWaalsContact C-N 3.33Å; S125-F127 PolarHBondContact O-N 2.99Å; S125-L128 WeakPolarHBondContact O-CB 3.43Å; S125-L128 PolarHBondContact O-N 3.48Å; S125-S129 PolarHBondContact O-N 3.4Å; S125-S129 PolarHBondContact O-OG 2.63Å |
| 126 | I | 89.6 | Confident | 92.7 | Very high | 104 Ų | 104 | 35.2 Ų | 35.2 | 53% | 0.533 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -62.6 | -37.4 | 173.7 | -167.3 | 167.5 | 0 | 0 | 0 | 112.6 | G124 L128 S129 I130 | G124-I126 PolarHBondContact O-N 2.8Å; G124-I126 VanDerWaalsContact O-N 3.13Å; I126-L128 VanDerWaalsContact C-N 3.3Å; I126-L128 PolarHBondContact O-N 3.3Å; I126-S129 WeakPolarHBondContact O-CB 3.23Å; I126-S129 PolarHBondContact O-N 3.04Å; I126-I130 HydrophobicContact CG1-CD1 4.48Å; I126-I130 WeakPolarHBondContact O-CG1 3.38Å; I126-I130 PolarHBondContact O-N 3.28Å |
| 127 | F | 90.4 | Very high | 92.6 | Very high | 113 Ų | 113 | 37.9 Ų | 37.9 | 50% | 0.496 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -65.5 | -37.9 | 176.6 | -64.7 | -72.7 | 0 | 0 | 0 | 110.9 | G124 S125 I130 L131 | G124-F127 WeakPolarHBondContact O-CB 3.33Å; G124-F127 PolarHBondContact O-N 3.32Å; S125-F127 VanDerWaalsContact C-N 3.33Å; S125-F127 PolarHBondContact O-N 2.99Å; F127-I130 PolarHBondContact O-N 3.39Å; F127-L131 VanDerWaalsContact O-CB 3.26Å; F127-L131 WeakPolarHBondContact O-CB 3.5Å; F127-L131 PolarHBondContact O-N 3.32Å |
| 128 | L | 92.7 | Very high | 92.6 | Very high | 23 Ų | 23 | 39.2 Ų | 39.2 | 12% | 0.12 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -66.6 | -39.3 | 173.5 | -64.4 | 177.9 | 0 | 0 | 0 | 111.5 | Y110 T113 Y114 L117 S125 I126 I130 L131 S132 | Y110-L128 HydrophobicContact CD2-CB 4.48Å; Y110-L128 HydrophobicContact CD2-CD2 4.29Å; Y110-L128 HydrophobicContact CE2-CB 3.83Å; Y110-L128 HydrophobicContact CE2-CD2 4.45Å; Y110-L128 WeakPolarHBondContact CE2-O 3.47Å; T113-L128 HydrophobicContact CG2-CD1 4.04Å; Y114-L128 VanDerWaalsContact CA-CD1 3.49Å; Y114-L128 HydrophobicContact CD2-CB 3.64Å; Y114-L128 HydrophobicContact CD2-CD1 3.87Å; Y114-L128 HydrophobicContact CD2-CG 4.43Å; Y114-L128 HydrophobicContact CE2-CB 3.95Å; Y114-L128 HydrophobicContact CG-CD1 4.03Å; L117-L128 HydrophobicContact CD1-CD1 3.86Å; S125-L128 WeakPolarHBondContact O-CB 3.43Å; S125-L128 PolarHBondContact O-N 3.48Å; I126-L128 VanDerWaalsContact C-N 3.3Å; I126-L128 PolarHBondContact O-N 3.3Å; L128-I130 VanDerWaalsContact C-N 3.32Å; L128-I130 PolarHBondContact O-N 2.94Å; L128-L131 HydrophobicContact CD2-CD2 4.25Å; L128-L131 PolarHBondContact O-N 3.12Å; L128-S132 WeakPolarHBondContact O-CB 3.38Å; L128-S132 PolarHBondContact O-N 2.67Å; L128-S132 PolarHBondContact O-OG 3.13Å |
| 129 | S | 95 | Very high | 92.7 | Very high | 6 Ų | 6 | 43.4 Ų | 43.4 | 4% | 0.042 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.1 | -35.6 | 174.3 | -61.1 | 0 | 0 | 0 | 0 | 113.1 | Y114 S125 I126 S132 V145 I238 | Y114-S129 PolarHBondContact OH-OG 2.66Å; S125-S129 PolarHBondContact O-N 3.4Å; S125-S129 PolarHBondContact O-OG 2.63Å; I126-S129 WeakPolarHBondContact O-CB 3.23Å; I126-S129 PolarHBondContact O-N 3.04Å; S129-S132 PolarHBondContact O-OG 3.43Å; S129-V145 WeakPolarHBondContact OG-CG1 3.33Å; S129-I238 WeakPolarHBondContact O-CG1 3.44Å |
| 130 | I | 92.9 | Very high | 92.6 | Very high | 52 Ų | 52 | 45.7 Ų | 45.7 | 27% | 0.267 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -70.3 | -48.6 | 172.8 | -64.9 | 167.7 | 0 | 0 | 0 | 109.8 | I126 F127 L128 S132 G133 Y134 A237 G241 | I126-I130 HydrophobicContact CG1-CD1 4.48Å; I126-I130 WeakPolarHBondContact O-CG1 3.38Å; I126-I130 PolarHBondContact O-N 3.28Å; F127-I130 PolarHBondContact O-N 3.39Å; L128-I130 VanDerWaalsContact C-N 3.32Å; L128-I130 PolarHBondContact O-N 2.94Å; I130-S132 VanDerWaalsContact C-N 3.26Å; I130-S132 PolarHBondContact O-N 2.98Å; I130-G133 PolarHBondContact O-N 3.07Å; I130-G133 VanDerWaalsContact O-N 3.09Å; I130-Y134 PolarHBondContact O-N 3.37Å; I130-A237 WeakPolarHBondContact CA-O 3.23Å; I130-A237 HydrophobicContact CG1-CB 4.04Å; I130-G241 WeakPolarHBondContact O-CA 3.22Å |
| 131 | L | 92.8 | Very high | 92.7 | Very high | 34 Ų | 34 | 43.9 Ų | 43.9 | 18% | 0.178 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -57.6 | -38.6 | 179.7 | 178 | 63.3 | 0 | 0 | 0 | 112.1 | L95 F127 L128 G133 Y134 L135 | L95-L131 HydrophobicContact CD1-CD1 3.63Å; L95-L131 HydrophobicContact CD1-CD2 3.75Å; L95-L131 HydrophobicContact CD1-CG 4.32Å; F127-L131 VanDerWaalsContact O-CB 3.26Å; F127-L131 WeakPolarHBondContact O-CB 3.5Å; F127-L131 PolarHBondContact O-N 3.32Å; L128-L131 HydrophobicContact CD2-CD2 4.25Å; L128-L131 PolarHBondContact O-N 3.12Å; L131-G133 VanDerWaalsContact C-N 3.29Å; L131-G133 PolarHBondContact O-N 2.85Å; L131-Y134 WeakPolarHBondContact O-CA 3.22Å; L131-Y134 WeakPolarHBondContact O-CB 3.29Å; L131-Y134 PolarHBondContact O-N 2.86Å; L131-L135 HydrophobicContact CD1-CD1 3.83Å; L131-L135 HydrophobicContact CD1-CD2 4.43Å; L131-L135 HydrophobicContact CD1-CG 3.92Å; L131-L135 HydrophobicContact CD2-CD1 4.23Å; L131-L135 HydrophobicContact CG-CD1 3.73Å; L131-L135 HydrophobicContact CG-CG 4.19Å; L131-L135 WeakPolarHBondContact O-CG 3.43Å; L131-L135 PolarHBondContact O-N 3.15Å |
| 132 | S | 95.6 | Very high | 93 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.1 | -34.1 | 178.8 | 69.5 | 0 | 0 | 0 | 0 | 112.8 | Y110 L128 S129 I130 Y134 L135 Y136 V145 | Y110-S132 WeakPolarHBondContact OH-CB 3.42Å; L128-S132 WeakPolarHBondContact O-CB 3.38Å; L128-S132 PolarHBondContact O-N 2.67Å; L128-S132 PolarHBondContact O-OG 3.13Å; S129-S132 PolarHBondContact O-OG 3.43Å; I130-S132 VanDerWaalsContact C-N 3.26Å; I130-S132 PolarHBondContact O-N 2.98Å; S132-Y134 VanDerWaalsContact C-N 3.29Å; S132-L135 PolarHBondContact O-N 3.45Å; S132-Y136 WeakPolarHBondContact O-CB 3.47Å; S132-Y136 PolarHBondContact O-N 3.02Å; S132-V145 WeakPolarHBondContact OG-CG2 3.49Å |
| 133 | G | 94.6 | Very high | 93.3 | Very high | 5 Ų | 5 | 46.3 Ų | 46.3 | 5% | 0.052 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -70 | -24.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | I130 L131 T242 | I130-G133 PolarHBondContact O-N 3.07Å; I130-G133 VanDerWaalsContact O-N 3.09Å; L131-G133 VanDerWaalsContact C-N 3.29Å; L131-G133 PolarHBondContact O-N 2.85Å; G133-T242 WeakPolarHBondContact O-CA 3.31Å; G133-T242 PolarHBondContact O-N 3.17Å; G133-T242 PolarHBondContact O-OG1 3.32Å |
| 134 | Y | 93.6 | Very high | 93.8 | Very high | 12 Ų | 12 | 41.1 Ų | 41.1 | 5% | 0.047 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -74.7 | -41.3 | 170.8 | -169.4 | -73.1 | 0 | 0 | 0 | 111.4 | G92 T93 I130 L131 S132 L244 Y245 T248 | G92-Y134 VanDerWaalsContact C-CZ 3.48Å; G92-Y134 WeakPolarHBondContact O-CE1 3.47Å; T93-Y134 PolarHBondContact N-OH 2.79Å; I130-Y134 PolarHBondContact O-N 3.37Å; L131-Y134 WeakPolarHBondContact O-CA 3.22Å; L131-Y134 WeakPolarHBondContact O-CB 3.29Å; L131-Y134 PolarHBondContact O-N 2.86Å; S132-Y134 VanDerWaalsContact C-N 3.29Å; Y134-L244 HydrophobicContact CD2-CB 4.15Å; Y134-L244 HydrophobicContact CD2-CD2 4Å; Y134-L244 HydrophobicContact CD2-CG 3.91Å; Y134-L244 HydrophobicContact CE2-CD2 4.4Å; Y134-L244 HydrophobicContact CE2-CG 4.05Å; Y134-Y245 HydrophobicContact CD1-CD2 4.06Å; Y134-Y245 AromaticContact CE1-CD2 3.72Å; Y134-Y245 HydrophobicContact CE1-CD2 3.72Å; Y134-Y245 HydrophobicContact CE1-CE2 4.5Å; Y134-Y245 VanDerWaalsContact CE2-CA 3.42Å; Y134-Y245 HydrophobicContact CE2-CD2 4.3Å; Y134-Y245 HydrophobicContact CG-CD2 4.44Å; Y134-Y245 AromaticContact CZ-CD2 3.85Å; Y134-T248 WeakPolarHBondContact OH-CG2 3.5Å |
| 135 | L | 93.3 | Very high | 94.4 | Very high | 8 Ų | 8 | 40.3 Ų | 40.3 | 4% | 0.042 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -89.6 | -31.8 | -169.7 | -64.1 | 178.5 | 0 | 0 | 0 | 115 | L95 K99 V106 L131 S132 | L95-L135 HydrophobicContact CB-CD1 4.44Å; L95-L135 HydrophobicContact CB-CD2 3.91Å; K99-L135 VanDerWaalsContact CE-O 3.3Å; K99-L135 WeakPolarHBondContact CE-O 3.42Å; K99-L135 PolarHBondContact NZ-O 2.9Å; V106-L135 HydrophobicContact CG1-CD1 4.27Å; L131-L135 HydrophobicContact CD1-CD1 3.83Å; L131-L135 HydrophobicContact CD1-CD2 4.43Å; L131-L135 HydrophobicContact CD1-CG 3.92Å; L131-L135 HydrophobicContact CD2-CD1 4.23Å; L131-L135 HydrophobicContact CG-CD1 3.73Å; L131-L135 HydrophobicContact CG-CG 4.19Å; L131-L135 WeakPolarHBondContact O-CG 3.43Å; L131-L135 PolarHBondContact O-N 3.15Å; S132-L135 PolarHBondContact O-N 3.45Å |
| 136 | Y | 94.9 | Very high | 94.8 | Very high | 9 Ų | 9 | 39.6 Ų | 39.6 | 4% | 0.035 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -125.5 | 153.8 | -169 | -56.6 | -77 | 0 | 0 | 0 | 112.2 | K99 Y103 L107 S132 L140 L144 | K99-Y136 HydrophobicContact CG-CE1 4.29Å; Y103-Y136 HydrophobicContact CD2-CE1 4.47Å; Y103-Y136 HydrophobicContact CE2-CD1 4.04Å; Y103-Y136 AromaticContact CE2-CE1 3.63Å; Y103-Y136 HydrophobicContact CE2-CE1 3.63Å; Y103-Y136 AromaticContact CZ-CE1 3.84Å; L107-Y136 WeakPolarHBondContact CA-OH 3.47Å; L107-Y136 HydrophobicContact CD1-CE1 4.26Å; S132-Y136 WeakPolarHBondContact O-CB 3.47Å; S132-Y136 PolarHBondContact O-N 3.02Å; Y136-L140 HydrophobicContact CD1-CD2 3.99Å; Y136-L140 HydrophobicContact CG-CD2 4.42Å; Y136-L144 HydrophobicContact CD2-CD1 4.31Å; Y136-L144 HydrophobicContact CE2-CD1 4.47Å; Y136-L144 HydrophobicContact CG-CD1 4.46Å |
| 137 | P | 94.3 | Very high | 95.2 | Very high | 88 Ų | 88 | 36.6 Ų | 36.6 | 57% | 0.571 | 19% | 0.192 | S | C | * | . | trans | -57.3 | 145.1 | 170.9 | -23 | 33.4 | 0 | 0 | 0 | 111.8 | L140 A141 | P137-L140 PolarHBondContact O-N 3.46Å; P137-A141 PolarHBondContact O-N 2.91Å | ||
| 138 | F | 94.2 | Very high | 95.6 | Very high | 56 Ų | 56 | 31.2 Ų | 31.2 | 25% | 0.246 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -49.8 | -48.4 | -172.4 | -175.6 | -85.4 | 0 | 0 | 0 | 115 | L140 A141 L142 F235 I238 N239 | F138-L140 VanDerWaalsContact C-N 3.31Å; F138-L140 PolarHBondContact O-N 3.05Å; F138-A141 PolarHBondContact O-N 3Å; F138-L142 HydrophobicContact CE1-CB 4.42Å; F138-L142 HydrophobicContact CE1-CD2 4.09Å; F138-L142 HydrophobicContact CZ-CD2 4.48Å; F138-L142 WeakPolarHBondContact O-CB 2.98Å; F138-L142 PolarHBondContact O-N 3.34Å; F138-F235 AromaticContact CE1-CD2 3.93Å; F138-F235 HydrophobicContact CE1-CD2 3.93Å; F138-F235 AromaticContact CE1-CE2 3.82Å; F138-F235 HydrophobicContact CE1-CE2 3.82Å; F138-F235 HydrophobicContact CE2-CD2 4.21Å; F138-F235 HydrophobicContact CE2-CE2 4.26Å; F138-F235 HydrophobicContact CZ-CB 4.49Å; F138-F235 AromaticContact CZ-CD2 3.26Å; F138-F235 HydrophobicContact CZ-CD2 3.26Å; F138-F235 AromaticContact CZ-CE2 3.4Å; F138-F235 HydrophobicContact CZ-CE2 3.4Å; F138-F235 AromaticContact CZ-CG 3.9Å; F138-F235 HydrophobicContact CZ-CG 3.9Å; F138-F235 HydrophobicContact CZ-CZ 4.18Å; F138-I238 HydrophobicContact CD2-CB 4.37Å; F138-I238 HydrophobicContact CD2-CG2 3.45Å; F138-I238 VanDerWaalsContact CD2-CG2 3.45Å; F138-I238 HydrophobicContact CE2-CB 4Å; F138-I238 HydrophobicContact CE2-CG2 3.57Å; F138-I238 HydrophobicContact CG-CG2 4.38Å; F138-N239 WeakPolarHBondContact CE2-ND2 3.34Å |
| 139 | P | 96.4 | Very high | 95.8 | Very high | 98 Ų | 98 | 30.3 Ų | 30.3 | 64% | 0.636 | 16% | 0.164 | S | C | * | . | H | α-helix | trans | -62.9 | -38.1 | -179.6 | -22.3 | 34.6 | 0 | 0 | 0 | 112.9 | F143 | P139-F143 WeakPolarHBondContact O-CB 3.42Å; P139-F143 PolarHBondContact O-N 3.25Å |
| 140 | L | 95.7 | Very high | 95.9 | Very high | 58 Ų | 58 | 30 Ų | 30 | 30% | 0.304 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -70.3 | -45 | 177.9 | 178.7 | 61.2 | 0 | 0 | 0 | 110.9 | Y103 Y136 P137 F138 L142 F143 L144 | Y103-L140 WeakPolarHBondContact OH-CD2 3.34Å; Y136-L140 HydrophobicContact CD1-CD2 3.99Å; Y136-L140 HydrophobicContact CG-CD2 4.42Å; P137-L140 PolarHBondContact O-N 3.46Å; F138-L140 VanDerWaalsContact C-N 3.31Å; F138-L140 PolarHBondContact O-N 3.05Å; L140-L142 VanDerWaalsContact C-N 3.32Å; L140-L142 PolarHBondContact O-N 3.01Å; L140-F143 PolarHBondContact O-N 3.27Å; L140-L144 HydrophobicContact CD1-CD1 4.07Å; L140-L144 HydrophobicContact CD1-CG 4.02Å; L140-L144 HydrophobicContact CG-CD1 3.9Å; L140-L144 HydrophobicContact CG-CG 4.3Å; L140-L144 WeakPolarHBondContact O-CB 3.47Å; L140-L144 VanDerWaalsContact O-CG 3.25Å; L140-L144 WeakPolarHBondContact O-CG 3.37Å; L140-L144 PolarHBondContact O-N 3.34Å |
| 141 | A | 96.8 | Very high | 96.1 | Very high | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -57.8 | -45.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | P137 F138 L144 V145 I238 | P137-A141 PolarHBondContact O-N 2.91Å; F138-A141 PolarHBondContact O-N 3Å; A141-L144 PolarHBondContact O-N 3.47Å; A141-V145 WeakPolarHBondContact O-CB 3.45Å; A141-V145 VanDerWaalsContact O-CG2 3.27Å; A141-V145 WeakPolarHBondContact O-CG2 3.47Å; A141-V145 PolarHBondContact O-N 2.87Å; A141-I238 HydrophobicContact CB-CD1 4.18Å; A141-I238 HydrophobicContact CB-CG1 4.32Å; A141-I238 HydrophobicContact CB-CG2 3.8Å |
| 142 | L | 97.6 | Very high | 96.3 | Very high | 40 Ų | 40 | 28.4 Ų | 28.4 | 21% | 0.209 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -62.8 | -48.2 | 178.7 | -176.2 | 63.8 | 0 | 0 | 0 | 111.5 | F138 L140 L144 V145 C146 A231 I238 | F138-L142 HydrophobicContact CE1-CB 4.42Å; F138-L142 HydrophobicContact CE1-CD2 4.09Å; F138-L142 HydrophobicContact CZ-CD2 4.48Å; F138-L142 WeakPolarHBondContact O-CB 2.98Å; F138-L142 PolarHBondContact O-N 3.34Å; L140-L142 VanDerWaalsContact C-N 3.32Å; L140-L142 PolarHBondContact O-N 3.01Å; L142-L144 PolarHBondContact O-N 3.4Å; L142-V145 PolarHBondContact O-N 2.88Å; L142-C146 WeakPolarHBondContact O-CB 3.32Å; L142-C146 PolarHBondContact O-N 3.33Å; L142-C146 PolarHBondContact O-SG 2.8Å; L142-A231 HydrophobicContact CD1-CB 4.26Å; L142-I238 VanDerWaalsContact CA-CD1 3.43Å; L142-I238 HydrophobicContact CB-CD1 3.94Å; L142-I238 HydrophobicContact CD1-CD1 3.95Å |
| 143 | F | 97.9 | Very high | 96.3 | Very high | 108 Ų | 108 | 28.4 Ų | 28.4 | 47% | 0.474 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -58.8 | -46.7 | 176.7 | 177.5 | -101.6 | 0 | 0 | 0 | 112 | P139 L140 C146 L147 F227 | P139-F143 WeakPolarHBondContact O-CB 3.42Å; P139-F143 PolarHBondContact O-N 3.25Å; L140-F143 PolarHBondContact O-N 3.27Å; F143-C146 PolarHBondContact O-N 2.98Å; F143-L147 HydrophobicContact CE1-CD2 3.91Å; F143-L147 HydrophobicContact CZ-CD2 4.09Å; F143-L147 VanDerWaalsContact O-CB 3.24Å; F143-L147 WeakPolarHBondContact O-CB 3.35Å; F143-L147 PolarHBondContact O-N 3.26Å; F143-F227 HydrophobicContact CD2-CZ 4.03Å; F143-F227 HydrophobicContact CE2-CE2 4.41Å; F143-F227 HydrophobicContact CE2-CZ 4.06Å |
| 144 | L | 97.4 | Very high | 96.5 | Very high | 13 Ų | 13 | 28.6 Ų | 28.6 | 7% | 0.068 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.4 | -46.2 | 179.1 | -75 | 173.6 | 0 | 0 | 0 | 111.9 | L107 Y110 Y136 L140 A141 L142 L147 C148 | L107-L144 HydrophobicContact CD1-CD1 3.69Å; L107-L144 HydrophobicContact CD1-CD2 4.06Å; Y110-L144 HydrophobicContact CE1-CB 4.22Å; Y136-L144 HydrophobicContact CD2-CD1 4.31Å; Y136-L144 HydrophobicContact CE2-CD1 4.47Å; Y136-L144 HydrophobicContact CG-CD1 4.46Å; L140-L144 HydrophobicContact CD1-CD1 4.07Å; L140-L144 HydrophobicContact CD1-CG 4.02Å; L140-L144 HydrophobicContact CG-CD1 3.9Å; L140-L144 HydrophobicContact CG-CG 4.3Å; L140-L144 WeakPolarHBondContact O-CB 3.47Å; L140-L144 VanDerWaalsContact O-CG 3.25Å; L140-L144 WeakPolarHBondContact O-CG 3.37Å; L140-L144 PolarHBondContact O-N 3.34Å; A141-L144 PolarHBondContact O-N 3.47Å; L142-L144 PolarHBondContact O-N 3.4Å; L144-L147 PolarHBondContact O-N 3.13Å; L144-C148 WeakPolarHBondContact O-CB 3.32Å; L144-C148 PolarHBondContact O-N 3.17Å; L144-C148 PolarHBondContact O-SG 3.3Å |
| 145 | V | 97.8 | Very high | 96.6 | Very high | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.1 | -47.9 | 178.5 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | Y110 Y114 S129 S132 A141 L142 L147 C148 S149 S234 I238 | Y110-V145 VanDerWaalsContact OH-CG2 3.29Å; Y110-V145 WeakPolarHBondContact OH-CG2 3.49Å; Y114-V145 HydrophobicContact CE2-CG1 4.35Å; Y114-V145 HydrophobicContact CE2-CG2 4.4Å; S129-V145 WeakPolarHBondContact OG-CG1 3.33Å; S132-V145 WeakPolarHBondContact OG-CG2 3.49Å; A141-V145 WeakPolarHBondContact O-CB 3.45Å; A141-V145 VanDerWaalsContact O-CG2 3.27Å; A141-V145 WeakPolarHBondContact O-CG2 3.47Å; A141-V145 PolarHBondContact O-N 2.87Å; L142-V145 PolarHBondContact O-N 2.88Å; V145-L147 VanDerWaalsContact C-N 3.34Å; V145-L147 PolarHBondContact O-N 3.32Å; V145-C148 PolarHBondContact O-N 2.9Å; V145-S149 WeakPolarHBondContact O-CB 3.3Å; V145-S149 PolarHBondContact O-N 3.41Å; V145-S234 WeakPolarHBondContact CG1-OG 3.39Å; V145-I238 HydrophobicContact CB-CD1 4.48Å; V145-I238 HydrophobicContact CG2-CD1 4.15Å; V145-I238 HydrophobicContact CG2-CG1 4.4Å |
| 146 | C | 97.8 | Very high | 96.8 | Very high | 4 Ų | 4 | 32.2 Ų | 32.2 | 3% | 0.027 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.6 | -42.8 | 178.3 | -67.8 | 0 | 0 | 0 | 0 | 112 | L142 F143 G150 F227 V230 | L142-C146 WeakPolarHBondContact O-CB 3.32Å; L142-C146 PolarHBondContact O-N 3.33Å; L142-C146 PolarHBondContact O-SG 2.8Å; F143-C146 PolarHBondContact O-N 2.98Å; C146-G150 PolarHBondContact O-N 3.31Å; C146-F227 VanDerWaalsContact C-CD2 3.49Å; C146-F227 HydrophobicContact CB-CD1 4.47Å; C146-F227 HydrophobicContact CB-CD2 3.76Å; C146-F227 HydrophobicContact CB-CE1 4.38Å; C146-F227 HydrophobicContact CB-CE2 3.67Å; C146-F227 HydrophobicContact CB-CG 4.17Å; C146-F227 HydrophobicContact CB-CZ 3.99Å; C146-F227 WeakPolarHBondContact CB-O 3.49Å; C146-F227 WeakPolarHBondContact O-CD2 3.26Å; C146-F227 PolarHBondContact SG-O 3.25Å; C146-F227 VanDerWaalsContact SG-O 3.4Å; C146-V230 HydrophobicContact CB-CG2 4.3Å |
| 147 | L | 98.3 | Very high | 96.8 | Very high | 41 Ų | 41 | 32.8 Ų | 32.8 | 22% | 0.215 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.4 | -49.9 | 178.5 | -176.5 | 62.1 | 0 | 0 | 0 | 111.9 | F111 F143 L144 V145 S149 G150 L151 F223 F227 | F111-L147 HydrophobicContact CE2-CD2 4.15Å; F111-L147 HydrophobicContact CE2-CG 4.34Å; F143-L147 HydrophobicContact CE1-CD2 3.91Å; F143-L147 HydrophobicContact CZ-CD2 4.09Å; F143-L147 VanDerWaalsContact O-CB 3.24Å; F143-L147 WeakPolarHBondContact O-CB 3.35Å; F143-L147 PolarHBondContact O-N 3.26Å; L144-L147 PolarHBondContact O-N 3.13Å; V145-L147 VanDerWaalsContact C-N 3.34Å; V145-L147 PolarHBondContact O-N 3.32Å; L147-S149 VanDerWaalsContact C-N 3.34Å; L147-S149 PolarHBondContact O-N 3.2Å; L147-G150 PolarHBondContact O-N 2.65Å; L147-L151 HydrophobicContact CD1-CD1 3.94Å; L147-L151 HydrophobicContact CD1-CG 4.2Å; L147-L151 HydrophobicContact CG-CD1 3.98Å; L147-L151 WeakPolarHBondContact O-CB 3.26Å; L147-L151 WeakPolarHBondContact O-CG 3.35Å; L147-L151 PolarHBondContact O-N 2.87Å; L147-F223 HydrophobicContact CD1-CZ 4.36Å; L147-F227 HydrophobicContact CB-CE2 4.1Å |
| 148 | C | 97.6 | Very high | 96.8 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -61.2 | -43.8 | 178.7 | -66.1 | 0 | 0 | 0 | 0 | 111.4 | F111 Y114 I115 L144 V145 G152 | F111-C148 WeakPolarHBondContact CD2-SG 3.26Å; F111-C148 VanDerWaalsContact CE2-SG 3.57Å; Y114-C148 HydrophobicContact CD1-CB 3.44Å; Y114-C148 VanDerWaalsContact CD1-CB 3.44Å; Y114-C148 HydrophobicContact CD2-CB 4.09Å; Y114-C148 HydrophobicContact CE1-CB 4.01Å; Y114-C148 HydrophobicContact CG-CB 3.52Å; I115-C148 HydrophobicContact CG1-CB 4.48Å; L144-C148 WeakPolarHBondContact O-CB 3.32Å; L144-C148 PolarHBondContact O-N 3.17Å; L144-C148 PolarHBondContact O-SG 3.3Å; V145-C148 PolarHBondContact O-N 2.9Å; C148-G152 PolarHBondContact O-N 2.91Å |
| 149 | S | 96.5 | Very high | 96.7 | Very high | 4 Ų | 4 | 31 Ų | 31 | 3% | 0.028 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -64.5 | -44.6 | 178 | -179.3 | 0 | 0 | 0 | 0 | 111.4 | V145 L147 A153 | V145-S149 WeakPolarHBondContact O-CB 3.3Å; V145-S149 PolarHBondContact O-N 3.41Å; L147-S149 VanDerWaalsContact C-N 3.34Å; L147-S149 PolarHBondContact O-N 3.2Å; S149-A153 WeakPolarHBondContact O-CB 3.39Å; S149-A153 PolarHBondContact O-N 3.31Å |
| 150 | G | 97.3 | Very high | 96.5 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -59.9 | -50.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | C146 L147 S154 | C146-G150 PolarHBondContact O-N 3.31Å; L147-G150 PolarHBondContact O-N 2.65Å; G150-S154 WeakPolarHBondContact O-CB 3.32Å; G150-S154 PolarHBondContact O-N 2.92Å; G150-S154 PolarHBondContact O-OG 3.43Å |
| 151 | L | 97.9 | Very high | 96.2 | Very high | 52 Ų | 52 | 29.4 Ų | 29.4 | 27% | 0.272 | 14% | 0.139 | S | C | . | . | H | α-helix | trans | -66.4 | -50.2 | -179 | -70.5 | 173.4 | 0 | 0 | 0 | 112.3 | F111 I115 L147 A153 S154 F155 F223 | F111-L151 HydrophobicContact CE1-CD1 4.47Å; F111-L151 HydrophobicContact CE2-CD1 4.41Å; F111-L151 HydrophobicContact CZ-CD1 3.63Å; I115-L151 HydrophobicContact CD1-CB 4Å; I115-L151 HydrophobicContact CD1-CD1 4.2Å; L147-L151 HydrophobicContact CD1-CD1 3.94Å; L147-L151 HydrophobicContact CD1-CG 4.2Å; L147-L151 HydrophobicContact CG-CD1 3.98Å; L147-L151 WeakPolarHBondContact O-CB 3.26Å; L147-L151 WeakPolarHBondContact O-CG 3.35Å; L147-L151 PolarHBondContact O-N 2.87Å; L151-A153 VanDerWaalsContact C-N 3.34Å; L151-A153 PolarHBondContact O-N 3.36Å; L151-S154 WeakPolarHBondContact O-CB 3.44Å; L151-S154 PolarHBondContact O-N 3.43Å; L151-S154 VanDerWaalsContact O-N 3.15Å; L151-F155 WeakPolarHBondContact O-CD2 3.32Å; L151-F155 PolarHBondContact O-N 3.06Å; L151-F223 HydrophobicContact CD2-CE2 3.92Å; L151-F223 HydrophobicContact CG-CE2 4.09Å |
| 152 | G | 96.9 | Very high | 95.7 | Very high | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64.2 | -38.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | T119 C148 S154 F155 C156 | T119-G152 WeakPolarHBondContact CA-O 3.37Å; C148-G152 PolarHBondContact O-N 2.91Å; G152-S154 VanDerWaalsContact C-N 3.32Å; G152-S154 PolarHBondContact O-N 3.4Å; G152-F155 PolarHBondContact O-N 2.87Å; G152-C156 PolarHBondContact O-N 3.49Å |
| 153 | A | 96.6 | Very high | 95 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.2 | -37.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q118 S149 L151 C156 Y157 N209 F222 T226 | Q118-A153 HydrophobicContact CG-CB 4.41Å; S149-A153 WeakPolarHBondContact O-CB 3.39Å; S149-A153 PolarHBondContact O-N 3.31Å; L151-A153 VanDerWaalsContact C-N 3.34Å; L151-A153 PolarHBondContact O-N 3.36Å; A153-C156 WeakPolarHBondContact O-CB 3.49Å; A153-C156 PolarHBondContact O-N 3.19Å; A153-Y157 WeakPolarHBondContact O-CB 3.24Å; A153-Y157 PolarHBondContact O-N 3.46Å; A153-N209 WeakPolarHBondContact CB-OD1 3.43Å; A153-F222 HydrophobicContact CB-CE1 3.84Å; A153-F222 HydrophobicContact CB-CZ 3.95Å; A153-F222 WeakPolarHBondContact O-CE1 3.3Å; A153-T226 HydrophobicContact CB-CG2 4.03Å |
| 154 | S | 97.6 | Very high | 94 | Very high | 10 Ų | 10 | 28.8 Ų | 28.8 | 7% | 0.07 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.4 | -38.7 | 174.3 | -73.2 | 0 | 0 | 0 | 0 | 112.2 | G150 L151 G152 Y157 M158 | G150-S154 WeakPolarHBondContact O-CB 3.32Å; G150-S154 PolarHBondContact O-N 2.92Å; G150-S154 PolarHBondContact O-OG 3.43Å; L151-S154 WeakPolarHBondContact O-CB 3.44Å; L151-S154 PolarHBondContact O-N 3.43Å; L151-S154 VanDerWaalsContact O-N 3.15Å; G152-S154 VanDerWaalsContact C-N 3.32Å; G152-S154 PolarHBondContact O-N 3.4Å; S154-Y157 WeakPolarHBondContact O-CB 3.22Å; S154-Y157 PolarHBondContact O-N 3.08Å; S154-M158 VanDerWaalsContact O-CG 3.27Å; S154-M158 WeakPolarHBondContact O-CG 3.24Å; S154-M158 PolarHBondContact O-N 3.46Å |
| 155 | F | 96.7 | Very high | 93 | Very high | 89 Ų | 89 | 30.9 Ų | 30.9 | 39% | 0.39 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -67.3 | -41.1 | 173.1 | -64.1 | -39.4 | 0 | 0 | 0 | 112.1 | I115 T119 L151 G152 Y157 M158 L159 | I115-F155 HydrophobicContact CG2-CD2 3.67Å; I115-F155 HydrophobicContact CG2-CE2 3.79Å; T119-F155 HydrophobicContact CG2-CB 3.64Å; T119-F155 WeakPolarHBondContact OG1-CB 3.49Å; L151-F155 WeakPolarHBondContact O-CD2 3.32Å; L151-F155 PolarHBondContact O-N 3.06Å; G152-F155 PolarHBondContact O-N 2.87Å; F155-Y157 VanDerWaalsContact C-N 3.31Å; F155-Y157 PolarHBondContact O-N 2.88Å; F155-M158 HydrophobicContact CD1-SD 4.18Å; F155-M158 PolarHBondContact O-N 3.46Å; F155-M158 VanDerWaalsContact O-N 3.14Å; F155-L159 WeakPolarHBondContact O-CG 3.43Å; F155-L159 PolarHBondContact O-N 3.48Å |
| 156 | C | 95.9 | Very high | 92 | Very high | 7 Ų | 7 | 34.2 Ų | 34.2 | 5% | 0.047 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.2 | -43 | 171.8 | -171.1 | 0 | 0 | 0 | 0 | 111.7 | Q118 T119 G152 A153 M158 L159 S160 N209 | Q118-C156 WeakPolarHBondContact O-CB 3.21Å; T119-C156 WeakPolarHBondContact O-CA 3.19Å; T119-C156 VanDerWaalsContact O-CB 3.26Å; T119-C156 WeakPolarHBondContact O-CB 3.21Å; T119-C156 PolarHBondContact O-SG 2.91Å; G152-C156 PolarHBondContact O-N 3.49Å; A153-C156 WeakPolarHBondContact O-CB 3.49Å; A153-C156 PolarHBondContact O-N 3.19Å; C156-M158 VanDerWaalsContact C-N 3.35Å; C156-M158 PolarHBondContact O-N 2.87Å; C156-L159 PolarHBondContact O-N 2.86Å; C156-S160 WeakPolarHBondContact O-CB 3.37Å; C156-S160 PolarHBondContact O-N 3.44Å; C156-N209 HydrophobicContact CB-CB 3.92Å; C156-N209 VanDerWaalsContact SG-CB 3.59Å |
| 157 | Y | 95.4 | Very high | 90.8 | Very high | 21 Ų | 21 | 36.9 Ų | 36.9 | 8% | 0.082 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -57 | -47.5 | 172.3 | 172.7 | -68 | 0 | 0 | 0 | 110.7 | A153 S154 F155 S160 Y161 P213 V217 L219 F222 | A153-Y157 WeakPolarHBondContact O-CB 3.24Å; A153-Y157 PolarHBondContact O-N 3.46Å; S154-Y157 WeakPolarHBondContact O-CB 3.22Å; S154-Y157 PolarHBondContact O-N 3.08Å; F155-Y157 VanDerWaalsContact C-N 3.31Å; F155-Y157 PolarHBondContact O-N 2.88Å; Y157-S160 CarbonylContact O-C 3.47Å; Y157-S160 PolarHBondContact O-N 2.89Å; Y157-Y161 WeakPolarHBondContact O-CB 3.43Å; Y157-Y161 PolarHBondContact O-N 3.02Å; Y157-P213 HydrophobicContact CD1-CB 4.2Å; Y157-P213 HydrophobicContact CD1-CG 4.48Å; Y157-P213 HydrophobicContact CD2-CB 4.16Å; Y157-P213 VanDerWaalsContact CD2-CD 3.45Å; Y157-P213 HydrophobicContact CD2-CG 4.1Å; Y157-P213 HydrophobicContact CE1-CB 3.78Å; Y157-P213 HydrophobicContact CE2-CB 3.77Å; Y157-P213 HydrophobicContact CE2-CG 4.17Å; Y157-P213 HydrophobicContact CG-CB 4.34Å; Y157-P213 HydrophobicContact CG-CG 4.23Å; Y157-V217 WeakPolarHBondContact CE2-O 3.39Å; Y157-V217 PolarHBondContact OH-O 2.9Å; Y157-L219 HydrophobicContact CD1-CD1 3.72Å; Y157-L219 HydrophobicContact CE1-CB 4.41Å; Y157-L219 HydrophobicContact CE1-CD1 4.09Å; Y157-L219 HydrophobicContact CG-CD1 4.03Å; Y157-F222 HydrophobicContact CD2-CB 4.42Å; Y157-F222 HydrophobicContact CD2-CD1 4Å; Y157-F222 HydrophobicContact CD2-CD2 4.11Å; Y157-F222 HydrophobicContact CD2-CE1 4.27Å; Y157-F222 HydrophobicContact CD2-CE2 4.33Å; Y157-F222 AromaticContact CD2-CG 3.91Å; Y157-F222 HydrophobicContact CD2-CG 3.91Å; Y157-F222 HydrophobicContact CD2-CZ 4.41Å; Y157-F222 HydrophobicContact CE2-CB 4.46Å; Y157-F222 HydrophobicContact CE2-CG 4.4Å; Y157-F222 HydrophobicContact CG-CD1 4.41Å; Y157-F222 HydrophobicContact CG-CE1 4.49Å |
| 158 | M | 94.1 | Very high | 89.8 | Confident | 85 Ų | 85 | 36 Ų | 36 | 42% | 0.419 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -66 | -40.9 | -178.9 | -72.2 | 169.7 | 67.9 | 0 | 0 | 111.6 | S154 F155 C156 S160 Y161 L162 L219 | S154-M158 VanDerWaalsContact O-CG 3.27Å; S154-M158 WeakPolarHBondContact O-CG 3.24Å; S154-M158 PolarHBondContact O-N 3.46Å; F155-M158 HydrophobicContact CD1-SD 4.18Å; F155-M158 PolarHBondContact O-N 3.46Å; F155-M158 VanDerWaalsContact O-N 3.14Å; C156-M158 VanDerWaalsContact C-N 3.35Å; C156-M158 PolarHBondContact O-N 2.87Å; M158-S160 VanDerWaalsContact C-N 3.33Å; M158-S160 PolarHBondContact O-N 3.33Å; M158-Y161 PolarHBondContact O-N 3.26Å; M158-L162 WeakPolarHBondContact O-CB 3.42Å; M158-L162 VanDerWaalsContact O-CG 3.3Å; M158-L162 WeakPolarHBondContact O-CG 3.47Å; M158-L162 PolarHBondContact O-N 3.43Å; M158-L219 HydrophobicContact SD-CD2 4.46Å |
| 159 | L | 92.7 | Very high | 88.6 | Confident | 21 Ų | 21 | 40 Ų | 40 | 11% | 0.11 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -60.2 | -44.5 | 172.7 | -71.5 | -179.4 | 0 | 0 | 0 | 111.3 | L50 I53 T119 F120 F155 C156 Y161 L162 V163 | L50-L159 HydrophobicContact CD1-CD1 4.13Å; L50-L159 HydrophobicContact CD1-CD2 3.95Å; L50-L159 HydrophobicContact CD1-CG 4.47Å; I53-L159 HydrophobicContact CB-CD2 4.46Å; I53-L159 HydrophobicContact CD1-CD2 3.6Å; I53-L159 HydrophobicContact CG2-CD2 4.08Å; T119-L159 HydrophobicContact CG2-CD1 3.68Å; F120-L159 HydrophobicContact CD1-CD1 4.13Å; F120-L159 HydrophobicContact CE1-CD1 3.88Å; F155-L159 WeakPolarHBondContact O-CG 3.43Å; F155-L159 PolarHBondContact O-N 3.48Å; C156-L159 PolarHBondContact O-N 2.86Å; L159-Y161 VanDerWaalsContact C-N 3.35Å; L159-L162 PolarHBondContact O-N 2.99Å; L159-V163 WeakPolarHBondContact O-CB 3.45Å; L159-V163 PolarHBondContact O-N 3.3Å |
| 160 | S | 91.6 | Very high | 87.6 | Confident | 7 Ų | 7 | 45.1 Ų | 45.1 | 5% | 0.049 | 22% | 0.223 | C | C | . | . | I | π-helix | trans | -64 | -39.6 | 174.6 | -176.7 | 0 | 0 | 0 | 0 | 112 | C156 Y157 M158 G164 R165 I210 | C156-S160 WeakPolarHBondContact O-CB 3.37Å; C156-S160 PolarHBondContact O-N 3.44Å; Y157-S160 CarbonylContact O-C 3.47Å; Y157-S160 PolarHBondContact O-N 2.89Å; M158-S160 VanDerWaalsContact C-N 3.33Å; M158-S160 PolarHBondContact O-N 3.33Å; S160-G164 CarbonylContact O-C 3.27Å; S160-G164 VanDerWaalsContact O-C 3.29Å; S160-G164 WeakPolarHBondContact O-CA 3.08Å; S160-G164 PolarHBondContact O-N 3.5Å; S160-R165 PolarHBondContact O-N 3.19Å; S160-I210 WeakPolarHBondContact OG-CA 3.46Å; S160-I210 WeakPolarHBondContact OG-CG2 3.47Å; S160-I210 PolarHBondContact OG-O 2.77Å |
| 161 | Y | 89.6 | Confident | 86.6 | Confident | 116 Ų | 116 | 52.9 Ų | 52.9 | 46% | 0.455 | 25% | 0.254 | S | S | . | . | I | π-helix | trans | -62.8 | -45.2 | 176.9 | -175.8 | -91.6 | 0 | 0 | 0 | 112.1 | Y157 M158 L159 R165 P213 | Y157-Y161 WeakPolarHBondContact O-CB 3.43Å; Y157-Y161 PolarHBondContact O-N 3.02Å; M158-Y161 PolarHBondContact O-N 3.26Å; L159-Y161 VanDerWaalsContact C-N 3.35Å; Y161-R165 WeakPolarHBondContact O-CB 3.3Å; Y161-P213 HydrophobicContact CD2-CB 3.86Å; Y161-P213 HydrophobicContact CG-CB 4.36Å |
| 162 | L | 85.6 | Confident | 85.8 | Confident | 99 Ų | 99 | 53.5 Ų | 53.5 | 52% | 0.518 | 26% | 0.257 | S | S | . | . | I | π-helix | trans | -73.5 | -43.2 | -177.2 | -69.8 | 170.7 | 0 | 0 | 0 | 113.1 | M158 L159 | M158-L162 WeakPolarHBondContact O-CB 3.42Å; M158-L162 VanDerWaalsContact O-CG 3.3Å; M158-L162 WeakPolarHBondContact O-CG 3.47Å; M158-L162 PolarHBondContact O-N 3.43Å; L159-L162 PolarHBondContact O-N 2.99Å |
| 163 | V | 83.1 | Confident | 85 | Confident | 17 Ų | 17 | 56 Ų | 56 | 10% | 0.103 | 27% | 0.273 | C | S | . | . | I | π-helix | trans | -115.3 | -40.3 | -169.1 | 179.3 | 0 | 0 | 0 | 0 | 111.8 | S46 L50 L159 | S46-V163 WeakPolarHBondContact O-CG2 3.44Å; L50-V163 HydrophobicContact CB-CG2 4.36Å; L50-V163 HydrophobicContact CD2-CG1 4.43Å; L159-V163 WeakPolarHBondContact O-CB 3.45Å; L159-V163 PolarHBondContact O-N 3.3Å |
| 164 | G | 77.1 | Confident | 84.2 | Confident | 18 Ų | 18 | 62 Ų | 62 | 19% | 0.186 | 30% | 0.3 | C | S | . | . | I | π-helix | trans | -74.1 | -37.2 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | S160 V167 V168 | S160-G164 CarbonylContact O-C 3.27Å; S160-G164 VanDerWaalsContact O-C 3.29Å; S160-G164 WeakPolarHBondContact O-CA 3.08Å; S160-G164 PolarHBondContact O-N 3.5Å; G164-V167 PolarHBondContact O-N 3.35Å; G164-V167 VanDerWaalsContact O-N 3.17Å; G164-V168 VanDerWaalsContact O-CG2 3.29Å; G164-V168 WeakPolarHBondContact O-CG2 3.4Å; G164-V168 PolarHBondContact O-N 3.39Å |
| 165 | R | 77.9 | Confident | 83.5 | Confident | 57 Ų | 57 | 68.8 Ų | 68.8 | 22% | 0.215 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -60.1 | -50.3 | -172.7 | -168.3 | 179.5 | -178.6 | -179.3 | 9.2 | 112.3 | S160 Y161 V167 V168 Y169 N216 | S160-R165 PolarHBondContact O-N 3.19Å; Y161-R165 WeakPolarHBondContact O-CB 3.3Å; R165-V167 VanDerWaalsContact C-N 3.28Å; R165-V167 PolarHBondContact O-N 2.98Å; R165-V168 PolarHBondContact O-N 2.84Å; R165-Y169 HydrophobicContact CG-CD2 3.64Å; R165-Y169 HydrophobicContact CG-CE2 3.59Å; R165-Y169 VanDerWaalsContact O-CD2 3.29Å; R165-Y169 WeakPolarHBondContact O-CD2 3.41Å; R165-Y169 PolarHBondContact O-N 2.91Å; R165-N216 PolarHBondContact NH2-OD1 3.41Å |
| 166 | P | 74.9 | Confident | 82.7 | Confident | 70 Ų | 70 | 64.7 Ų | 64.7 | 46% | 0.455 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -59.2 | -37.9 | 176.6 | -23 | 34.4 | 0 | 0 | 0 | 113.1 | K170 | P166-K170 WeakPolarHBondContact O-CB 3.39Å; P166-K170 PolarHBondContact O-N 2.89Å; P166-K170 VanDerWaalsContact O-N 3.12Å |
| 167 | V | 74.4 | Confident | 82 | Confident | 61 Ų | 61 | 69.5 Ų | 69.5 | 37% | 0.37 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -67.8 | -47.5 | 178.7 | 179.7 | 0 | 0 | 0 | 0 | 110.6 | G164 R165 Y169 K170 Y171 | G164-V167 PolarHBondContact O-N 3.35Å; G164-V167 VanDerWaalsContact O-N 3.17Å; R165-V167 VanDerWaalsContact C-N 3.28Å; R165-V167 PolarHBondContact O-N 2.98Å; V167-Y169 PolarHBondContact O-N 3.3Å; V167-K170 PolarHBondContact O-N 3.35Å; V167-K170 VanDerWaalsContact O-N 3.15Å; V167-Y171 HydrophobicContact CG1-CD2 3.82Å; V167-Y171 HydrophobicContact CG1-CE2 4.18Å; V167-Y171 VanDerWaalsContact O-CD2 3.28Å; V167-Y171 WeakPolarHBondContact O-CD2 3.36Å; V167-Y171 PolarHBondContact O-N 3.37Å |
| 168 | V | 77 | Confident | 81.4 | Confident | 21 Ų | 21 | 73.8 Ų | 73.8 | 13% | 0.127 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.9 | -42.5 | 179.7 | 177.1 | 0 | 0 | 0 | 0 | 111 | G164 R165 K170 Y171 L172 A176 V214 | G164-V168 VanDerWaalsContact O-CG2 3.29Å; G164-V168 WeakPolarHBondContact O-CG2 3.4Å; G164-V168 PolarHBondContact O-N 3.39Å; R165-V168 PolarHBondContact O-N 2.84Å; V168-K170 PolarHBondContact O-N 2.99Å; V168-Y171 PolarHBondContact O-N 3.37Å; V168-L172 HydrophobicContact CG1-CB 4.04Å; V168-L172 HydrophobicContact CG1-CD1 4.35Å; V168-L172 CarbonylContact O-C 3.29Å; V168-L172 VanDerWaalsContact O-CA 3.3Å; V168-L172 WeakPolarHBondContact O-CA 3.44Å; V168-L172 WeakPolarHBondContact O-CB 3.23Å; V168-L172 PolarHBondContact O-N 2.99Å; V168-A176 HydrophobicContact CG1-CB 4.3Å; V168-V214 HydrophobicContact CB-CG2 4.13Å; V168-V214 HydrophobicContact CG1-CG1 3.81Å; V168-V214 HydrophobicContact CG1-CG2 4.06Å; V168-V214 HydrophobicContact CG2-CG2 4.3Å |
| 169 | Y | 72.3 | Confident | 80.9 | Confident | 84 Ų | 84 | 73.1 Ų | 73.1 | 33% | 0.329 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -68.4 | -21.9 | 176.2 | -85 | -80.9 | 0 | 0 | 0 | 113.8 | R165 V167 T173 V214 | R165-Y169 HydrophobicContact CG-CD2 3.64Å; R165-Y169 HydrophobicContact CG-CE2 3.59Å; R165-Y169 VanDerWaalsContact O-CD2 3.29Å; R165-Y169 WeakPolarHBondContact O-CD2 3.41Å; R165-Y169 PolarHBondContact O-N 2.91Å; V167-Y169 PolarHBondContact O-N 3.3Å; Y169-T173 HydrophobicContact CD1-CG2 4.47Å; Y169-T173 PolarHBondContact O-OG1 3.4Å; Y169-V214 HydrophobicContact CD2-CG1 4.4Å; Y169-V214 HydrophobicContact CE2-CG1 3.85Å; Y169-V214 PolarHBondContact OH-O 3.22Å |
| 170 | K | 74.8 | Confident | 80.4 | Confident | 112 Ų | 112 | 73.1 Ų | 73.1 | 49% | 0.487 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -81.8 | -39.3 | 176.3 | -175 | 177.4 | 179.3 | -174.6 | 0 | 113 | P166 V167 V168 | P166-K170 WeakPolarHBondContact O-CB 3.39Å; P166-K170 PolarHBondContact O-N 2.89Å; P166-K170 VanDerWaalsContact O-N 3.12Å; V167-K170 PolarHBondContact O-N 3.35Å; V167-K170 VanDerWaalsContact O-N 3.15Å; V168-K170 PolarHBondContact O-N 2.99Å |
| 171 | Y | 76.8 | Confident | 80 | Confident | 163 Ų | 163 | 78.8 Ų | 78.8 | 64% | 0.639 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -108.9 | -18.5 | -171.6 | -64.5 | -74.7 | 0 | 0 | 0 | 114.6 | V167 V168 | V167-Y171 HydrophobicContact CG1-CD2 3.82Å; V167-Y171 HydrophobicContact CG1-CE2 4.18Å; V167-Y171 VanDerWaalsContact O-CD2 3.28Å; V167-Y171 WeakPolarHBondContact O-CD2 3.36Å; V167-Y171 PolarHBondContact O-N 3.37Å; V168-Y171 PolarHBondContact O-N 3.37Å |
| 172 | L | 81.2 | Confident | 79.6 | Confident | 65 Ų | 65 | 78.4 Ų | 78.4 | 34% | 0.34 | 37% | 0.37 | S | S | . | . | trans | -133.7 | 24.4 | -169.7 | -67.1 | 161.7 | 0 | 0 | 0 | 112.4 | V168 E174 R175 A176 | V168-L172 HydrophobicContact CG1-CB 4.04Å; V168-L172 HydrophobicContact CG1-CD1 4.35Å; V168-L172 CarbonylContact O-C 3.29Å; V168-L172 VanDerWaalsContact O-CA 3.3Å; V168-L172 WeakPolarHBondContact O-CA 3.44Å; V168-L172 WeakPolarHBondContact O-CB 3.23Å; V168-L172 PolarHBondContact O-N 2.99Å; L172-E174 VanDerWaalsContact C-N 3.33Å; L172-E174 PolarHBondContact O-N 3.14Å; L172-R175 PolarHBondContact O-N 3.01Å; L172-R175 VanDerWaalsContact O-N 3.14Å; L172-A176 WeakPolarHBondContact O-CB 3.43Å; L172-A176 PolarHBondContact O-N 3.22Å | ||
| 173 | T | 79 | Confident | 79.4 | Confident | 54 Ų | 54 | 74 Ų | 74 | 33% | 0.331 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -51.4 | -47.8 | -173.2 | -32.5 | 0 | 0 | 0 | 0 | 112.9 | Y169 R175 A176 Q177 | Y169-T173 HydrophobicContact CD1-CG2 4.47Å; Y169-T173 PolarHBondContact O-OG1 3.4Å; T173-R175 PolarHBondContact O-N 3.4Å; T173-A176 PolarHBondContact O-N 3.47Å; T173-Q177 WeakPolarHBondContact O-CG 3.33Å; T173-Q177 PolarHBondContact O-N 3.38Å |
| 174 | E | 81.3 | Confident | 79.4 | Confident | 124 Ų | 124 | 76.4 Ų | 76.4 | 58% | 0.579 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -65.1 | -40 | -176.8 | -161.8 | -159.7 | 143.3 | 0 | 0 | 112.1 | L172 K178 | L172-E174 VanDerWaalsContact C-N 3.33Å; L172-E174 PolarHBondContact O-N 3.14Å; E174-K178 WeakPolarHBondContact O-CG 3.37Å; E174-K178 PolarHBondContact O-N 2.86Å; E174-K178 VanDerWaalsContact O-N 3.14Å; E174-K178 IonicContact OE1-NZ 2.73Å; E174-K178 PolarHBondContact OE1-NZ 3.06Å |
| 175 | R | 81.6 | Confident | 79.5 | Confident | 153 Ų | 153 | 83.9 Ų | 83.9 | 58% | 0.577 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -69.8 | -43.1 | 176.5 | -67.4 | -175.8 | -178.2 | 174.8 | 0.2 | 111.3 | L172 T173 Q177 K178 W179 | L172-R175 PolarHBondContact O-N 3.01Å; L172-R175 VanDerWaalsContact O-N 3.14Å; T173-R175 PolarHBondContact O-N 3.4Å; R175-Q177 VanDerWaalsContact C-N 3.29Å; R175-Q177 PolarHBondContact O-N 2.98Å; R175-K178 PolarHBondContact O-N 3.46Å; R175-W179 HydrophobicContact CB-CH2 4.14Å; R175-W179 HydrophobicContact CB-CZ2 4.1Å; R175-W179 HydrophobicContact CB-CZ3 4.4Å; R175-W179 VanDerWaalsContact O-CG 3.28Å; R175-W179 PolarHBondContact O-N 3.07Å |
| 176 | A | 80.7 | Confident | 79.7 | Confident | 3 Ų | 3 | 85.3 Ų | 85.3 | 3% | 0.025 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -59.2 | -40.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | V168 L172 T173 S180 V214 | V168-A176 HydrophobicContact CG1-CB 4.3Å; L172-A176 WeakPolarHBondContact O-CB 3.43Å; L172-A176 PolarHBondContact O-N 3.22Å; T173-A176 PolarHBondContact O-N 3.47Å; A176-S180 WeakPolarHBondContact O-CB 3.47Å; A176-S180 PolarHBondContact O-N 3.25Å; A176-V214 HydrophobicContact CB-CG1 3.77Å |
| 177 | Q | 80.4 | Confident | 79.9 | Confident | 108 Ų | 108 | 85.9 Ų | 85.9 | 51% | 0.505 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.6 | -46.6 | 174.8 | -75.5 | 174.9 | -10.8 | 0 | 0 | 112.3 | T173 R175 W179 S180 Q181 | T173-Q177 WeakPolarHBondContact O-CG 3.33Å; T173-Q177 PolarHBondContact O-N 3.38Å; R175-Q177 VanDerWaalsContact C-N 3.29Å; R175-Q177 PolarHBondContact O-N 2.98Å; Q177-W179 PolarHBondContact O-N 2.86Å; Q177-S180 WeakPolarHBondContact O-CB 3.5Å; Q177-S180 PolarHBondContact O-N 3Å; Q177-Q181 WeakPolarHBondContact O-CG 3.39Å; Q177-Q181 PolarHBondContact O-N 3.37Å |
| 178 | K | 83.8 | Confident | 80.3 | Confident | 111 Ų | 111 | 90.4 Ų | 90.4 | 48% | 0.483 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -59.1 | -45 | 176.5 | -75.4 | 172.2 | 173.2 | 165.1 | 0 | 112.1 | E174 R175 Q181 Q182 | E174-K178 WeakPolarHBondContact O-CG 3.37Å; E174-K178 PolarHBondContact O-N 2.86Å; E174-K178 VanDerWaalsContact O-N 3.14Å; E174-K178 IonicContact OE1-NZ 2.73Å; E174-K178 PolarHBondContact OE1-NZ 3.06Å; R175-K178 PolarHBondContact O-N 3.46Å; K178-Q181 PolarHBondContact O-N 3.1Å; K178-Q182 PolarHBondContact O-N 3.19Å; K178-Q182 VanDerWaalsContact O-N 3.07Å |
| 179 | W | 82.8 | Confident | 80.8 | Confident | 71 Ų | 71 | 95.3 Ų | 95.3 | 27% | 0.269 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.3 | -41.2 | 176.3 | -61.6 | -30.3 | 0 | 0 | 0 | 112.1 | R175 Q177 Q181 Q182 V183 F207 T211 I215 | R175-W179 HydrophobicContact CB-CH2 4.14Å; R175-W179 HydrophobicContact CB-CZ2 4.1Å; R175-W179 HydrophobicContact CB-CZ3 4.4Å; R175-W179 VanDerWaalsContact O-CG 3.28Å; R175-W179 PolarHBondContact O-N 3.07Å; Q177-W179 PolarHBondContact O-N 2.86Å; W179-Q181 VanDerWaalsContact C-N 3.34Å; W179-Q181 PolarHBondContact O-N 3.3Å; W179-Q182 PolarHBondContact O-N 3.43Å; W179-V183 WeakPolarHBondContact O-CG2 3.32Å; W179-V183 PolarHBondContact O-N 3.23Å; W179-F207 HydrophobicContact CE3-CZ 4.46Å; W179-F207 AromaticContact CH2-CE2 3.83Å; W179-F207 HydrophobicContact CH2-CE2 3.83Å; W179-F207 AromaticContact CH2-CZ 3.63Å; W179-F207 HydrophobicContact CH2-CZ 3.63Å; W179-F207 HydrophobicContact CZ2-CE2 4.23Å; W179-F207 AromaticContact CZ2-CZ 3.69Å; W179-F207 HydrophobicContact CZ2-CZ 3.69Å; W179-F207 HydrophobicContact CZ3-CE2 4.34Å; W179-F207 HydrophobicContact CZ3-CZ 4.03Å; W179-T211 HydrophobicContact CE3-CG2 4.19Å; W179-T211 HydrophobicContact CZ3-CG2 3.93Å; W179-I215 HydrophobicContact CB-CG2 3.93Å |
| 180 | S | 83.3 | Confident | 81.5 | Confident | 21 Ų | 21 | 91.9 Ų | 91.9 | 15% | 0.147 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -57.8 | -48.2 | 174.5 | -167.6 | 0 | 0 | 0 | 0 | 110.7 | A176 Q177 Q182 V183 D184 | A176-S180 WeakPolarHBondContact O-CB 3.47Å; A176-S180 PolarHBondContact O-N 3.25Å; Q177-S180 WeakPolarHBondContact O-CB 3.5Å; Q177-S180 PolarHBondContact O-N 3Å; S180-Q182 VanDerWaalsContact C-N 3.33Å; S180-Q182 PolarHBondContact O-N 3.45Å; S180-V183 PolarHBondContact O-N 3.13Å; S180-V183 VanDerWaalsContact O-N 3.15Å; S180-D184 WeakPolarHBondContact O-CB 3.5Å; S180-D184 PolarHBondContact O-N 2.85Å; S180-D184 VanDerWaalsContact O-OD2 3.11Å; S180-D184 PolarHBondContact OG-OD2 2.96Å |
| 181 | Q | 83.1 | Confident | 82.2 | Confident | 126 Ų | 126 | 89.5 Ų | 89.5 | 59% | 0.589 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -60.5 | -39 | 178.7 | -71.8 | 174.4 | -1.9 | 0 | 0 | 112.9 | Q177 K178 W179 D184 K185 | Q177-Q181 WeakPolarHBondContact O-CG 3.39Å; Q177-Q181 PolarHBondContact O-N 3.37Å; K178-Q181 PolarHBondContact O-N 3.1Å; W179-Q181 VanDerWaalsContact C-N 3.34Å; W179-Q181 PolarHBondContact O-N 3.3Å; Q181-D184 PolarHBondContact O-N 3.17Å; Q181-K185 WeakPolarHBondContact O-CG 3.42Å; Q181-K185 PolarHBondContact O-N 3.49Å |
| 182 | Q | 80.9 | Confident | 82.9 | Confident | 108 Ų | 108 | 86.5 Ų | 86.5 | 51% | 0.505 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -65 | -39.7 | 175.9 | -77.2 | -177.5 | -26.9 | 0 | 0 | 112.5 | K178 W179 S180 H186 | K178-Q182 PolarHBondContact O-N 3.19Å; K178-Q182 VanDerWaalsContact O-N 3.07Å; W179-Q182 PolarHBondContact O-N 3.43Å; S180-Q182 VanDerWaalsContact C-N 3.33Å; S180-Q182 PolarHBondContact O-N 3.45Å; Q182-H186 PolarHBondContact O-ND1 3.46Å |
| 183 | V | 81.5 | Confident | 83.3 | Confident | 7 Ų | 7 | 85.7 Ų | 85.7 | 4% | 0.042 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -75.8 | -32.8 | 177.7 | 176.1 | 0 | 0 | 0 | 0 | 111.7 | W179 S180 K185 H186 R187 L190 Y193 I215 V217 | W179-V183 WeakPolarHBondContact O-CG2 3.32Å; W179-V183 PolarHBondContact O-N 3.23Å; S180-V183 PolarHBondContact O-N 3.13Å; S180-V183 VanDerWaalsContact O-N 3.15Å; V183-K185 PolarHBondContact O-N 3.25Å; V183-H186 CarbonylContact O-C 3.59Å; V183-H186 WeakPolarHBondContact O-CA 3.41Å; V183-H186 PolarHBondContact O-N 3.2Å; V183-R187 PolarHBondContact O-N 3.24Å; V183-L190 HydrophobicContact CG1-CD1 3.33Å; V183-Y193 HydrophobicContact CB-CE1 4.48Å; V183-Y193 HydrophobicContact CG2-CD1 4.36Å; V183-Y193 HydrophobicContact CG2-CE1 3.57Å; V183-I215 HydrophobicContact CB-CD1 3.96Å; V183-I215 HydrophobicContact CG1-CD1 4.01Å; V183-I215 HydrophobicContact CG2-CD1 3.43Å; V183-I215 VanDerWaalsContact CG2-CD1 3.43Å; V183-V217 HydrophobicContact CG1-CG2 4.39Å |
| 184 | D | 81.8 | Confident | 83.9 | Confident | 67 Ų | 67 | 83.2 Ų | 83.2 | 36% | 0.358 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -62.5 | -31.5 | 178.2 | -73.1 | -30.2 | 0 | 0 | 0 | 112 | S180 Q181 H186 R187 | S180-D184 WeakPolarHBondContact O-CB 3.5Å; S180-D184 PolarHBondContact O-N 2.85Å; S180-D184 VanDerWaalsContact O-OD2 3.11Å; S180-D184 PolarHBondContact OG-OD2 2.96Å; Q181-D184 PolarHBondContact O-N 3.17Å; D184-H186 PolarHBondContact O-N 3.09Å; D184-H186 VanDerWaalsContact O-N 3.17Å; D184-R187 HydrophobicContact CB-CG 4.4Å; D184-R187 WeakPolarHBondContact O-CG 3.36Å; D184-R187 PolarHBondContact O-N 3.17Å; D184-R187 IonicContact OD1-CZ 3.35Å; D184-R187 IonicContact OD1-NE 2.79Å; D184-R187 PolarHBondContact OD1-NE 2.73Å; D184-R187 IonicContact OD1-NH2 2.99Å; D184-R187 PolarHBondContact OD1-NH2 3.29Å |
| 185 | K | 80.4 | Confident | 84.5 | Confident | 175 Ų | 175 | 79 Ų | 79 | 76% | 0.761 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | -20.3 | 170.4 | -68 | 176.6 | -177.2 | -174.5 | 0 | 114.3 | Q181 V183 | Q181-K185 WeakPolarHBondContact O-CG 3.42Å; Q181-K185 PolarHBondContact O-N 3.49Å; V183-K185 PolarHBondContact O-N 3.25Å |
| 186 | H | 82.3 | Confident | 84.9 | Confident | 88 Ų | 88 | 75.8 Ų | 75.8 | 41% | 0.407 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -117.7 | 17.7 | -176 | -57.8 | 95.3 | 0 | 0 | 0 | 112.5 | Q182 V183 D184 D188 H189 L190 Y193 | Q182-H186 PolarHBondContact O-ND1 3.46Å; V183-H186 CarbonylContact O-C 3.59Å; V183-H186 WeakPolarHBondContact O-CA 3.41Å; V183-H186 PolarHBondContact O-N 3.2Å; D184-H186 PolarHBondContact O-N 3.09Å; D184-H186 VanDerWaalsContact O-N 3.17Å; H186-D188 VanDerWaalsContact C-N 3.29Å; H186-D188 PolarHBondContact O-N 2.78Å; H186-H189 CarbonylContact O-C 3.38Å; H186-H189 VanDerWaalsContact O-C 3.27Å; H186-H189 PolarHBondContact O-N 3.29Å; H186-L190 PolarHBondContact O-N 3.27Å; H186-L190 VanDerWaalsContact O-N 3.13Å; H186-Y193 HydrophobicContact CB-CD2 4.13Å; H186-Y193 HydrophobicContact CB-CG 4.25Å; H186-Y193 AromaticContact CG-CD2 3.95Å; H186-Y193 AromaticContact ND1-CE2 3.97Å |
| 187 | R | 79.1 | Confident | 85.3 | Confident | 82 Ų | 82 | 76.6 Ų | 76.6 | 31% | 0.309 | 36% | 0.36 | S | S | . | . | G | 310 helix | trans | -55.9 | -39.7 | -174.9 | -86.1 | -86.1 | -176.1 | -162 | -5.6 | 114.1 | V183 D184 H189 L190 I215 N216 | V183-R187 PolarHBondContact O-N 3.24Å; D184-R187 HydrophobicContact CB-CG 4.4Å; D184-R187 WeakPolarHBondContact O-CG 3.36Å; D184-R187 PolarHBondContact O-N 3.17Å; D184-R187 IonicContact OD1-CZ 3.35Å; D184-R187 IonicContact OD1-NE 2.79Å; D184-R187 PolarHBondContact OD1-NE 2.73Å; D184-R187 IonicContact OD1-NH2 2.99Å; D184-R187 PolarHBondContact OD1-NH2 3.29Å; R187-H189 PolarHBondContact O-N 3.27Å; R187-L190 WeakPolarHBondContact O-CB 3.37Å; R187-L190 PolarHBondContact O-N 3.44Å; R187-I215 PolarHBondContact NH2-O 3.46Å; R187-N216 PolarHBondContact NH1-O 3.05Å |
| 188 | D | 81.8 | Confident | 85.9 | Confident | 155 Ų | 155 | 71.9 Ų | 71.9 | 83% | 0.829 | 34% | 0.337 | S | S | * | . | G | 310 helix | trans | -67.7 | -17.2 | 180 | -58.7 | -34.5 | 0 | 0 | 0 | 112.7 | H186 | H186-D188 VanDerWaalsContact C-N 3.29Å; H186-D188 PolarHBondContact O-N 2.78Å |
| 189 | H | 87.1 | Confident | 86.2 | Confident | 125 Ų | 125 | 70.3 Ų | 70.3 | 58% | 0.579 | 33% | 0.333 | S | S | * | . | G | 310 helix | trans | -128.1 | 32.8 | -178.6 | -60.2 | -42.4 | 0 | 0 | 0 | 112.4 | H186 R187 I191 N192 Y193 | H186-H189 CarbonylContact O-C 3.38Å; H186-H189 VanDerWaalsContact O-C 3.27Å; H186-H189 PolarHBondContact O-N 3.29Å; R187-H189 PolarHBondContact O-N 3.27Å; H189-I191 VanDerWaalsContact C-N 3.3Å; H189-I191 PolarHBondContact O-N 3.15Å; H189-N192 HydrophobicContact CB-CB 4.42Å; H189-N192 WeakPolarHBondContact O-CB 3.45Å; H189-N192 PolarHBondContact O-N 2.93Å; H189-Y193 PolarHBondContact O-N 2.63Å |
| 190 | L | 87.6 | Confident | 86.3 | Confident | 11 Ų | 11 | 67.9 Ų | 67.9 | 6% | 0.058 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -60.3 | -35.5 | -170.4 | -164.3 | 63.2 | 0 | 0 | 0 | 113.8 | V183 H186 R187 Y193 I194 V217 V221 | V183-L190 HydrophobicContact CG1-CD1 3.33Å; H186-L190 PolarHBondContact O-N 3.27Å; H186-L190 VanDerWaalsContact O-N 3.13Å; R187-L190 WeakPolarHBondContact O-CB 3.37Å; R187-L190 PolarHBondContact O-N 3.44Å; L190-Y193 PolarHBondContact O-N 3.02Å; L190-I194 WeakPolarHBondContact O-CG1 3.44Å; L190-I194 PolarHBondContact O-N 3.38Å; L190-V217 HydrophobicContact CD1-CG2 4.21Å; L190-V217 HydrophobicContact CD2-CB 4.34Å; L190-V217 HydrophobicContact CD2-CG1 4Å; L190-V217 HydrophobicContact CD2-CG2 4.17Å; L190-V217 HydrophobicContact CG-CG1 4.36Å; L190-V217 HydrophobicContact CG-CG2 4.43Å; L190-V221 HydrophobicContact CB-CG1 4.02Å; L190-V221 HydrophobicContact CD2-CG1 4Å; L190-V221 HydrophobicContact CG-CG1 3.85Å |
| 191 | I | 90.8 | Very high | 86 | Confident | 62 Ų | 62 | 70 Ų | 70 | 32% | 0.318 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -60.4 | -49.5 | 174 | -65.3 | 170.3 | 0 | 0 | 0 | 110.1 | H189 Y193 I194 I195 V221 I224 | H189-I191 VanDerWaalsContact C-N 3.3Å; H189-I191 PolarHBondContact O-N 3.15Å; I191-Y193 VanDerWaalsContact C-N 3.27Å; I191-Y193 PolarHBondContact O-N 3.39Å; I191-I194 PolarHBondContact O-N 2.95Å; I191-I195 HydrophobicContact CG2-CD1 3.78Å; I191-I195 HydrophobicContact CG2-CG1 4.38Å; I191-I195 VanDerWaalsContact O-CG1 3.3Å; I191-I195 WeakPolarHBondContact O-CG1 3.12Å; I191-I195 PolarHBondContact O-N 3.43Å; I191-V221 HydrophobicContact CB-CG1 4.42Å; I191-V221 HydrophobicContact CD1-CG2 4.39Å; I191-V221 HydrophobicContact CG1-CB 4.1Å; I191-V221 HydrophobicContact CG1-CG1 3.62Å; I191-V221 HydrophobicContact CG1-CG2 3.96Å; I191-I224 HydrophobicContact CG2-CG2 4.38Å |
| 192 | N | 90.4 | Very high | 85.9 | Confident | 101 Ų | 101 | 65.8 Ų | 65.8 | 54% | 0.54 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.4 | -38.1 | -179.8 | -63.1 | -21 | 0 | 0 | 0 | 111.2 | H189 I195 F196 | H189-N192 HydrophobicContact CB-CB 4.42Å; H189-N192 WeakPolarHBondContact O-CB 3.45Å; H189-N192 PolarHBondContact O-N 2.93Å; N192-I195 PolarHBondContact O-N 2.86Å; N192-F196 WeakPolarHBondContact O-CB 3.14Å; N192-F196 PolarHBondContact O-N 3.34Å |
| 193 | Y | 90.3 | Very high | 86 | Confident | 48 Ų | 48 | 63.6 Ų | 63.6 | 19% | 0.188 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -63.1 | -46.4 | 175.6 | -172.9 | -103.5 | 0 | 0 | 0 | 112 | V183 H186 H189 L190 I191 I195 F196 L197 | V183-Y193 HydrophobicContact CB-CE1 4.48Å; V183-Y193 HydrophobicContact CG2-CD1 4.36Å; V183-Y193 HydrophobicContact CG2-CE1 3.57Å; H186-Y193 HydrophobicContact CB-CD2 4.13Å; H186-Y193 HydrophobicContact CB-CG 4.25Å; H186-Y193 AromaticContact CG-CD2 3.95Å; H186-Y193 AromaticContact ND1-CE2 3.97Å; H189-Y193 PolarHBondContact O-N 2.63Å; L190-Y193 PolarHBondContact O-N 3.02Å; I191-Y193 VanDerWaalsContact C-N 3.27Å; I191-Y193 PolarHBondContact O-N 3.39Å; Y193-I195 PolarHBondContact O-N 3.39Å; Y193-F196 WeakPolarHBondContact O-CB 3.29Å; Y193-F196 PolarHBondContact O-N 3.04Å; Y193-L197 HydrophobicContact CD1-CD1 3.98Å; Y193-L197 HydrophobicContact CD1-CG 4.4Å; Y193-L197 HydrophobicContact CE1-CD1 3.49Å; Y193-L197 VanDerWaalsContact CE1-CD1 3.49Å; Y193-L197 HydrophobicContact CE1-CG 4.09Å; Y193-L197 WeakPolarHBondContact O-CG 3.19Å; Y193-L197 PolarHBondContact O-N 2.98Å |
| 194 | I | 91.9 | Very high | 86.3 | Confident | 2 Ų | 2 | 66.3 Ų | 66.3 | 1% | 0.01 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 175.4 | -64.6 | -64 | 0 | 0 | 0 | 111.4 | L190 I191 F196 L197 R198 V217 | L190-I194 WeakPolarHBondContact O-CG1 3.44Å; L190-I194 PolarHBondContact O-N 3.38Å; I191-I194 PolarHBondContact O-N 2.95Å; I194-F196 VanDerWaalsContact C-N 3.31Å; I194-F196 PolarHBondContact O-N 3.28Å; I194-L197 PolarHBondContact O-N 3.12Å; I194-R198 HydrophobicContact CG2-CG 4.27Å; I194-R198 WeakPolarHBondContact O-CB 3.27Å; I194-R198 WeakPolarHBondContact O-CG 3.35Å; I194-R198 PolarHBondContact O-N 3.43Å; I194-V217 HydrophobicContact CD1-CG1 4.33Å; I194-V217 HydrophobicContact CD1-CG2 4.39Å; I194-V217 HydrophobicContact CG1-CG1 4.34Å |
| 195 | I | 92.6 | Very high | 86.5 | Confident | 34 Ų | 34 | 66.2 Ų | 66.2 | 17% | 0.174 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -56.5 | -49 | 175.4 | -70.5 | 170.2 | 0 | 0 | 0 | 110 | I191 N192 Y193 L197 R198 I199 G225 L228 | I191-I195 HydrophobicContact CG2-CD1 3.78Å; I191-I195 HydrophobicContact CG2-CG1 4.38Å; I191-I195 VanDerWaalsContact O-CG1 3.3Å; I191-I195 WeakPolarHBondContact O-CG1 3.12Å; I191-I195 PolarHBondContact O-N 3.43Å; N192-I195 PolarHBondContact O-N 2.86Å; Y193-I195 PolarHBondContact O-N 3.39Å; I195-L197 PolarHBondContact O-N 3.41Å; I195-R198 PolarHBondContact O-N 2.99Å; I195-R198 VanDerWaalsContact O-N 3.12Å; I195-I199 HydrophobicContact CG2-CD1 3.55Å; I195-I199 HydrophobicContact CG2-CG1 4.27Å; I195-I199 VanDerWaalsContact O-CG1 3.31Å; I195-I199 WeakPolarHBondContact O-CG1 3.17Å; I195-I199 PolarHBondContact O-N 3.04Å; I195-G225 WeakPolarHBondContact CG1-O 3.1Å; I195-L228 HydrophobicContact CD1-CB 3.99Å; I195-L228 HydrophobicContact CD1-CD1 3.97Å; I195-L228 HydrophobicContact CG1-CB 4.14Å |
| 196 | F | 90.9 | Very high | 86.9 | Confident | 86 Ų | 86 | 64 Ų | 64 | 38% | 0.377 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -57.9 | -46.8 | 178 | 174.6 | -97.7 | 0 | 0 | 0 | 112.2 | N192 Y193 I194 R198 I199 T200 F202 L283 | N192-F196 WeakPolarHBondContact O-CB 3.14Å; N192-F196 PolarHBondContact O-N 3.34Å; Y193-F196 WeakPolarHBondContact O-CB 3.29Å; Y193-F196 PolarHBondContact O-N 3.04Å; I194-F196 VanDerWaalsContact C-N 3.31Å; I194-F196 PolarHBondContact O-N 3.28Å; F196-R198 PolarHBondContact O-N 3.46Å; F196-I199 PolarHBondContact O-N 3.28Å; F196-T200 HydrophobicContact CD2-CG2 4.06Å; F196-T200 HydrophobicContact CE1-CG2 4.24Å; F196-T200 HydrophobicContact CE2-CG2 3.69Å; F196-T200 HydrophobicContact CG-CG2 4.49Å; F196-T200 HydrophobicContact CZ-CG2 3.79Å; F196-T200 WeakPolarHBondContact O-CB 3.29Å; F196-T200 WeakPolarHBondContact O-CG2 3.48Å; F196-T200 PolarHBondContact O-N 3.2Å; F196-T200 PolarHBondContact O-OG1 3.4Å; F196-F202 HydrophobicContact CE1-CE2 4.47Å; F196-F202 HydrophobicContact CZ-CE2 4.13Å; F196-L283 HydrophobicContact CZ-CD1 3.86Å; F196-L283 HydrophobicContact CZ-CD2 4.37Å |
| 197 | L | 89.2 | Confident | 87.3 | Confident | 20 Ų | 20 | 61.8 Ų | 61.8 | 11% | 0.105 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -63 | -28.2 | 177.9 | -69.6 | -175.9 | 0 | 0 | 0 | 113.4 | Y193 I194 I195 T200 L203 I208 | Y193-L197 HydrophobicContact CD1-CD1 3.98Å; Y193-L197 HydrophobicContact CD1-CG 4.4Å; Y193-L197 HydrophobicContact CE1-CD1 3.49Å; Y193-L197 VanDerWaalsContact CE1-CD1 3.49Å; Y193-L197 HydrophobicContact CE1-CG 4.09Å; Y193-L197 WeakPolarHBondContact O-CG 3.19Å; Y193-L197 PolarHBondContact O-N 2.98Å; I194-L197 PolarHBondContact O-N 3.12Å; I195-L197 PolarHBondContact O-N 3.41Å; L197-T200 VanDerWaalsContact O-O 3.09Å; L197-L203 HydrophobicContact CD1-CD1 4.3Å; L197-L203 HydrophobicContact CD2-CD1 3.98Å; L197-I208 HydrophobicContact CB-CD1 4Å; L197-I208 WeakPolarHBondContact O-CD1 3.34Å |
| 198 | R | 92.8 | Very high | 87.9 | Confident | 9 Ų | 9 | 58 Ų | 58 | 3% | 0.034 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -84.6 | -32.9 | -179.9 | -70.9 | -72.1 | -172.3 | -156.8 | -5.8 | 113.5 | I194 I195 F196 N205 N209 T226 G229 | I194-R198 HydrophobicContact CG2-CG 4.27Å; I194-R198 WeakPolarHBondContact O-CB 3.27Å; I194-R198 WeakPolarHBondContact O-CG 3.35Å; I194-R198 PolarHBondContact O-N 3.43Å; I195-R198 PolarHBondContact O-N 2.99Å; I195-R198 VanDerWaalsContact O-N 3.12Å; F196-R198 PolarHBondContact O-N 3.46Å; R198-N205 PolarHBondContact NH1-O 3.2Å; R198-N205 PolarHBondContact NH1-OD1 2.69Å; R198-N209 VanDerWaalsContact CZ-OD1 3.3Å; R198-N209 PolarHBondContact NH1-OD1 3.41Å; R198-N209 VanDerWaalsContact NH1-OD1 3.12Å; R198-N209 PolarHBondContact NH2-OD1 2.99Å; R198-T226 PolarHBondContact NE-OG1 3.23Å; R198-T226 PolarHBondContact NH2-OG1 3.38Å; R198-G229 CarbonylContact C-O 3.58Å |
| 199 | I | 88.9 | Confident | 88.5 | Confident | 78 Ų | 78 | 50.7 Ų | 50.7 | 40% | 0.4 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -73 | -40.6 | 175.3 | -67.5 | 174.1 | 0 | 0 | 0 | 109.8 | I195 F196 G229 P232 | I195-I199 HydrophobicContact CG2-CD1 3.55Å; I195-I199 HydrophobicContact CG2-CG1 4.27Å; I195-I199 VanDerWaalsContact O-CG1 3.31Å; I195-I199 WeakPolarHBondContact O-CG1 3.17Å; I195-I199 PolarHBondContact O-N 3.04Å; F196-I199 PolarHBondContact O-N 3.28Å; I199-G229 WeakPolarHBondContact CG1-O 3.47Å; I199-P232 HydrophobicContact CD1-CG 3.97Å; I199-P232 HydrophobicContact CG1-CG 3.91Å |
| 200 | T | 84.7 | Confident | 88.6 | Confident | 21 Ų | 21 | 47.2 Ų | 47.2 | 13% | 0.129 | 24% | 0.237 | C | C | . | . | S | Bend | trans | -80.8 | 137.5 | -177.8 | 58 | 0 | 0 | 0 | 0 | 111.2 | F196 L197 F202 | F196-T200 HydrophobicContact CD2-CG2 4.06Å; F196-T200 HydrophobicContact CE1-CG2 4.24Å; F196-T200 HydrophobicContact CE2-CG2 3.69Å; F196-T200 HydrophobicContact CG-CG2 4.49Å; F196-T200 HydrophobicContact CZ-CG2 3.79Å; F196-T200 WeakPolarHBondContact O-CB 3.29Å; F196-T200 WeakPolarHBondContact O-CG2 3.48Å; F196-T200 PolarHBondContact O-N 3.2Å; F196-T200 PolarHBondContact O-OG1 3.4Å; L197-T200 VanDerWaalsContact O-O 3.09Å; T200-F202 VanDerWaalsContact CB-CD2 3.43Å; T200-F202 VanDerWaalsContact CB-CE2 3.5Å; T200-F202 HydrophobicContact CG2-CD2 4.03Å; T200-F202 HydrophobicContact CG2-CE2 3.61Å; T200-F202 HydrophobicContact CG2-CZ 4.23Å; T200-F202 PolarHBondContact O-N 2.91Å; T200-F202 VanDerWaalsContact O-N 3.09Å; T200-F202 WeakPolarHBondContact OG1-CD2 3.34Å |
| 201 | P | 78.6 | Confident | 88.7 | Confident | 66 Ų | 66 | 47.6 Ų | 47.6 | 43% | 0.429 | 24% | 0.239 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.9 | 19.1 | -179.4 | 35.4 | -37.3 | 0 | 0 | 0 | 112.8 | P272 | P201-P272 HydrophobicContact CG-CB 3.55Š|
| 202 | F | 79.5 | Confident | 88.8 | Confident | 36 Ų | 36 | 44.7 Ų | 44.7 | 16% | 0.158 | 23% | 0.225 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.2 | -39.4 | -174.9 | -57.5 | -39.5 | 0 | 0 | 0 | 112.3 | F196 T200 Q276 L279 Q280 L283 | F196-F202 HydrophobicContact CE1-CE2 4.47Å; F196-F202 HydrophobicContact CZ-CE2 4.13Å; T200-F202 VanDerWaalsContact CB-CD2 3.43Å; T200-F202 VanDerWaalsContact CB-CE2 3.5Å; T200-F202 HydrophobicContact CG2-CD2 4.03Å; T200-F202 HydrophobicContact CG2-CE2 3.61Å; T200-F202 HydrophobicContact CG2-CZ 4.23Å; T200-F202 PolarHBondContact O-N 2.91Å; T200-F202 VanDerWaalsContact O-N 3.09Å; T200-F202 WeakPolarHBondContact OG1-CD2 3.34Å; F202-Q276 HydrophobicContact CD1-CG 3.78Å; F202-Q276 HydrophobicContact CE1-CG 4.01Å; F202-L279 HydrophobicContact CE1-CB 3.98Å; F202-L279 HydrophobicContact CZ-CB 3.68Å; F202-L279 HydrophobicContact CZ-CD1 4.36Å; F202-L279 HydrophobicContact CZ-CD2 4.23Å; F202-L279 HydrophobicContact CZ-CG 4.31Å; F202-Q280 HydrophobicContact CD1-CG 4.39Å; F202-L283 HydrophobicContact CE2-CD1 3.98Å; F202-L283 HydrophobicContact CZ-CD1 4.36Å |
| 203 | L | 84.1 | Confident | 88.8 | Confident | 62 Ų | 62 | 39.9 Ų | 39.9 | 33% | 0.325 | 20% | 0.199 | S | C | . | . | S | Bend | trans | -114.8 | 132.8 | -177.9 | -64.1 | -179.2 | 0 | 0 | 0 | 110.2 | L197 F207 I208 | L197-L203 HydrophobicContact CD1-CD1 4.3Å; L197-L203 HydrophobicContact CD2-CD1 3.98Å; L203-F207 HydrophobicContact CB-CD1 4.31Å; L203-F207 HydrophobicContact CD1-CD1 4.1Å; L203-F207 HydrophobicContact CD1-CE1 4.18Å; L203-F207 HydrophobicContact CD2-CD1 3.98Å; L203-F207 HydrophobicContact CD2-CE1 4.03Å; L203-F207 HydrophobicContact CG-CD1 4.36Å; L203-I208 HydrophobicContact CB-CD1 4.06Å; L203-I208 HydrophobicContact CB-CG1 3.83Å; L203-I208 HydrophobicContact CD1-CG1 4.26Å |
| 204 | P | 86.6 | Confident | 88.6 | Confident | 64 Ų | 64 | 37.8 Ų | 37.8 | 42% | 0.416 | 19% | 0.191 | S | C | . | . | trans | -57.8 | 144.1 | 171.6 | -24.1 | 33.7 | 0 | 0 | 0 | 111.7 | W206 F207 I208 | P204-W206 VanDerWaalsContact C-N 3.26Å; P204-W206 VanDerWaalsContact CB-CD1 3.48Å; P204-W206 HydrophobicContact CB-CD2 4.4Å; P204-W206 HydrophobicContact CB-CG 4.17Å; P204-W206 HydrophobicContact CG-CZ2 4.47Å; P204-W206 PolarHBondContact O-N 3.41Å; P204-F207 HydrophobicContact CB-CB 4.26Å; P204-F207 WeakPolarHBondContact O-CB 3.21Å; P204-F207 PolarHBondContact O-N 2.8Å; P204-I208 PolarHBondContact O-N 3.11Å | ||
| 205 | N | 87.3 | Confident | 88.4 | Confident | 66 Ų | 66 | 38.2 Ų | 38.2 | 35% | 0.353 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -56.3 | -40.8 | -179.4 | -88.5 | -40.8 | 0 | 0 | 0 | 113.1 | R198 F207 I208 N209 | R198-N205 PolarHBondContact NH1-O 3.2Å; R198-N205 PolarHBondContact NH1-OD1 2.69Å; N205-F207 VanDerWaalsContact C-N 3.25Å; N205-F207 PolarHBondContact O-N 3.4Å; N205-I208 PolarHBondContact O-N 3.38Å; N205-N209 PolarHBondContact O-N 2.99Å; N205-N209 VanDerWaalsContact O-N 3.13Å; N205-N209 PolarHBondContact O-OD1 3.2Å |
| 206 | W | 89.5 | Confident | 88.1 | Confident | 129 Ų | 129 | 39.9 Ų | 39.9 | 49% | 0.489 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -61.1 | -36.4 | 177 | 68.1 | -102.8 | 0 | 0 | 0 | 112 | A121 P204 N209 I210 | A121-W206 HydrophobicContact CB-CB 3.56Å; P204-W206 VanDerWaalsContact C-N 3.26Å; P204-W206 VanDerWaalsContact CB-CD1 3.48Å; P204-W206 HydrophobicContact CB-CD2 4.4Å; P204-W206 HydrophobicContact CB-CG 4.17Å; P204-W206 HydrophobicContact CG-CZ2 4.47Å; P204-W206 PolarHBondContact O-N 3.41Å; W206-N209 PolarHBondContact O-N 2.69Å; W206-I210 HydrophobicContact CE3-CD1 3.92Å; W206-I210 HydrophobicContact CZ3-CD1 4.41Å; W206-I210 WeakPolarHBondContact O-CG1 3.35Å; W206-I210 PolarHBondContact O-N 2.86Å |
| 207 | F | 90 | Very high | 88.1 | Confident | 41 Ų | 41 | 35.8 Ų | 35.8 | 18% | 0.18 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -66.8 | -47.3 | -177.5 | -178.7 | -95 | 0 | 0 | 0 | 110.1 | W179 L203 P204 N205 N209 I210 T211 | W179-F207 HydrophobicContact CE3-CZ 4.46Å; W179-F207 AromaticContact CH2-CE2 3.83Å; W179-F207 HydrophobicContact CH2-CE2 3.83Å; W179-F207 AromaticContact CH2-CZ 3.63Å; W179-F207 HydrophobicContact CH2-CZ 3.63Å; W179-F207 HydrophobicContact CZ2-CE2 4.23Å; W179-F207 AromaticContact CZ2-CZ 3.69Å; W179-F207 HydrophobicContact CZ2-CZ 3.69Å; W179-F207 HydrophobicContact CZ3-CE2 4.34Å; W179-F207 HydrophobicContact CZ3-CZ 4.03Å; L203-F207 HydrophobicContact CB-CD1 4.31Å; L203-F207 HydrophobicContact CD1-CD1 4.1Å; L203-F207 HydrophobicContact CD1-CE1 4.18Å; L203-F207 HydrophobicContact CD2-CD1 3.98Å; L203-F207 HydrophobicContact CD2-CE1 4.03Å; L203-F207 HydrophobicContact CG-CD1 4.36Å; P204-F207 HydrophobicContact CB-CB 4.26Å; P204-F207 WeakPolarHBondContact O-CB 3.21Å; P204-F207 PolarHBondContact O-N 2.8Å; N205-F207 VanDerWaalsContact C-N 3.25Å; N205-F207 PolarHBondContact O-N 3.4Å; F207-N209 VanDerWaalsContact C-N 3.3Å; F207-N209 PolarHBondContact O-N 3.44Å; F207-I210 PolarHBondContact O-N 3.01Å; F207-T211 HydrophobicContact CD1-CG2 4.17Å; F207-T211 HydrophobicContact CD2-CG2 4.07Å; F207-T211 HydrophobicContact CE1-CG2 3.83Å; F207-T211 HydrophobicContact CE2-CG2 3.72Å; F207-T211 HydrophobicContact CG-CG2 4.29Å; F207-T211 HydrophobicContact CZ-CG2 3.6Å; F207-T211 WeakPolarHBondContact O-CB 3.42Å; F207-T211 WeakPolarHBondContact O-CG2 3.38Å; F207-T211 PolarHBondContact O-N 3.02Å; F207-T211 PolarHBondContact O-OG1 3.43Å |
| 208 | I | 91.6 | Very high | 88.3 | Confident | 3 Ų | 3 | 38 Ų | 38 | 2% | 0.015 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60 | -42.4 | 176.3 | -53.9 | 168.2 | 0 | 0 | 0 | 110.2 | L197 L203 P204 N205 I210 S212 F222 | L197-I208 HydrophobicContact CB-CD1 4Å; L197-I208 WeakPolarHBondContact O-CD1 3.34Å; L203-I208 HydrophobicContact CB-CD1 4.06Å; L203-I208 HydrophobicContact CB-CG1 3.83Å; L203-I208 HydrophobicContact CD1-CG1 4.26Å; P204-I208 PolarHBondContact O-N 3.11Å; N205-I208 PolarHBondContact O-N 3.38Å; I208-I210 PolarHBondContact O-N 3.19Å; I208-S212 VanDerWaalsContact O-CB 3.22Å; I208-S212 WeakPolarHBondContact O-CB 3.31Å; I208-S212 PolarHBondContact O-N 2.87Å; I208-S212 PolarHBondContact O-OG 3.48Å; I208-F222 HydrophobicContact CG2-CE2 4.22Å |
| 209 | N | 93.9 | Very high | 88.4 | Confident | 0 Ų | 0 | 40.8 Ų | 40.8 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.7 | -47.4 | 177.9 | -59.8 | -3.7 | 0 | 0 | 0 | 112.2 | A153 C156 R198 N205 W206 F207 P213 F222 | A153-N209 WeakPolarHBondContact CB-OD1 3.43Å; C156-N209 HydrophobicContact CB-CB 3.92Å; C156-N209 VanDerWaalsContact SG-CB 3.59Å; R198-N209 VanDerWaalsContact CZ-OD1 3.3Å; R198-N209 PolarHBondContact NH1-OD1 3.41Å; R198-N209 VanDerWaalsContact NH1-OD1 3.12Å; R198-N209 PolarHBondContact NH2-OD1 2.99Å; N205-N209 PolarHBondContact O-N 2.99Å; N205-N209 VanDerWaalsContact O-N 3.13Å; N205-N209 PolarHBondContact O-OD1 3.2Å; W206-N209 PolarHBondContact O-N 2.69Å; F207-N209 VanDerWaalsContact C-N 3.3Å; F207-N209 PolarHBondContact O-N 3.44Å; N209-P213 WeakPolarHBondContact O-CD 3.4Å; N209-F222 HydrophobicContact CB-CZ 4.29Å |
| 210 | I | 90.5 | Very high | 88.7 | Confident | 53 Ų | 53 | 39.3 Ų | 39.3 | 27% | 0.272 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -73.7 | -38.6 | -175.5 | -68.7 | -178.8 | 0 | 0 | 0 | 111.6 | S160 W206 F207 I208 P213 | S160-I210 WeakPolarHBondContact OG-CA 3.46Å; S160-I210 WeakPolarHBondContact OG-CG2 3.47Å; S160-I210 PolarHBondContact OG-O 2.77Å; W206-I210 HydrophobicContact CE3-CD1 3.92Å; W206-I210 HydrophobicContact CZ3-CD1 4.41Å; W206-I210 WeakPolarHBondContact O-CG1 3.35Å; W206-I210 PolarHBondContact O-N 2.86Å; F207-I210 PolarHBondContact O-N 3.01Å; I208-I210 PolarHBondContact O-N 3.19Å; I210-P213 VanDerWaalsContact O-CD 3.3Å; I210-P213 WeakPolarHBondContact O-CD 3.25Å; I210-P213 WeakPolarHBondContact O-CG 3.26Å |
| 211 | T | 88.9 | Confident | 89.2 | Confident | 18 Ų | 18 | 39.8 Ų | 39.8 | 11% | 0.11 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -81.7 | -33.7 | -174.3 | 52.6 | 0 | 0 | 0 | 0 | 113.8 | W179 F207 P213 V214 I215 | W179-T211 HydrophobicContact CE3-CG2 4.19Å; W179-T211 HydrophobicContact CZ3-CG2 3.93Å; F207-T211 HydrophobicContact CD1-CG2 4.17Å; F207-T211 HydrophobicContact CD2-CG2 4.07Å; F207-T211 HydrophobicContact CE1-CG2 3.83Å; F207-T211 HydrophobicContact CE2-CG2 3.72Å; F207-T211 HydrophobicContact CG-CG2 4.29Å; F207-T211 HydrophobicContact CZ-CG2 3.6Å; F207-T211 WeakPolarHBondContact O-CB 3.42Å; F207-T211 WeakPolarHBondContact O-CG2 3.38Å; F207-T211 PolarHBondContact O-N 3.02Å; F207-T211 PolarHBondContact O-OG1 3.43Å; T211-P213 VanDerWaalsContact C-CD 3.48Å; T211-V214 WeakPolarHBondContact O-CA 3.44Å; T211-V214 VanDerWaalsContact O-CB 3.3Å; T211-V214 WeakPolarHBondContact O-CB 3.47Å; T211-V214 PolarHBondContact O-N 3.36Å; T211-I215 WeakPolarHBondContact O-CG1 3.36Å; T211-I215 PolarHBondContact O-N 3.24Å; T211-I215 VanDerWaalsContact O-N 3.13Å |
| 212 | S | 92 | Very high | 90 | Very high | 2 Ų | 2 | 36.6 Ų | 36.6 | 1% | 0.014 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -48.6 | -45 | 179.4 | -68 | 0 | 0 | 0 | 0 | 115.4 | I208 V214 I215 N216 V217 F222 | I208-S212 VanDerWaalsContact O-CB 3.22Å; I208-S212 WeakPolarHBondContact O-CB 3.31Å; I208-S212 PolarHBondContact O-N 2.87Å; I208-S212 PolarHBondContact O-OG 3.48Å; S212-V214 VanDerWaalsContact C-N 3.32Å; S212-V214 PolarHBondContact O-N 3.5Å; S212-I215 WeakPolarHBondContact O-CG1 3.43Å; S212-N216 PolarHBondContact O-N 3.18Å; S212-V217 WeakPolarHBondContact O-CB 3.03Å; S212-V217 PolarHBondContact O-N 3.03Å; S212-F222 VanDerWaalsContact OG-CD2 3.32Å; S212-F222 WeakPolarHBondContact OG-CD2 3.43Å; S212-F222 WeakPolarHBondContact OG-CE2 3.46Å |
| 213 | P | 91.1 | Very high | 90.9 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -28.4 | 175.7 | 24.1 | -31.4 | 0 | 0 | 0 | 113.4 | Y157 Y161 N209 I210 T211 N216 | Y157-P213 HydrophobicContact CD1-CB 4.2Å; Y157-P213 HydrophobicContact CD1-CG 4.48Å; Y157-P213 HydrophobicContact CD2-CB 4.16Å; Y157-P213 VanDerWaalsContact CD2-CD 3.45Å; Y157-P213 HydrophobicContact CD2-CG 4.1Å; Y157-P213 HydrophobicContact CE1-CB 3.78Å; Y157-P213 HydrophobicContact CE2-CB 3.77Å; Y157-P213 HydrophobicContact CE2-CG 4.17Å; Y157-P213 HydrophobicContact CG-CB 4.34Å; Y157-P213 HydrophobicContact CG-CG 4.23Å; Y161-P213 HydrophobicContact CD2-CB 3.86Å; Y161-P213 HydrophobicContact CG-CB 4.36Å; N209-P213 WeakPolarHBondContact O-CD 3.4Å; I210-P213 VanDerWaalsContact O-CD 3.3Å; I210-P213 WeakPolarHBondContact O-CD 3.25Å; I210-P213 WeakPolarHBondContact O-CG 3.26Å; T211-P213 VanDerWaalsContact C-CD 3.48Å; P213-N216 PolarHBondContact O-N 3.07Å |
| 214 | V | 86.6 | Confident | 91.5 | Very high | 3 Ų | 3 | 38.6 Ų | 38.6 | 2% | 0.018 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -70.1 | -37.2 | 179.9 | 178.3 | 0 | 0 | 0 | 0 | 110.8 | V168 Y169 A176 T211 S212 N216 | V168-V214 HydrophobicContact CB-CG2 4.13Å; V168-V214 HydrophobicContact CG1-CG1 3.81Å; V168-V214 HydrophobicContact CG1-CG2 4.06Å; V168-V214 HydrophobicContact CG2-CG2 4.3Å; Y169-V214 HydrophobicContact CD2-CG1 4.4Å; Y169-V214 HydrophobicContact CE2-CG1 3.85Å; Y169-V214 PolarHBondContact OH-O 3.22Å; A176-V214 HydrophobicContact CB-CG1 3.77Å; T211-V214 WeakPolarHBondContact O-CA 3.44Å; T211-V214 VanDerWaalsContact O-CB 3.3Å; T211-V214 WeakPolarHBondContact O-CB 3.47Å; T211-V214 PolarHBondContact O-N 3.36Å; S212-V214 VanDerWaalsContact C-N 3.32Å; S212-V214 PolarHBondContact O-N 3.5Å; V214-N216 VanDerWaalsContact C-N 3.27Å; V214-N216 PolarHBondContact O-N 3.21Å |
| 215 | I | 87 | Confident | 91.9 | Very high | 11 Ų | 11 | 35.5 Ų | 35.5 | 6% | 0.056 | 19% | 0.19 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.4 | 14.3 | 176.4 | 60.9 | 169.2 | 0 | 0 | 0 | 113 | W179 V183 R187 T211 S212 V217 | W179-I215 HydrophobicContact CB-CG2 3.93Å; V183-I215 HydrophobicContact CB-CD1 3.96Å; V183-I215 HydrophobicContact CG1-CD1 4.01Å; V183-I215 HydrophobicContact CG2-CD1 3.43Å; V183-I215 VanDerWaalsContact CG2-CD1 3.43Å; R187-I215 PolarHBondContact NH2-O 3.46Å; T211-I215 WeakPolarHBondContact O-CG1 3.36Å; T211-I215 PolarHBondContact O-N 3.24Å; T211-I215 VanDerWaalsContact O-N 3.13Å; S212-I215 WeakPolarHBondContact O-CG1 3.43Å; I215-V217 HydrophobicContact CD1-CG2 3.82Å; I215-V217 HydrophobicContact CG1-CG2 3.88Å; I215-V217 PolarHBondContact O-N 3.38Å |
| 216 | N | 86.8 | Confident | 92.4 | Very high | 70 Ų | 70 | 32.4 Ų | 32.4 | 37% | 0.374 | 17% | 0.174 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 58.4 | 38.3 | 176.5 | -51.6 | -69.6 | 0 | 0 | 0 | 114.7 | R165 R187 S212 P213 V214 | R165-N216 PolarHBondContact NH2-OD1 3.41Å; R187-N216 PolarHBondContact NH1-O 3.05Å; S212-N216 PolarHBondContact O-N 3.18Å; P213-N216 PolarHBondContact O-N 3.07Å; V214-N216 VanDerWaalsContact C-N 3.27Å; V214-N216 PolarHBondContact O-N 3.21Å |
| 217 | V | 90.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 28.6 Ų | 28.6 | 0% | 0 | 16% | 0.161 | C | C | . | . | trans | -71.8 | 127.5 | 168 | 174.2 | 0 | 0 | 0 | 0 | 108.7 | Y157 V183 L190 I194 S212 I215 V221 F222 | Y157-V217 WeakPolarHBondContact CE2-O 3.39Å; Y157-V217 PolarHBondContact OH-O 2.9Å; V183-V217 HydrophobicContact CG1-CG2 4.39Å; L190-V217 HydrophobicContact CD1-CG2 4.21Å; L190-V217 HydrophobicContact CD2-CB 4.34Å; L190-V217 HydrophobicContact CD2-CG1 4Å; L190-V217 HydrophobicContact CD2-CG2 4.17Å; L190-V217 HydrophobicContact CG-CG1 4.36Å; L190-V217 HydrophobicContact CG-CG2 4.43Å; I194-V217 HydrophobicContact CD1-CG1 4.33Å; I194-V217 HydrophobicContact CD1-CG2 4.39Å; I194-V217 HydrophobicContact CG1-CG1 4.34Å; S212-V217 WeakPolarHBondContact O-CB 3.03Å; S212-V217 PolarHBondContact O-N 3.03Å; I215-V217 HydrophobicContact CD1-CG2 3.82Å; I215-V217 HydrophobicContact CG1-CG2 3.88Å; I215-V217 PolarHBondContact O-N 3.38Å; V217-V221 HydrophobicContact CG1-CB 4.48Å; V217-V221 HydrophobicContact CG1-CG1 4.12Å; V217-F222 HydrophobicContact CG1-CB 3.99Å | ||
| 218 | P | 93.5 | Very high | 93.1 | Very high | 65 Ų | 65 | 30.8 Ų | 30.8 | 42% | 0.422 | 17% | 0.174 | S | C | . | . | trans | -61.8 | 140.4 | 176.9 | -21.9 | 33.4 | 0 | 0 | 0 | 112.3 | G220 V221 F222 | P218-G220 VanDerWaalsContact C-N 3.33Å; P218-G220 PolarHBondContact O-N 3.31Å; P218-V221 HydrophobicContact CB-CB 4.31Å; P218-V221 HydrophobicContact CB-CG2 4.2Å; P218-V221 HydrophobicContact CG-CG2 4.3Å; P218-V221 WeakPolarHBondContact O-CB 3.32Å; P218-V221 PolarHBondContact O-N 3.45Å; P218-V221 VanDerWaalsContact O-N 3.16Å; P218-F222 PolarHBondContact O-N 2.83Å | ||
| 219 | L | 94.3 | Very high | 93.2 | Very high | 69 Ų | 69 | 30.6 Ų | 30.6 | 36% | 0.361 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -57.8 | -41.1 | -176.7 | -178.8 | 62.3 | 0 | 0 | 0 | 113.1 | Y157 M158 V221 F222 F223 | Y157-L219 HydrophobicContact CD1-CD1 3.72Å; Y157-L219 HydrophobicContact CE1-CB 4.41Å; Y157-L219 HydrophobicContact CE1-CD1 4.09Å; Y157-L219 HydrophobicContact CG-CD1 4.03Å; M158-L219 HydrophobicContact SD-CD2 4.46Å; L219-V221 PolarHBondContact O-N 2.85Å; L219-F222 HydrophobicContact CD1-CD1 4.44Å; L219-F222 PolarHBondContact O-N 3.41Å; L219-F223 WeakPolarHBondContact O-CB 3.36Å; L219-F223 PolarHBondContact O-N 2.99Å |
| 220 | G | 95.4 | Very high | 93.3 | Very high | 46 Ų | 46 | 31 Ų | 31 | 47% | 0.474 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -63.4 | -41.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | P218 F223 I224 | P218-G220 VanDerWaalsContact C-N 3.33Å; P218-G220 PolarHBondContact O-N 3.31Å; G220-F223 PolarHBondContact O-N 3.27Å; G220-I224 WeakPolarHBondContact O-CG1 3.22Å; G220-I224 PolarHBondContact O-N 3.35Å |
| 221 | V | 94.7 | Very high | 93.5 | Very high | 31 Ų | 31 | 29.7 Ų | 29.7 | 19% | 0.188 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62.7 | -45.2 | 174.6 | 165.6 | 0 | 0 | 0 | 0 | 110.6 | L190 I191 V217 P218 L219 G225 | L190-V221 HydrophobicContact CB-CG1 4.02Å; L190-V221 HydrophobicContact CD2-CG1 4Å; L190-V221 HydrophobicContact CG-CG1 3.85Å; I191-V221 HydrophobicContact CB-CG1 4.42Å; I191-V221 HydrophobicContact CD1-CG2 4.39Å; I191-V221 HydrophobicContact CG1-CB 4.1Å; I191-V221 HydrophobicContact CG1-CG1 3.62Å; I191-V221 HydrophobicContact CG1-CG2 3.96Å; V217-V221 HydrophobicContact CG1-CB 4.48Å; V217-V221 HydrophobicContact CG1-CG1 4.12Å; P218-V221 HydrophobicContact CB-CB 4.31Å; P218-V221 HydrophobicContact CB-CG2 4.2Å; P218-V221 HydrophobicContact CG-CG2 4.3Å; P218-V221 WeakPolarHBondContact O-CB 3.32Å; P218-V221 PolarHBondContact O-N 3.45Å; P218-V221 VanDerWaalsContact O-N 3.16Å; L219-V221 PolarHBondContact O-N 2.85Å; V221-G225 PolarHBondContact O-N 3.04Å |
| 222 | F | 95.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.2 | -43.6 | 177.5 | 175 | -93.1 | 0 | 0 | 0 | 112.4 | A153 Y157 I208 N209 S212 V217 P218 L219 T226 | A153-F222 HydrophobicContact CB-CE1 3.84Å; A153-F222 HydrophobicContact CB-CZ 3.95Å; A153-F222 WeakPolarHBondContact O-CE1 3.3Å; Y157-F222 HydrophobicContact CD2-CB 4.42Å; Y157-F222 HydrophobicContact CD2-CD1 4Å; Y157-F222 HydrophobicContact CD2-CD2 4.11Å; Y157-F222 HydrophobicContact CD2-CE1 4.27Å; Y157-F222 HydrophobicContact CD2-CE2 4.33Å; Y157-F222 AromaticContact CD2-CG 3.91Å; Y157-F222 HydrophobicContact CD2-CG 3.91Å; Y157-F222 HydrophobicContact CD2-CZ 4.41Å; Y157-F222 HydrophobicContact CE2-CB 4.46Å; Y157-F222 HydrophobicContact CE2-CG 4.4Å; Y157-F222 HydrophobicContact CG-CD1 4.41Å; Y157-F222 HydrophobicContact CG-CE1 4.49Å; I208-F222 HydrophobicContact CG2-CE2 4.22Å; N209-F222 HydrophobicContact CB-CZ 4.29Å; S212-F222 VanDerWaalsContact OG-CD2 3.32Å; S212-F222 WeakPolarHBondContact OG-CD2 3.43Å; S212-F222 WeakPolarHBondContact OG-CE2 3.46Å; V217-F222 HydrophobicContact CG1-CB 3.99Å; P218-F222 PolarHBondContact O-N 2.83Å; L219-F222 HydrophobicContact CD1-CD1 4.44Å; L219-F222 PolarHBondContact O-N 3.41Å; F222-T226 WeakPolarHBondContact O-CB 3.35Å; F222-T226 PolarHBondContact O-N 3.37Å; F222-T226 PolarHBondContact O-OG1 3.29Å |
| 223 | F | 97.6 | Very high | 93.7 | Very high | 58 Ų | 58 | 34.6 Ų | 34.6 | 25% | 0.254 | 20% | 0.204 | S | C | . | . | H | α-helix | trans | -63.7 | -52.8 | 178.6 | 174.9 | -97.5 | 0 | 0 | 0 | 111.3 | L147 L151 L219 G220 G225 T226 F227 | L147-F223 HydrophobicContact CD1-CZ 4.36Å; L151-F223 HydrophobicContact CD2-CE2 3.92Å; L151-F223 HydrophobicContact CG-CE2 4.09Å; L219-F223 WeakPolarHBondContact O-CB 3.36Å; L219-F223 PolarHBondContact O-N 2.99Å; G220-F223 PolarHBondContact O-N 3.27Å; F223-G225 PolarHBondContact O-N 2.85Å; F223-T226 PolarHBondContact O-N 3.28Å; F223-F227 HydrophobicContact CZ-CD2 4.5Å; F223-F227 VanDerWaalsContact O-CB 3.3Å; F223-F227 WeakPolarHBondContact O-CB 3.5Å; F223-F227 PolarHBondContact O-N 3.09Å |
| 224 | I | 97.3 | Very high | 93.9 | Very high | 81 Ų | 81 | 35 Ų | 35 | 42% | 0.415 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -62.4 | -45.6 | -179.9 | -65.5 | 169.6 | 0 | 0 | 0 | 110.3 | I191 G220 T226 F227 L228 | I191-I224 HydrophobicContact CG2-CG2 4.38Å; G220-I224 WeakPolarHBondContact O-CG1 3.22Å; G220-I224 PolarHBondContact O-N 3.35Å; I224-T226 VanDerWaalsContact C-N 3.3Å; I224-T226 PolarHBondContact O-N 2.94Å; I224-F227 PolarHBondContact O-N 3.47Å; I224-L228 HydrophobicContact CG2-CD1 3.96Å; I224-L228 HydrophobicContact CG2-CG 4.48Å; I224-L228 WeakPolarHBondContact O-CG 3.27Å; I224-L228 PolarHBondContact O-N 3.21Å |
| 225 | G | 96.1 | Very high | 94.3 | Very high | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.7 | -37 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | I195 V221 F223 G229 | I195-G225 WeakPolarHBondContact CG1-O 3.1Å; V221-G225 PolarHBondContact O-N 3.04Å; F223-G225 PolarHBondContact O-N 2.85Å; G225-G229 WeakPolarHBondContact O-CA 3.38Å; G225-G229 PolarHBondContact O-N 2.98Å |
| 226 | T | 96.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 41.5 Ų | 41.5 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -71.2 | -45.6 | 174.5 | -60.1 | 0 | 0 | 0 | 0 | 111.3 | A153 R198 F222 F223 I224 L228 G229 V230 | A153-T226 HydrophobicContact CB-CG2 4.03Å; R198-T226 PolarHBondContact NE-OG1 3.23Å; R198-T226 PolarHBondContact NH2-OG1 3.38Å; F222-T226 WeakPolarHBondContact O-CB 3.35Å; F222-T226 PolarHBondContact O-N 3.37Å; F222-T226 PolarHBondContact O-OG1 3.29Å; F223-T226 PolarHBondContact O-N 3.28Å; I224-T226 VanDerWaalsContact C-N 3.3Å; I224-T226 PolarHBondContact O-N 2.94Å; T226-L228 VanDerWaalsContact C-N 3.31Å; T226-L228 PolarHBondContact O-N 3.41Å; T226-G229 PolarHBondContact O-N 3.25Å; T226-V230 HydrophobicContact CG2-CG1 4.05Å; T226-V230 WeakPolarHBondContact O-CG1 3.49Å; T226-V230 WeakPolarHBondContact O-CG2 3.39Å; T226-V230 PolarHBondContact O-N 2.95Å |
| 227 | F | 97.1 | Very high | 94.8 | Very high | 50 Ų | 50 | 38.8 Ų | 38.8 | 22% | 0.219 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -56.8 | -43.9 | 178.9 | -177.8 | -88.5 | 0 | 0 | 0 | 111.9 | F143 C146 L147 F223 I224 | F143-F227 HydrophobicContact CD2-CZ 4.03Å; F143-F227 HydrophobicContact CE2-CE2 4.41Å; F143-F227 HydrophobicContact CE2-CZ 4.06Å; C146-F227 VanDerWaalsContact C-CD2 3.49Å; C146-F227 HydrophobicContact CB-CD1 4.47Å; C146-F227 HydrophobicContact CB-CD2 3.76Å; C146-F227 HydrophobicContact CB-CE1 4.38Å; C146-F227 HydrophobicContact CB-CE2 3.67Å; C146-F227 HydrophobicContact CB-CG 4.17Å; C146-F227 HydrophobicContact CB-CZ 3.99Å; C146-F227 WeakPolarHBondContact CB-O 3.49Å; C146-F227 WeakPolarHBondContact O-CD2 3.26Å; C146-F227 PolarHBondContact SG-O 3.25Å; C146-F227 VanDerWaalsContact SG-O 3.4Å; L147-F227 HydrophobicContact CB-CE2 4.1Å; F223-F227 HydrophobicContact CZ-CD2 4.5Å; F223-F227 VanDerWaalsContact O-CB 3.3Å; F223-F227 WeakPolarHBondContact O-CB 3.5Å; F223-F227 PolarHBondContact O-N 3.09Å; I224-F227 PolarHBondContact O-N 3.47Å |
| 228 | L | 96.8 | Very high | 95 | Very high | 86 Ų | 86 | 38.8 Ų | 38.8 | 45% | 0.45 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -78.7 | -42.7 | 177.7 | -63.7 | 176.9 | 0 | 0 | 0 | 112.3 | I195 I224 T226 V230 A231 | I195-L228 HydrophobicContact CD1-CB 3.99Å; I195-L228 HydrophobicContact CD1-CD1 3.97Å; I195-L228 HydrophobicContact CG1-CB 4.14Å; I224-L228 HydrophobicContact CG2-CD1 3.96Å; I224-L228 HydrophobicContact CG2-CG 4.48Å; I224-L228 WeakPolarHBondContact O-CG 3.27Å; I224-L228 PolarHBondContact O-N 3.21Å; T226-L228 VanDerWaalsContact C-N 3.31Å; T226-L228 PolarHBondContact O-N 3.41Å; L228-V230 VanDerWaalsContact C-N 3.34Å; L228-V230 PolarHBondContact O-N 2.89Å; L228-A231 WeakPolarHBondContact O-CB 3.21Å; L228-A231 PolarHBondContact O-N 3.35Å |
| 229 | G | 94.8 | Very high | 95 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -70.6 | -24.6 | -173.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | R198 I199 G225 T226 A231 | R198-G229 CarbonylContact C-O 3.58Å; I199-G229 WeakPolarHBondContact CG1-O 3.47Å; G225-G229 WeakPolarHBondContact O-CA 3.38Å; G225-G229 PolarHBondContact O-N 2.98Å; T226-G229 PolarHBondContact O-N 3.25Å; G229-A231 VanDerWaalsContact C-N 3.34Å |
| 230 | V | 95.4 | Very high | 94.8 | Very high | 7 Ų | 7 | 35.7 Ų | 35.7 | 4% | 0.042 | 21% | 0.211 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -83.3 | -10.5 | 174.7 | -59.3 | 0 | 0 | 0 | 0 | 113.4 | C146 T226 L228 P233 S234 | C146-V230 HydrophobicContact CB-CG2 4.3Å; T226-V230 HydrophobicContact CG2-CG1 4.05Å; T226-V230 WeakPolarHBondContact O-CG1 3.49Å; T226-V230 WeakPolarHBondContact O-CG2 3.39Å; T226-V230 PolarHBondContact O-N 2.95Å; L228-V230 VanDerWaalsContact C-N 3.34Å; L228-V230 PolarHBondContact O-N 2.89Å; V230-P233 VanDerWaalsContact O-CD 3.29Å; V230-P233 WeakPolarHBondContact O-CD 3.4Å; V230-P233 WeakPolarHBondContact O-CG 3.41Å; V230-S234 WeakPolarHBondContact O-CB 3.3Å; V230-S234 PolarHBondContact O-N 3.3Å; V230-S234 PolarHBondContact O-OG 3.3Å |
| 231 | A | 95.4 | Very high | 94.6 | Very high | 26 Ų | 26 | 33.5 Ų | 33.5 | 22% | 0.215 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -61.6 | -45.2 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L142 L228 G229 S234 F235 | L142-A231 HydrophobicContact CD1-CB 4.26Å; L228-A231 WeakPolarHBondContact O-CB 3.21Å; L228-A231 PolarHBondContact O-N 3.35Å; G229-A231 VanDerWaalsContact C-N 3.34Å; A231-S234 PolarHBondContact O-N 3.3Å; A231-F235 PolarHBondContact O-N 3.33Å |
| 232 | P | 93.4 | Very high | 94.5 | Very high | 60 Ų | 60 | 33.4 Ų | 33.4 | 39% | 0.39 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -61.3 | -50.2 | 178.6 | -25 | 37.2 | 0 | 0 | 0 | 115.1 | I199 S234 F235 | I199-P232 HydrophobicContact CD1-CG 3.97Å; I199-P232 HydrophobicContact CG1-CG 3.91Å; P232-S234 VanDerWaalsContact C-N 3.28Å; P232-S234 PolarHBondContact O-N 2.85Å; P232-F235 VanDerWaalsContact O-CB 3.31Å; P232-F235 WeakPolarHBondContact O-CB 3.18Å; P232-F235 PolarHBondContact O-N 2.92Å |
| 233 | P | 91.6 | Very high | 94.2 | Very high | 63 Ų | 63 | 34 Ų | 34 | 41% | 0.409 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -65.8 | -33.3 | 175.3 | 24 | -32.2 | 0 | 0 | 0 | 112.2 | V230 F235 V236 A237 | V230-P233 VanDerWaalsContact O-CD 3.29Å; V230-P233 WeakPolarHBondContact O-CD 3.4Å; V230-P233 WeakPolarHBondContact O-CG 3.41Å; P233-F235 VanDerWaalsContact C-N 3.32Å; P233-F235 PolarHBondContact O-N 2.86Å; P233-V236 PolarHBondContact O-N 3.33Å; P233-A237 PolarHBondContact O-N 2.94Å |
| 234 | S | 94.3 | Very high | 93.7 | Very high | 8 Ų | 8 | 32.7 Ų | 32.7 | 6% | 0.056 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -66.1 | -35.1 | 176.6 | -58.5 | 0 | 0 | 0 | 0 | 112.3 | V145 V230 A231 P232 V236 A237 I238 | V145-S234 WeakPolarHBondContact CG1-OG 3.39Å; V230-S234 WeakPolarHBondContact O-CB 3.3Å; V230-S234 PolarHBondContact O-N 3.3Å; V230-S234 PolarHBondContact O-OG 3.3Å; A231-S234 PolarHBondContact O-N 3.3Å; P232-S234 VanDerWaalsContact C-N 3.28Å; P232-S234 PolarHBondContact O-N 2.85Å; S234-V236 VanDerWaalsContact C-N 3.27Å; S234-V236 PolarHBondContact O-N 3.41Å; S234-A237 PolarHBondContact O-N 3.02Å; S234-I238 WeakPolarHBondContact O-CB 3.37Å; S234-I238 WeakPolarHBondContact O-CD1 3.44Å; S234-I238 WeakPolarHBondContact O-CG1 3.31Å; S234-I238 PolarHBondContact O-N 3.39Å |
| 235 | F | 94.9 | Very high | 93.3 | Very high | 104 Ų | 104 | 33.4 Ų | 33.4 | 46% | 0.456 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -54.1 | -45.3 | 174.3 | -173.6 | -79.2 | 0 | 0 | 0 | 111.2 | F138 A231 P232 P233 N239 | F138-F235 AromaticContact CE1-CD2 3.93Å; F138-F235 HydrophobicContact CE1-CD2 3.93Å; F138-F235 AromaticContact CE1-CE2 3.82Å; F138-F235 HydrophobicContact CE1-CE2 3.82Å; F138-F235 HydrophobicContact CE2-CD2 4.21Å; F138-F235 HydrophobicContact CE2-CE2 4.26Å; F138-F235 HydrophobicContact CZ-CB 4.49Å; F138-F235 AromaticContact CZ-CD2 3.26Å; F138-F235 HydrophobicContact CZ-CD2 3.26Å; F138-F235 AromaticContact CZ-CE2 3.4Å; F138-F235 HydrophobicContact CZ-CE2 3.4Å; F138-F235 AromaticContact CZ-CG 3.9Å; F138-F235 HydrophobicContact CZ-CG 3.9Å; F138-F235 HydrophobicContact CZ-CZ 4.18Å; A231-F235 PolarHBondContact O-N 3.33Å; P232-F235 VanDerWaalsContact O-CB 3.31Å; P232-F235 WeakPolarHBondContact O-CB 3.18Å; P232-F235 PolarHBondContact O-N 2.92Å; P233-F235 VanDerWaalsContact C-N 3.32Å; P233-F235 PolarHBondContact O-N 2.86Å; F235-N239 WeakPolarHBondContact CD1-ND2 3.3Å; F235-N239 WeakPolarHBondContact CE1-ND2 3.29Å; F235-N239 WeakPolarHBondContact CZ-ND2 3.48Å; F235-N239 WeakPolarHBondContact O-CB 3.45Å; F235-N239 PolarHBondContact O-N 3.3Å; F235-N239 PolarHBondContact O-ND2 3.21Å |
| 236 | V | 92.9 | Very high | 93 | Very high | 48 Ų | 48 | 38.9 Ų | 38.9 | 29% | 0.291 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -65.2 | -48.2 | 178.8 | 176.7 | 0 | 0 | 0 | 0 | 110.9 | P233 S234 I238 N239 A240 L265 | P233-V236 PolarHBondContact O-N 3.33Å; S234-V236 VanDerWaalsContact C-N 3.27Å; S234-V236 PolarHBondContact O-N 3.41Å; V236-I238 PolarHBondContact O-N 3.37Å; V236-N239 PolarHBondContact O-N 3.03Å; V236-A240 PolarHBondContact O-N 3.43Å; V236-L265 HydrophobicContact CG1-CD2 4.21Å; V236-L265 HydrophobicContact CG2-CD2 4.34Å |
| 237 | A | 92.6 | Very high | 92.4 | Very high | 12 Ų | 12 | 40.4 Ų | 40.4 | 10% | 0.099 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -61.8 | -45.7 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | I130 P233 S234 N239 A240 G241 | I130-A237 WeakPolarHBondContact CA-O 3.23Å; I130-A237 HydrophobicContact CG1-CB 4.04Å; P233-A237 PolarHBondContact O-N 2.94Å; S234-A237 PolarHBondContact O-N 3.02Å; A237-N239 VanDerWaalsContact C-N 3.34Å; A237-N239 PolarHBondContact O-N 2.8Å; A237-A240 WeakPolarHBondContact O-CB 3.36Å; A237-A240 PolarHBondContact O-N 2.92Å; A237-G241 PolarHBondContact O-N 3.46Å; A237-G241 VanDerWaalsContact O-N 3.14Å |
| 238 | I | 95.6 | Very high | 91.9 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.6 | -41.6 | 178.7 | -66.3 | 163.5 | 0 | 0 | 0 | 110.2 | S129 F138 A141 L142 V145 S234 V236 A240 G241 T242 | S129-I238 WeakPolarHBondContact O-CG1 3.44Å; F138-I238 HydrophobicContact CD2-CB 4.37Å; F138-I238 HydrophobicContact CD2-CG2 3.45Å; F138-I238 VanDerWaalsContact CD2-CG2 3.45Å; F138-I238 HydrophobicContact CE2-CB 4Å; F138-I238 HydrophobicContact CE2-CG2 3.57Å; F138-I238 HydrophobicContact CG-CG2 4.38Å; A141-I238 HydrophobicContact CB-CD1 4.18Å; A141-I238 HydrophobicContact CB-CG1 4.32Å; A141-I238 HydrophobicContact CB-CG2 3.8Å; L142-I238 VanDerWaalsContact CA-CD1 3.43Å; L142-I238 HydrophobicContact CB-CD1 3.94Å; L142-I238 HydrophobicContact CD1-CD1 3.95Å; V145-I238 HydrophobicContact CB-CD1 4.48Å; V145-I238 HydrophobicContact CG2-CD1 4.15Å; V145-I238 HydrophobicContact CG2-CG1 4.4Å; S234-I238 WeakPolarHBondContact O-CB 3.37Å; S234-I238 WeakPolarHBondContact O-CD1 3.44Å; S234-I238 WeakPolarHBondContact O-CG1 3.31Å; S234-I238 PolarHBondContact O-N 3.39Å; V236-I238 PolarHBondContact O-N 3.37Å; I238-A240 VanDerWaalsContact C-N 3.31Å; I238-A240 PolarHBondContact O-N 3.3Å; I238-G241 WeakPolarHBondContact O-CA 3.45Å; I238-G241 PolarHBondContact O-N 3.37Å; I238-G241 VanDerWaalsContact O-N 3.13Å; I238-T242 PolarHBondContact O-N 3.07Å; I238-T242 PolarHBondContact O-OG1 2.94Å; I238-T242 VanDerWaalsContact O-OG1 3.07Å |
| 239 | N | 91.8 | Very high | 91.1 | Very high | 34 Ų | 34 | 40.2 Ų | 40.2 | 18% | 0.182 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.4 | -34.1 | 176.2 | -84.1 | -65.3 | 0 | 0 | 0 | 113.2 | F138 F235 V236 A237 G241 T242 T243 L265 | F138-N239 WeakPolarHBondContact CE2-ND2 3.34Å; F235-N239 WeakPolarHBondContact CD1-ND2 3.3Å; F235-N239 WeakPolarHBondContact CE1-ND2 3.29Å; F235-N239 WeakPolarHBondContact CZ-ND2 3.48Å; F235-N239 WeakPolarHBondContact O-CB 3.45Å; F235-N239 PolarHBondContact O-N 3.3Å; F235-N239 PolarHBondContact O-ND2 3.21Å; V236-N239 PolarHBondContact O-N 3.03Å; A237-N239 VanDerWaalsContact C-N 3.34Å; A237-N239 PolarHBondContact O-N 2.8Å; N239-G241 VanDerWaalsContact C-N 3.32Å; N239-T242 PolarHBondContact O-N 2.72Å; N239-T243 WeakPolarHBondContact O-CB 3.33Å; N239-T243 PolarHBondContact O-N 3.27Å; N239-T243 PolarHBondContact O-OG1 3.02Å; N239-L265 HydrophobicContact CB-CD1 3.98Å |
| 240 | A | 90.5 | Very high | 90 | Very high | 36 Ų | 36 | 43.3 Ų | 43.3 | 30% | 0.298 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -61 | -43.9 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | V236 A237 I238 T243 L244 | V236-A240 PolarHBondContact O-N 3.43Å; A237-A240 WeakPolarHBondContact O-CB 3.36Å; A237-A240 PolarHBondContact O-N 2.92Å; I238-A240 VanDerWaalsContact C-N 3.31Å; I238-A240 PolarHBondContact O-N 3.3Å; A240-T243 PolarHBondContact O-N 2.86Å; A240-L244 PolarHBondContact O-N 2.93Å |
| 241 | G | 92.1 | Very high | 88.5 | Confident | 0 Ų | 0 | 44.9 Ų | 44.9 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -60.7 | -48.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | I130 A237 I238 N239 T243 L244 Y245 | I130-G241 WeakPolarHBondContact O-CA 3.22Å; A237-G241 PolarHBondContact O-N 3.46Å; A237-G241 VanDerWaalsContact O-N 3.14Å; I238-G241 WeakPolarHBondContact O-CA 3.45Å; I238-G241 PolarHBondContact O-N 3.37Å; I238-G241 VanDerWaalsContact O-N 3.13Å; N239-G241 VanDerWaalsContact C-N 3.32Å; G241-T243 PolarHBondContact O-N 2.98Å; G241-L244 WeakPolarHBondContact O-CB 3.46Å; G241-L244 PolarHBondContact O-N 2.84Å; G241-L244 VanDerWaalsContact O-N 3.16Å; G241-Y245 PolarHBondContact O-N 3.41Å |
| 242 | T | 91.3 | Very high | 86.5 | Confident | 29 Ų | 29 | 52.9 Ų | 52.9 | 18% | 0.178 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59 | -38.5 | 176.1 | -56 | 0 | 0 | 0 | 0 | 111.5 | G133 I238 N239 Y245 K246 | G133-T242 WeakPolarHBondContact O-CA 3.31Å; G133-T242 PolarHBondContact O-N 3.17Å; G133-T242 PolarHBondContact O-OG1 3.32Å; I238-T242 PolarHBondContact O-N 3.07Å; I238-T242 PolarHBondContact O-OG1 2.94Å; I238-T242 VanDerWaalsContact O-OG1 3.07Å; N239-T242 PolarHBondContact O-N 2.72Å; T242-Y245 PolarHBondContact O-N 2.98Å; T242-K246 WeakPolarHBondContact O-CG 3.24Å; T242-K246 PolarHBondContact O-N 3.36Å |
| 243 | T | 89.7 | Confident | 84.6 | Confident | 12 Ų | 12 | 54 Ų | 54 | 7% | 0.074 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -70.4 | -40.7 | 178 | -53 | 0 | 0 | 0 | 0 | 111 | N239 A240 G241 Y245 K246 L247 L262 | N239-T243 WeakPolarHBondContact O-CB 3.33Å; N239-T243 PolarHBondContact O-N 3.27Å; N239-T243 PolarHBondContact O-OG1 3.02Å; A240-T243 PolarHBondContact O-N 2.86Å; G241-T243 PolarHBondContact O-N 2.98Å; T243-Y245 VanDerWaalsContact C-N 3.32Å; T243-Y245 PolarHBondContact O-N 2.91Å; T243-K246 PolarHBondContact O-N 3.44Å; T243-L247 HydrophobicContact CG2-CD1 4.3Å; T243-L247 HydrophobicContact CG2-CG 4.45Å; T243-L247 VanDerWaalsContact O-CG 3.32Å; T243-L247 WeakPolarHBondContact O-CG 3.49Å; T243-L247 PolarHBondContact O-N 2.88Å; T243-L262 HydrophobicContact CG2-CD1 3.44Å; T243-L262 VanDerWaalsContact CG2-CD1 3.44Å |
| 244 | L | 88.4 | Confident | 82.9 | Confident | 30 Ų | 30 | 53.9 Ų | 53.9 | 16% | 0.157 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -58.8 | -42.9 | 172.8 | -177.5 | 65.7 | 0 | 0 | 0 | 111.7 | M85 A88 K89 Y134 A240 G241 L247 T248 | M85-L244 HydrophobicContact CG-CD1 4.27Å; A88-L244 HydrophobicContact CB-CD1 4.33Å; A88-L244 HydrophobicContact CB-CD2 3.77Å; K89-L244 HydrophobicContact CG-CD1 3.72Å; Y134-L244 HydrophobicContact CD2-CB 4.15Å; Y134-L244 HydrophobicContact CD2-CD2 4Å; Y134-L244 HydrophobicContact CD2-CG 3.91Å; Y134-L244 HydrophobicContact CE2-CD2 4.4Å; Y134-L244 HydrophobicContact CE2-CG 4.05Å; A240-L244 PolarHBondContact O-N 2.93Å; G241-L244 WeakPolarHBondContact O-CB 3.46Å; G241-L244 PolarHBondContact O-N 2.84Å; G241-L244 VanDerWaalsContact O-N 3.16Å; L244-L247 PolarHBondContact O-N 3.16Å; L244-T248 PolarHBondContact O-N 2.91Å; L244-T248 PolarHBondContact O-OG1 2.92Å |
| 245 | Y | 89.1 | Confident | 81.3 | Confident | 97 Ų | 97 | 56.4 Ų | 56.4 | 38% | 0.38 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -58.9 | -48.4 | 173.9 | 175.8 | -98.3 | 0 | 0 | 0 | 111.7 | Y134 G241 T242 T243 L247 T248 T249 | Y134-Y245 HydrophobicContact CD1-CD2 4.06Å; Y134-Y245 AromaticContact CE1-CD2 3.72Å; Y134-Y245 HydrophobicContact CE1-CD2 3.72Å; Y134-Y245 HydrophobicContact CE1-CE2 4.5Å; Y134-Y245 VanDerWaalsContact CE2-CA 3.42Å; Y134-Y245 HydrophobicContact CE2-CD2 4.3Å; Y134-Y245 HydrophobicContact CG-CD2 4.44Å; Y134-Y245 AromaticContact CZ-CD2 3.85Å; G241-Y245 PolarHBondContact O-N 3.41Å; T242-Y245 PolarHBondContact O-N 2.98Å; T243-Y245 VanDerWaalsContact C-N 3.32Å; T243-Y245 PolarHBondContact O-N 2.91Å; Y245-L247 VanDerWaalsContact C-N 3.34Å; Y245-L247 PolarHBondContact O-N 3.32Å; Y245-T248 WeakPolarHBondContact O-CB 3.4Å; Y245-T248 PolarHBondContact O-N 3.13Å; Y245-T249 PolarHBondContact O-N 3.3Å; Y245-T249 PolarHBondContact O-OG1 3.04Å |
| 246 | K | 87.9 | Confident | 80.1 | Confident | 115 Ų | 115 | 61.9 Ų | 61.9 | 50% | 0.5 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.5 | -44.1 | 176.7 | -71.3 | 172.8 | -179.3 | 177.3 | 0 | 112.4 | T242 T243 T248 T249 A250 | T242-K246 WeakPolarHBondContact O-CG 3.24Å; T242-K246 PolarHBondContact O-N 3.36Å; T243-K246 PolarHBondContact O-N 3.44Å; K246-T248 PolarHBondContact O-N 3.14Å; K246-T249 PolarHBondContact O-N 3.2Å; K246-A250 WeakPolarHBondContact O-CB 3.03Å; K246-A250 PolarHBondContact O-N 3.41Å |
| 247 | L | 85 | Confident | 78.6 | Confident | 32 Ų | 32 | 65.3 Ų | 65.3 | 17% | 0.168 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -66.5 | -22.5 | 177.3 | -68.8 | 173.4 | 0 | 0 | 0 | 113.2 | M85 T243 L244 Y245 V254 | M85-L247 HydrophobicContact SD-CD1 4.44Å; T243-L247 HydrophobicContact CG2-CD1 4.3Å; T243-L247 HydrophobicContact CG2-CG 4.45Å; T243-L247 VanDerWaalsContact O-CG 3.32Å; T243-L247 WeakPolarHBondContact O-CG 3.49Å; T243-L247 PolarHBondContact O-N 2.88Å; L244-L247 PolarHBondContact O-N 3.16Å; Y245-L247 VanDerWaalsContact C-N 3.34Å; Y245-L247 PolarHBondContact O-N 3.32Å; L247-V254 HydrophobicContact CD2-CG1 4.33Å; L247-V254 HydrophobicContact CD2-CG2 3.69Å |
| 248 | T | 85.7 | Confident | 77 | Confident | 39 Ų | 39 | 66.4 Ų | 66.4 | 24% | 0.239 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -83.4 | -43 | 177.3 | -50.5 | 0 | 0 | 0 | 0 | 110.9 | K89 T93 Y134 L244 Y245 K246 | K89-T248 HydrophobicContact CB-CG2 4.23Å; K89-T248 WeakPolarHBondContact CG-OG1 3.38Å; T93-T248 WeakPolarHBondContact OG1-CG2 3.47Å; Y134-T248 WeakPolarHBondContact OH-CG2 3.5Å; L244-T248 PolarHBondContact O-N 2.91Å; L244-T248 PolarHBondContact O-OG1 2.92Å; Y245-T248 WeakPolarHBondContact O-CB 3.4Å; Y245-T248 PolarHBondContact O-N 3.13Å; K246-T248 PolarHBondContact O-N 3.14Å |
| 249 | T | 81.8 | Confident | 75.8 | Confident | 92 Ų | 92 | 71.1 Ų | 71.1 | 56% | 0.564 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -89 | -28.8 | -172.8 | -46 | 0 | 0 | 0 | 0 | 113.5 | Y245 K246 | Y245-T249 PolarHBondContact O-N 3.3Å; Y245-T249 PolarHBondContact O-OG1 3.04Å; K246-T249 PolarHBondContact O-N 3.2Å |
| 250 | A | 70.6 | Confident | 74.9 | Confident | 66 Ų | 66 | 71.9 Ų | 71.9 | 55% | 0.545 | 41% | 0.407 | S | S | . | . | S | Bend | trans | -93.2 | -3.9 | -178 | 0 | 0 | 0 | 0 | 0 | 114.4 | K246 | K246-A250 WeakPolarHBondContact O-CB 3.03Å; K246-A250 PolarHBondContact O-N 3.41Å |
| 251 | G | 63.7 | Low | 74 | Confident | 40 Ų | 40 | 73.4 Ų | 73.4 | 41% | 0.412 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 63.8 | -167 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | A253 | G251-A253 PolarHBondContact O-N 3.46Š|
| 252 | E | 54.1 | Low | 72.9 | Confident | 194 Ų | 194 | 77 Ų | 77 | 91% | 0.907 | 43% | 0.431 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.9 | 13.7 | 179.6 | -68.3 | -171.1 | 164.7 | 0 | 0 | 115 | V254 | E252-V254 PolarHBondContact O-N 3.32Š|
| 253 | A | 52.9 | Low | 72.2 | Confident | 82 Ų | 82 | 77.1 Ų | 77.1 | 68% | 0.678 | 44% | 0.438 | S | S | * | . | trans | -73.1 | 57.9 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110 | G251 S255 | G251-A253 PolarHBondContact O-N 3.46Å; A253-S255 VanDerWaalsContact C-N 3.29Å; A253-S255 PolarHBondContact O-N 3.5Å | ||
| 254 | V | 55.3 | Low | 71.7 | Confident | 62 Ų | 62 | 81.2 Ų | 81.2 | 38% | 0.376 | 46% | 0.459 | S | S | . | . | trans | -70.7 | 91.9 | 173.4 | -172.8 | 0 | 0 | 0 | 0 | 106.9 | L247 E252 W256 L259 | L247-V254 HydrophobicContact CD2-CG1 4.33Å; L247-V254 HydrophobicContact CD2-CG2 3.69Å; E252-V254 PolarHBondContact O-N 3.32Å; V254-W256 PolarHBondContact O-N 3.07Å; V254-L259 HydrophobicContact CG1-CB 4.26Å | ||
| 255 | S | 61.4 | Low | 70.9 | Confident | 61 Ų | 61 | 81 Ų | 81 | 43% | 0.427 | 46% | 0.458 | S | S | . | . | trans | -53.6 | 129.1 | 164.8 | 144.1 | 0 | 0 | 0 | 0 | 107.9 | A253 N257 S258 | A253-S255 VanDerWaalsContact C-N 3.29Å; A253-S255 PolarHBondContact O-N 3.5Å; S255-N257 PolarHBondContact O-N 2.85Å; S255-N257 WeakPolarHBondContact OG-CB 3.4Å; S255-N257 PolarHBondContact OG-N 2.79Å; S255-S258 PolarHBondContact O-N 3.3Å | ||
| 256 | W | 70.6 | Confident | 70.1 | Confident | 218 Ų | 218 | 78.6 Ų | 78.6 | 83% | 0.826 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -46.1 | -27.6 | 177.1 | -85.6 | 95.2 | 0 | 0 | 0 | 113.1 | V254 S258 L259 A260 | V254-W256 PolarHBondContact O-N 3.07Å; W256-S258 PolarHBondContact O-N 2.86Å; W256-L259 PolarHBondContact O-N 3.48Å; W256-A260 VanDerWaalsContact O-CB 3.31Å; W256-A260 WeakPolarHBondContact O-CB 3.44Å; W256-A260 PolarHBondContact O-N 3.32Å |
| 257 | N | 60.8 | Low | 69.6 | Low | 121 Ų | 121 | 78.4 Ų | 78.4 | 65% | 0.647 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -64.2 | -36.9 | 174.6 | -75.5 | -16.2 | 0 | 0 | 0 | 113.4 | S255 A260 V261 | S255-N257 PolarHBondContact O-N 2.85Å; S255-N257 WeakPolarHBondContact OG-CB 3.4Å; S255-N257 PolarHBondContact OG-N 2.79Å; N257-A260 PolarHBondContact O-N 3.06Å; N257-V261 WeakPolarHBondContact O-CB 3.47Å; N257-V261 WeakPolarHBondContact O-CG2 2.96Å; N257-V261 PolarHBondContact O-N 2.72Å |
| 258 | S | 59.8 | Low | 69.1 | Low | 34 Ų | 34 | 81.6 Ų | 81.6 | 24% | 0.238 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -69.9 | -38.9 | 179.4 | -56.9 | 0 | 0 | 0 | 0 | 111.2 | S255 W256 V261 L262 | S255-S258 PolarHBondContact O-N 3.3Å; W256-S258 PolarHBondContact O-N 2.86Å; S258-V261 PolarHBondContact O-N 3.35Å; S258-L262 WeakPolarHBondContact O-CB 3.42Å; S258-L262 PolarHBondContact O-N 2.93Å |
| 259 | L | 69.9 | Low | 68 | Low | 99 Ų | 99 | 82.8 Ų | 82.8 | 52% | 0.518 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -69.4 | -39.1 | 175.7 | -158.4 | 70.9 | 0 | 0 | 0 | 111.4 | V254 W256 L262 G263 | V254-L259 HydrophobicContact CG1-CB 4.26Å; W256-L259 PolarHBondContact O-N 3.48Å; L259-L262 PolarHBondContact O-N 3.38Å; L259-G263 PolarHBondContact O-N 3.38Å |
| 260 | A | 73 | Confident | 67.6 | Low | 50 Ų | 50 | 82.8 Ų | 82.8 | 41% | 0.413 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.4 | -43.9 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112 | W256 N257 G263 I264 | W256-A260 VanDerWaalsContact O-CB 3.31Å; W256-A260 WeakPolarHBondContact O-CB 3.44Å; W256-A260 PolarHBondContact O-N 3.32Å; N257-A260 PolarHBondContact O-N 3.06Å; A260-G263 PolarHBondContact O-N 3.17Å; A260-I264 WeakPolarHBondContact O-CB 3.35Å; A260-I264 WeakPolarHBondContact O-CD1 3.36Å; A260-I264 WeakPolarHBondContact O-CG1 3.15Å; A260-I264 PolarHBondContact O-N 3.42Å |
| 261 | V | 70.8 | Confident | 67.7 | Low | 68 Ų | 68 | 83.6 Ų | 83.6 | 41% | 0.412 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 174.8 | 169.2 | 0 | 0 | 0 | 0 | 110.8 | N257 S258 G263 I264 L265 | N257-V261 WeakPolarHBondContact O-CB 3.47Å; N257-V261 WeakPolarHBondContact O-CG2 2.96Å; N257-V261 PolarHBondContact O-N 2.72Å; S258-V261 PolarHBondContact O-N 3.35Å; V261-G263 PolarHBondContact O-N 3.14Å; V261-I264 PolarHBondContact O-N 2.96Å; V261-L265 HydrophobicContact CG1-CD1 3.95Å; V261-L265 HydrophobicContact CG1-CG 4.34Å; V261-L265 WeakPolarHBondContact O-CB 3.49Å; V261-L265 VanDerWaalsContact O-CG 3.25Å; V261-L265 WeakPolarHBondContact O-CG 3.47Å; V261-L265 PolarHBondContact O-N 3.05Å |
| 262 | L | 68.4 | Low | 67.6 | Low | 75 Ų | 75 | 83.9 Ų | 83.9 | 39% | 0.393 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -62.8 | -43 | 176.9 | -139.4 | 91.4 | 0 | 0 | 0 | 111.8 | T243 S258 L259 L265 A266 | T243-L262 HydrophobicContact CG2-CD1 3.44Å; T243-L262 VanDerWaalsContact CG2-CD1 3.44Å; S258-L262 WeakPolarHBondContact O-CB 3.42Å; S258-L262 PolarHBondContact O-N 2.93Å; L259-L262 PolarHBondContact O-N 3.38Å; L262-L265 PolarHBondContact O-N 3.49Å; L262-A266 WeakPolarHBondContact O-CB 3.41Å; L262-A266 PolarHBondContact O-N 3.33Å |
| 263 | G | 77.5 | Confident | 68.2 | Low | 32 Ų | 32 | 79.1 Ų | 79.1 | 33% | 0.33 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63.1 | -43.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L259 A260 V261 A266 I267 | L259-G263 PolarHBondContact O-N 3.38Å; A260-G263 PolarHBondContact O-N 3.17Å; V261-G263 PolarHBondContact O-N 3.14Å; G263-A266 PolarHBondContact O-N 3.39Å; G263-I267 WeakPolarHBondContact O-CB 3.25Å; G263-I267 VanDerWaalsContact O-CG1 3.24Å; G263-I267 WeakPolarHBondContact O-CG1 3.35Å; G263-I267 PolarHBondContact O-N 3.21Å |
| 264 | I | 78.3 | Confident | 69.1 | Low | 98 Ų | 98 | 79.5 Ų | 79.5 | 50% | 0.503 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.9 | -45.9 | 175.3 | -70.4 | 164.8 | 0 | 0 | 0 | 110.4 | A260 V261 A266 I267 L268 | A260-I264 WeakPolarHBondContact O-CB 3.35Å; A260-I264 WeakPolarHBondContact O-CD1 3.36Å; A260-I264 WeakPolarHBondContact O-CG1 3.15Å; A260-I264 PolarHBondContact O-N 3.42Å; V261-I264 PolarHBondContact O-N 2.96Å; I264-A266 VanDerWaalsContact C-N 3.35Å; I264-A266 PolarHBondContact O-N 3.32Å; I264-I267 PolarHBondContact O-N 3.45Å; I264-L268 HydrophobicContact CG2-CD1 3.86Å; I264-L268 VanDerWaalsContact O-CB 3.32Å; I264-L268 WeakPolarHBondContact O-CB 3.44Å; I264-L268 PolarHBondContact O-N 2.92Å |
| 265 | L | 72.4 | Confident | 69.9 | Low | 27 Ų | 27 | 80.9 Ų | 80.9 | 14% | 0.141 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -63.5 | -39.2 | 177.4 | -69.8 | 174.4 | 0 | 0 | 0 | 111.9 | V236 N239 V261 L262 L268 S269 | V236-L265 HydrophobicContact CG1-CD2 4.21Å; V236-L265 HydrophobicContact CG2-CD2 4.34Å; N239-L265 HydrophobicContact CB-CD1 3.98Å; V261-L265 HydrophobicContact CG1-CD1 3.95Å; V261-L265 HydrophobicContact CG1-CG 4.34Å; V261-L265 WeakPolarHBondContact O-CB 3.49Å; V261-L265 VanDerWaalsContact O-CG 3.25Å; V261-L265 WeakPolarHBondContact O-CG 3.47Å; V261-L265 PolarHBondContact O-N 3.05Å; L262-L265 PolarHBondContact O-N 3.49Å; L265-L268 PolarHBondContact O-N 3.01Å; L265-S269 WeakPolarHBondContact O-CB 3.39Å; L265-S269 PolarHBondContact O-N 2.76Å |
| 266 | A | 73.1 | Confident | 70.1 | Confident | 46 Ų | 46 | 80.5 Ų | 80.5 | 38% | 0.38 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.2 | -48.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | L262 G263 I264 L268 S269 I270 | L262-A266 WeakPolarHBondContact O-CB 3.41Å; L262-A266 PolarHBondContact O-N 3.33Å; G263-A266 PolarHBondContact O-N 3.39Å; I264-A266 VanDerWaalsContact C-N 3.35Å; I264-A266 PolarHBondContact O-N 3.32Å; A266-L268 PolarHBondContact O-N 2.92Å; A266-S269 PolarHBondContact O-N 3.06Å; A266-S269 PolarHBondContact O-OG 3.45Å; A266-I270 VanDerWaalsContact O-CG1 3.31Å; A266-I270 WeakPolarHBondContact O-CG1 3.32Å; A266-I270 PolarHBondContact O-N 2.88Å; A266-I270 VanDerWaalsContact O-N 3.07Å |
| 267 | I | 77.1 | Confident | 69.7 | Low | 110 Ų | 110 | 78.2 Ų | 78.2 | 56% | 0.564 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -61.4 | -45.5 | 176.6 | -68 | 166.3 | 0 | 0 | 0 | 111 | G263 I264 S269 I270 L271 | G263-I267 WeakPolarHBondContact O-CB 3.25Å; G263-I267 VanDerWaalsContact O-CG1 3.24Å; G263-I267 WeakPolarHBondContact O-CG1 3.35Å; G263-I267 PolarHBondContact O-N 3.21Å; I264-I267 PolarHBondContact O-N 3.45Å; I267-S269 VanDerWaalsContact C-N 3.27Å; I267-S269 PolarHBondContact O-N 3.43Å; I267-I270 PolarHBondContact O-N 2.82Å; I267-I270 VanDerWaalsContact O-N 3.17Å; I267-L271 HydrophobicContact CG2-CD1 4.16Å; I267-L271 PolarHBondContact O-N 2.91Å |
| 268 | L | 72.9 | Confident | 70 | Confident | 99 Ų | 99 | 79.3 Ų | 79.3 | 52% | 0.518 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -62.6 | -32.3 | 176 | -108.8 | 145.8 | 0 | 0 | 0 | 112.7 | I264 L265 A266 P272 | I264-L268 HydrophobicContact CG2-CD1 3.86Å; I264-L268 VanDerWaalsContact O-CB 3.32Å; I264-L268 WeakPolarHBondContact O-CB 3.44Å; I264-L268 PolarHBondContact O-N 2.92Å; L265-L268 PolarHBondContact O-N 3.01Å; A266-L268 PolarHBondContact O-N 2.92Å; L268-P272 WeakPolarHBondContact O-CD 3.32Å |
| 269 | S | 64.6 | Low | 70.1 | Confident | 65 Ų | 65 | 81.2 Ų | 81.2 | 46% | 0.455 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -73.9 | -28.8 | 176 | 79.3 | 0 | 0 | 0 | 0 | 112.8 | L265 A266 I267 | L265-S269 WeakPolarHBondContact O-CB 3.39Å; L265-S269 PolarHBondContact O-N 2.76Å; A266-S269 PolarHBondContact O-N 3.06Å; A266-S269 PolarHBondContact O-OG 3.45Å; I267-S269 VanDerWaalsContact C-N 3.27Å; I267-S269 PolarHBondContact O-N 3.43Å |
| 270 | I | 71.8 | Confident | 69.5 | Low | 91 Ų | 91 | 80.5 Ų | 80.5 | 47% | 0.467 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -86.8 | -31.2 | -178.8 | -68 | 167.4 | 0 | 0 | 0 | 111.7 | A266 I267 V273 C274 | A266-I270 VanDerWaalsContact O-CG1 3.31Å; A266-I270 WeakPolarHBondContact O-CG1 3.32Å; A266-I270 PolarHBondContact O-N 2.88Å; A266-I270 VanDerWaalsContact O-N 3.07Å; I267-I270 PolarHBondContact O-N 2.82Å; I267-I270 VanDerWaalsContact O-N 3.17Å; I270-V273 WeakPolarHBondContact O-CB 3.21Å; I270-V273 PolarHBondContact O-N 3.49Å; I270-C274 WeakPolarHBondContact CG2-SG 3.48Å; I270-C274 PolarHBondContact O-N 3.45Å |
| 271 | L | 73.9 | Confident | 68.9 | Low | 84 Ų | 84 | 85 Ų | 85 | 44% | 0.44 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -49.6 | -50.5 | 179.9 | -126.4 | 138.3 | 0 | 0 | 0 | 112.6 | I267 V273 C274 F275 | I267-L271 HydrophobicContact CG2-CD1 4.16Å; I267-L271 PolarHBondContact O-N 2.91Å; L271-V273 VanDerWaalsContact C-N 3.26Å; L271-V273 PolarHBondContact O-N 3.34Å; L271-C274 PolarHBondContact O-N 3.47Å; L271-F275 HydrophobicContact CD2-CD2 3.61Å; L271-F275 HydrophobicContact CD2-CE2 3.69Å; L271-F275 HydrophobicContact CG-CD2 4.15Å; L271-F275 HydrophobicContact CG-CE2 4.1Å; L271-F275 VanDerWaalsContact O-CD2 3.24Å; L271-F275 WeakPolarHBondContact O-CD2 3.47Å; L271-F275 PolarHBondContact O-N 3.37Å |
| 272 | P | 61.6 | Low | 68.1 | Low | 46 Ų | 46 | 90.7 Ų | 90.7 | 30% | 0.299 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61.6 | -33.5 | 179.2 | -24.1 | 35.1 | 0 | 0 | 0 | 113.4 | P201 L268 Q276 | P201-P272 HydrophobicContact CG-CB 3.55Å; L268-P272 WeakPolarHBondContact O-CD 3.32Å; P272-Q276 WeakPolarHBondContact O-CA 3.24Å; P272-Q276 WeakPolarHBondContact O-CB 3.16Å; P272-Q276 PolarHBondContact O-N 2.87Å |
| 273 | V | 66.9 | Low | 67.3 | Low | 93 Ų | 93 | 92.1 Ų | 92.1 | 56% | 0.564 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -73.7 | -44.9 | 179.1 | -177.6 | 0 | 0 | 0 | 0 | 110.7 | I270 L271 F275 Q276 | I270-V273 WeakPolarHBondContact O-CB 3.21Å; I270-V273 PolarHBondContact O-N 3.49Å; L271-V273 VanDerWaalsContact C-N 3.26Å; L271-V273 PolarHBondContact O-N 3.34Å; V273-F275 VanDerWaalsContact C-N 3.34Å; V273-F275 PolarHBondContact O-N 2.88Å; V273-Q276 WeakPolarHBondContact O-CB 3.42Å; V273-Q276 PolarHBondContact O-N 2.95Å |
| 274 | C | 70.9 | Confident | 65.6 | Low | 90 Ų | 90 | 101.1 Ų | 101.1 | 61% | 0.608 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -66 | -36.3 | 178.3 | -73.3 | 0 | 0 | 0 | 0 | 112.7 | I270 L271 | I270-C274 WeakPolarHBondContact CG2-SG 3.48Å; I270-C274 PolarHBondContact O-N 3.45Å; L271-C274 PolarHBondContact O-N 3.47Å |
| 275 | F | 71.4 | Confident | 65 | Low | 92 Ų | 92 | 101.3 Ų | 101.3 | 40% | 0.404 | 52% | 0.515 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.3 | 1.6 | -179.9 | -70 | -79.9 | 0 | 0 | 0 | 113.7 | L271 V273 K277 K278 L279 | L271-F275 HydrophobicContact CD2-CD2 3.61Å; L271-F275 HydrophobicContact CD2-CE2 3.69Å; L271-F275 HydrophobicContact CG-CD2 4.15Å; L271-F275 HydrophobicContact CG-CE2 4.1Å; L271-F275 VanDerWaalsContact O-CD2 3.24Å; L271-F275 WeakPolarHBondContact O-CD2 3.47Å; L271-F275 PolarHBondContact O-N 3.37Å; V273-F275 VanDerWaalsContact C-N 3.34Å; V273-F275 PolarHBondContact O-N 2.88Å; F275-K277 VanDerWaalsContact C-N 3.27Å; F275-K277 PolarHBondContact O-N 2.87Å; F275-K278 HydrophobicContact CD1-CD 4.27Å; F275-K278 PolarHBondContact O-N 3.35Å; F275-L279 HydrophobicContact CB-CD1 4.05Å; F275-L279 WeakPolarHBondContact O-CB 3.41Å; F275-L279 PolarHBondContact O-N 2.77Å |
| 276 | Q | 66.5 | Low | 64.6 | Low | 53 Ų | 53 | 105.2 Ų | 105.2 | 25% | 0.248 | 54% | 0.535 | C | S | . | . | H | α-helix | trans | -53.1 | -44.8 | -175.4 | -159.2 | 175.5 | -16.5 | 0 | 0 | 112.1 | F202 P272 V273 Q280 | F202-Q276 HydrophobicContact CD1-CG 3.78Å; F202-Q276 HydrophobicContact CE1-CG 4.01Å; P272-Q276 WeakPolarHBondContact O-CA 3.24Å; P272-Q276 WeakPolarHBondContact O-CB 3.16Å; P272-Q276 PolarHBondContact O-N 2.87Å; V273-Q276 WeakPolarHBondContact O-CB 3.42Å; V273-Q276 PolarHBondContact O-N 2.95Å; Q276-Q280 WeakPolarHBondContact O-CB 3.31Å; Q276-Q280 VanDerWaalsContact O-CG 3.23Å; Q276-Q280 WeakPolarHBondContact O-CG 3.49Å; Q276-Q280 PolarHBondContact O-N 3.47Å |
| 277 | K | 62.3 | Low | 64.1 | Low | 169 Ų | 169 | 108.5 Ų | 108.5 | 74% | 0.735 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -68.5 | -37.7 | 179 | -65.8 | -171.6 | 177.1 | -176.5 | 0 | 113.5 | F275 Q281 | F275-K277 VanDerWaalsContact C-N 3.27Å; F275-K277 PolarHBondContact O-N 2.87Å; K277-Q281 WeakPolarHBondContact O-CG 3.2Å; K277-Q281 PolarHBondContact O-N 3.5Å |
| 278 | K | 65.9 | Low | 63.4 | Low | 144 Ų | 144 | 108.4 Ų | 108.4 | 63% | 0.626 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -74.6 | -33.8 | 178.6 | -80.5 | -172.3 | 175.8 | -177.3 | 0 | 112.4 | F275 K282 | F275-K278 HydrophobicContact CD1-CD 4.27Å; F275-K278 PolarHBondContact O-N 3.35Å; K278-K282 PolarHBondContact O-N 2.85Å |
| 279 | L | 62 | Low | 62.8 | Low | 75 Ų | 75 | 109 Ų | 109 | 39% | 0.393 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -69.2 | -43.1 | 174.1 | -94.7 | 145.7 | 0 | 0 | 0 | 111.2 | F202 F275 Q281 K282 L283 | F202-L279 HydrophobicContact CE1-CB 3.98Å; F202-L279 HydrophobicContact CZ-CB 3.68Å; F202-L279 HydrophobicContact CZ-CD1 4.36Å; F202-L279 HydrophobicContact CZ-CD2 4.23Å; F202-L279 HydrophobicContact CZ-CG 4.31Å; F275-L279 HydrophobicContact CB-CD1 4.05Å; F275-L279 WeakPolarHBondContact O-CB 3.41Å; F275-L279 PolarHBondContact O-N 2.77Å; L279-Q281 VanDerWaalsContact C-N 3.34Å; L279-Q281 PolarHBondContact O-N 3.36Å; L279-K282 PolarHBondContact O-N 2.89Å; L279-L283 HydrophobicContact CD2-CD1 4.25Å; L279-L283 PolarHBondContact O-N 3.27Å |
| 280 | Q | 58.3 | Low | 62.7 | Low | 83 Ų | 83 | 111.9 Ų | 111.9 | 39% | 0.388 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -56.8 | -46.1 | 174.8 | -77.9 | 172.6 | -21.1 | 0 | 0 | 111.7 | F202 Q276 K282 L283 E284 | F202-Q280 HydrophobicContact CD1-CG 4.39Å; Q276-Q280 WeakPolarHBondContact O-CB 3.31Å; Q276-Q280 VanDerWaalsContact O-CG 3.23Å; Q276-Q280 WeakPolarHBondContact O-CG 3.49Å; Q276-Q280 PolarHBondContact O-N 3.47Å; Q280-K282 VanDerWaalsContact C-N 3.29Å; Q280-K282 PolarHBondContact O-N 2.79Å; Q280-L283 PolarHBondContact O-N 2.9Å; Q280-E284 PolarHBondContact O-N 2.93Å |
| 281 | Q | 60.8 | Low | 62 | Low | 146 Ų | 146 | 113.4 Ų | 113.4 | 68% | 0.682 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -66.9 | -20 | 178.9 | -75.8 | 179.4 | -19.9 | 0 | 0 | 115.6 | K277 L279 | K277-Q281 WeakPolarHBondContact O-CG 3.2Å; K277-Q281 PolarHBondContact O-N 3.5Å; L279-Q281 VanDerWaalsContact C-N 3.34Å; L279-Q281 PolarHBondContact O-N 3.36Å |
| 282 | K | 53.8 | Low | 61.1 | Low | 187 Ų | 187 | 115.7 Ų | 115.7 | 81% | 0.813 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -93.7 | -15.1 | 178 | -90.4 | -163 | 173.8 | -158.8 | 0 | 113.6 | K278 L279 Q280 | K278-K282 PolarHBondContact O-N 2.85Å; L279-K282 PolarHBondContact O-N 2.89Å; Q280-K282 VanDerWaalsContact C-N 3.29Å; Q280-K282 PolarHBondContact O-N 2.79Å |
| 283 | L | 51.4 | Low | 61.1 | Low | 105 Ų | 105 | 121.5 Ų | 121.5 | 55% | 0.55 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -103.4 | -12.7 | -177.1 | -76.7 | 162 | 0 | 0 | 0 | 112.8 | F196 F202 L279 Q280 | F196-L283 HydrophobicContact CZ-CD1 3.86Å; F196-L283 HydrophobicContact CZ-CD2 4.37Å; F202-L283 HydrophobicContact CE2-CD1 3.98Å; F202-L283 HydrophobicContact CZ-CD1 4.36Å; L279-L283 HydrophobicContact CD2-CD1 4.25Å; L279-L283 PolarHBondContact O-N 3.27Å; Q280-L283 PolarHBondContact O-N 2.9Å |
| 284 | E | 42.5 | Very low | 60.5 | Low | 221 Ų | 221 | 124.1 Ų | 124.1 | 100% | 1.033 | 59% | 0.589 | S | S | * | * | trans | -79.6 | 0 | 162.1 | -70.6 | -177.8 | 158.5 | 0 | 0 | 111.2 | Q280 | Q280-E284 PolarHBondContact O-N 2.93Š|
Retrieved 284 of 284 residues in 82.3 ms
(Link to these results)