| 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 | R | 32.8 | Very low | 33.3 | Very low | 290 Ų | 290 | 149.9 Ų | 149.9 | 100% | 1.094 | 72% | 0.724 | S | S | * | * | 0 | 107 | 0 | -80.2 | 177.4 | 179.9 | 171.4 | -0.7 | 107.2 | |||||
| 2 | N | 29.4 | Very low | 33.8 | Very low | 167 Ų | 167 | 145.6 Ų | 145.6 | 89% | 0.893 | 71% | 0.713 | S | S | * | * | trans | -176.7 | 84.7 | 159.7 | -91.2 | -10.2 | 0 | 0 | 0 | 105.6 | ||||
| 3 | F | 28.5 | Very low | 34.2 | Very low | 198 Ų | 198 | 141.3 Ų | 141.3 | 87% | 0.868 | 70% | 0.7 | S | S | * | * | trans | -74.4 | 117.9 | 172.9 | -98.6 | -93.6 | 0 | 0 | 0 | 107.8 | T5 | F3-T5 PolarHBondContact O-N 3.47Š| ||
| 4 | I | 29.3 | Very low | 34.2 | Very low | 146 Ų | 146 | 136.5 Ų | 136.5 | 75% | 0.749 | 69% | 0.687 | S | S | * | * | trans | -78.1 | 102.1 | 158.9 | -63.4 | 172.3 | 0 | 0 | 0 | 105.2 | W6 | I4-W6 PolarHBondContact O-N 3.33Š| ||
| 5 | T | 27.4 | Very low | 34.7 | Very low | 122 Ų | 122 | 133.7 Ų | 133.7 | 75% | 0.748 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 119 | 174 | 41.4 | 0 | 0 | 0 | 0 | 108.9 | F3 | F3-T5 PolarHBondContact O-N 3.47Š|
| 6 | W | 31.6 | Very low | 35 | Very low | 185 Ų | 185 | 130.7 Ų | 130.7 | 70% | 0.701 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 147.1 | 164.3 | -70.6 | 86.8 | 0 | 0 | 0 | 108.5 | I4 | I4-W6 PolarHBondContact O-N 3.33Š|
| 7 | P | 33.5 | Very low | 35.4 | Very low | 91 Ų | 91 | 127.5 Ų | 127.5 | 59% | 0.591 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 143.8 | 176.5 | 28 | -31.6 | 0 | 0 | 0 | 109.8 | ||
| 8 | P | 35.7 | Very low | 35.4 | Very low | 79 Ų | 79 | 123.4 Ų | 123.4 | 51% | 0.513 | 64% | 0.641 | S | S | . | * | P | Polyproline II helix | trans | -66.8 | 154.8 | -178.2 | 26.9 | -32.6 | 0 | 0 | 0 | 111.4 | H10 T11 | P8-H10 PolarHBondContact O-N 2.94Å; P8-T11 WeakPolarHBondContact CD-OG1 3.31Å; P8-T11 WeakPolarHBondContact O-CB 3.39Å; P8-T11 PolarHBondContact O-N 3.32Å; P8-T11 PolarHBondContact O-OG1 3.11Å; P8-T11 VanDerWaalsContact O-OG1 3.11Å |
| 9 | E | 44.3 | Very low | 35.8 | Very low | 168 Ų | 168 | 123.2 Ų | 123.2 | 79% | 0.785 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -56.9 | -20.8 | 178.2 | -62.6 | -173.9 | 160.1 | 0 | 0 | 113 | T11 | E9-T11 PolarHBondContact O-N 3.43Å |
| 10 | H | 38 | Very low | 36 | Very low | 151 Ų | 151 | 120.4 Ų | 120.4 | 70% | 0.699 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -62 | -25.3 | 169.8 | -65.9 | -79.1 | 0 | 0 | 0 | 113.6 | P8 S14 | P8-H10 PolarHBondContact O-N 2.94Å; H10-S14 WeakPolarHBondContact O-CA 3.48Å; H10-S14 WeakPolarHBondContact O-CB 3.46Å; H10-S14 PolarHBondContact O-N 3.06Å |
| 11 | T | 35.7 | Very low | 36.1 | Very low | 52 Ų | 52 | 117.2 Ų | 117.2 | 32% | 0.319 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -75.2 | -35.3 | -177.4 | -46.5 | 0 | 0 | 0 | 0 | 111.8 | P8 E9 I15 | P8-T11 WeakPolarHBondContact CD-OG1 3.31Å; P8-T11 WeakPolarHBondContact O-CB 3.39Å; P8-T11 PolarHBondContact O-N 3.32Å; P8-T11 PolarHBondContact O-OG1 3.11Å; P8-T11 VanDerWaalsContact O-OG1 3.11Å; E9-T11 PolarHBondContact O-N 3.43Å; T11-I15 HydrophobicContact CG2-CD1 3.95Å; T11-I15 HydrophobicContact CG2-CG1 4.47Å; T11-I15 WeakPolarHBondContact O-CB 3.41Å; T11-I15 VanDerWaalsContact O-CD1 3.3Å; T11-I15 WeakPolarHBondContact O-CD1 3.4Å; T11-I15 WeakPolarHBondContact O-CG1 3.23Å; T11-I15 PolarHBondContact O-N 3.25Å |
| 12 | V | 39 | Very low | 36.3 | Very low | 98 Ų | 98 | 106.1 Ų | 106.1 | 59% | 0.594 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -75.6 | -43 | 178.4 | -179.6 | 0 | 0 | 0 | 0 | 110.8 | S14 I15 V16 | V12-S14 VanDerWaalsContact C-N 3.31Å; V12-S14 PolarHBondContact O-N 2.97Å; V12-I15 PolarHBondContact O-N 3.25Å; V12-V16 WeakPolarHBondContact O-CG2 3.49Å; V12-V16 PolarHBondContact O-N 3.31Å |
| 13 | V | 39.8 | Very low | 36.7 | Very low | 90 Ų | 90 | 102.1 Ų | 102.1 | 55% | 0.545 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -63.6 | -40.2 | 172.4 | 179.1 | 0 | 0 | 0 | 0 | 110.1 | V16 T17 | V13-V16 PolarHBondContact O-N 3.1Å; V13-T17 WeakPolarHBondContact O-CB 3.27Å; V13-T17 PolarHBondContact O-N 3.28Å; V13-T17 PolarHBondContact O-OG1 3.29Å |
| 14 | S | 34 | Very low | 37.1 | Very low | 74 Ų | 74 | 95.9 Ų | 95.9 | 52% | 0.517 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -67.4 | -35.3 | 175.5 | -171.8 | 0 | 0 | 0 | 0 | 112.5 | H10 V12 A18 | H10-S14 WeakPolarHBondContact O-CA 3.48Å; H10-S14 WeakPolarHBondContact O-CB 3.46Å; H10-S14 PolarHBondContact O-N 3.06Å; V12-S14 VanDerWaalsContact C-N 3.31Å; V12-S14 PolarHBondContact O-N 2.97Å; S14-A18 WeakPolarHBondContact O-CA 3.33Å; S14-A18 WeakPolarHBondContact O-CB 3.27Å; S14-A18 PolarHBondContact O-N 3.28Å |
| 15 | I | 41.3 | Very low | 37.4 | Very low | 94 Ų | 94 | 95.4 Ų | 95.4 | 48% | 0.482 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -68 | -43.4 | 174.5 | -72.9 | 161.3 | 0 | 0 | 0 | 110.8 | T11 V12 A18 L19 | T11-I15 HydrophobicContact CG2-CD1 3.95Å; T11-I15 HydrophobicContact CG2-CG1 4.47Å; T11-I15 WeakPolarHBondContact O-CB 3.41Å; T11-I15 VanDerWaalsContact O-CD1 3.3Å; T11-I15 WeakPolarHBondContact O-CD1 3.4Å; T11-I15 WeakPolarHBondContact O-CG1 3.23Å; T11-I15 PolarHBondContact O-N 3.25Å; V12-I15 PolarHBondContact O-N 3.25Å; I15-A18 PolarHBondContact O-N 2.93Å; I15-L19 HydrophobicContact CG2-CD1 4.31Å; I15-L19 WeakPolarHBondContact O-CB 3.47Å; I15-L19 PolarHBondContact O-N 2.93Å |
| 16 | V | 39.6 | Very low | 37.9 | Very low | 86 Ų | 86 | 92.5 Ų | 92.5 | 52% | 0.521 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68.5 | -44.7 | 178.3 | 174.5 | 0 | 0 | 0 | 0 | 110.5 | V12 V13 A18 L19 V20 | V12-V16 WeakPolarHBondContact O-CG2 3.49Å; V12-V16 PolarHBondContact O-N 3.31Å; V13-V16 PolarHBondContact O-N 3.1Å; V16-A18 PolarHBondContact O-N 3.42Å; V16-L19 PolarHBondContact O-N 2.71Å; V16-V20 WeakPolarHBondContact O-CB 3.42Å; V16-V20 VanDerWaalsContact O-CG2 3.23Å; V16-V20 WeakPolarHBondContact O-CG2 3.34Å; V16-V20 PolarHBondContact O-N 3.33Å |
| 17 | T | 41.7 | Very low | 38.3 | Very low | 76 Ų | 76 | 87.6 Ų | 87.6 | 47% | 0.466 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.2 | -38 | 175 | -57 | 0 | 0 | 0 | 0 | 111.3 | V13 V20 T21 | V13-T17 WeakPolarHBondContact O-CB 3.27Å; V13-T17 PolarHBondContact O-N 3.28Å; V13-T17 PolarHBondContact O-OG1 3.29Å; T17-V20 PolarHBondContact O-N 3.37Å; T17-T21 WeakPolarHBondContact O-CB 3.46Å; T17-T21 PolarHBondContact O-N 3.17Å; T17-T21 PolarHBondContact O-OG1 2.98Å |
| 18 | A | 36.6 | Very low | 38.5 | Very low | 54 Ų | 54 | 87.4 Ų | 87.4 | 45% | 0.446 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -69.8 | -36.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | S14 I15 V16 A22 | S14-A18 WeakPolarHBondContact O-CA 3.33Å; S14-A18 WeakPolarHBondContact O-CB 3.27Å; S14-A18 PolarHBondContact O-N 3.28Å; I15-A18 PolarHBondContact O-N 2.93Å; V16-A18 PolarHBondContact O-N 3.42Å; A18-A22 WeakPolarHBondContact O-CB 3.32Å; A18-A22 PolarHBondContact O-N 3.01Å |
| 19 | L | 41.4 | Very low | 38.4 | Very low | 120 Ų | 120 | 85.1 Ų | 85.1 | 63% | 0.628 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.2 | -47.7 | 172.3 | -119.4 | 87.9 | 0 | 0 | 0 | 110.4 | I15 V16 T21 A22 T23 | I15-L19 HydrophobicContact CG2-CD1 4.31Å; I15-L19 WeakPolarHBondContact O-CB 3.47Å; I15-L19 PolarHBondContact O-N 2.93Å; V16-L19 PolarHBondContact O-N 2.71Å; L19-T21 PolarHBondContact O-N 2.9Å; L19-A22 PolarHBondContact O-N 3.37Å; L19-T23 WeakPolarHBondContact O-CG2 3.46Å; L19-T23 PolarHBondContact O-N 3.38Å; L19-T23 PolarHBondContact O-OG1 3.12Å |
| 20 | V | 40.6 | Very low | 38.3 | Very low | 66 Ų | 66 | 80.9 Ų | 80.9 | 40% | 0.4 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.9 | -40.3 | 179.6 | 172.1 | 0 | 0 | 0 | 0 | 111 | V16 T17 T23 T24 | V16-V20 WeakPolarHBondContact O-CB 3.42Å; V16-V20 VanDerWaalsContact O-CG2 3.23Å; V16-V20 WeakPolarHBondContact O-CG2 3.34Å; V16-V20 PolarHBondContact O-N 3.33Å; T17-V20 PolarHBondContact O-N 3.37Å; V20-T23 VanDerWaalsContact CA-OG1 3.32Å; V20-T23 WeakPolarHBondContact CA-OG1 3.47Å; V20-T23 PolarHBondContact O-N 3.21Å; V20-T23 PolarHBondContact O-OG1 3Å; V20-T24 WeakPolarHBondContact O-CG2 3.07Å; V20-T24 PolarHBondContact O-N 3.48Å; V20-T24 PolarHBondContact O-OG1 3.39Å; V20-T24 VanDerWaalsContact O-OG1 3.08Å |
| 21 | T | 38.5 | Very low | 38.2 | Very low | 54 Ų | 54 | 77.5 Ų | 77.5 | 33% | 0.331 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -72 | -37.2 | 178.9 | -51.2 | 0 | 0 | 0 | 0 | 111.8 | T17 L19 T23 T24 Q25 | T17-T21 WeakPolarHBondContact O-CB 3.46Å; T17-T21 PolarHBondContact O-N 3.17Å; T17-T21 PolarHBondContact O-OG1 2.98Å; L19-T21 PolarHBondContact O-N 2.9Å; T21-T23 VanDerWaalsContact C-N 3.34Å; T21-T24 WeakPolarHBondContact CA-OG1 3.37Å; T21-T24 PolarHBondContact O-N 2.65Å; T21-T24 PolarHBondContact O-OG1 2.88Å; T21-T24 VanDerWaalsContact O-OG1 3.06Å; T21-Q25 HydrophobicContact CG2-CG 4.37Å; T21-Q25 WeakPolarHBondContact O-CB 3.49Å; T21-Q25 VanDerWaalsContact O-CG 3.3Å; T21-Q25 WeakPolarHBondContact O-CG 3.38Å; T21-Q25 PolarHBondContact O-N 2.92Å |
| 22 | A | 36.1 | Very low | 38.2 | Very low | 57 Ų | 57 | 81.1 Ų | 81.1 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.5 | -38.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | A18 L19 A26 | A18-A22 WeakPolarHBondContact O-CB 3.32Å; A18-A22 PolarHBondContact O-N 3.01Å; L19-A22 PolarHBondContact O-N 3.37Å; A22-A26 WeakPolarHBondContact O-CB 3.47Å; A22-A26 PolarHBondContact O-N 3.08Å; A22-A26 VanDerWaalsContact O-N 3.09Å |
| 23 | T | 38.3 | Very low | 38.2 | Very low | 84 Ų | 84 | 81.7 Ų | 81.7 | 52% | 0.515 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -69.5 | -36 | 175 | 49.5 | 0 | 0 | 0 | 0 | 112.9 | L19 V20 T21 V27 | L19-T23 WeakPolarHBondContact O-CG2 3.46Å; L19-T23 PolarHBondContact O-N 3.38Å; L19-T23 PolarHBondContact O-OG1 3.12Å; V20-T23 VanDerWaalsContact CA-OG1 3.32Å; V20-T23 WeakPolarHBondContact CA-OG1 3.47Å; V20-T23 PolarHBondContact O-N 3.21Å; V20-T23 PolarHBondContact O-OG1 3Å; T21-T23 VanDerWaalsContact C-N 3.34Å; T23-V27 VanDerWaalsContact O-CG2 3.24Å; T23-V27 WeakPolarHBondContact O-CG2 3.3Å; T23-V27 PolarHBondContact O-N 3.46Å |
| 24 | T | 37.4 | Very low | 38.3 | Very low | 66 Ų | 66 | 83.5 Ų | 83.5 | 41% | 0.405 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -75 | -36.2 | 176.8 | 48.8 | 0 | 0 | 0 | 0 | 112.6 | V20 T21 V27 V28 | V20-T24 WeakPolarHBondContact O-CG2 3.07Å; V20-T24 PolarHBondContact O-N 3.48Å; V20-T24 PolarHBondContact O-OG1 3.39Å; V20-T24 VanDerWaalsContact O-OG1 3.08Å; T21-T24 WeakPolarHBondContact CA-OG1 3.37Å; T21-T24 PolarHBondContact O-N 2.65Å; T21-T24 PolarHBondContact O-OG1 2.88Å; T21-T24 VanDerWaalsContact O-OG1 3.06Å; T24-V27 PolarHBondContact O-N 2.87Å; T24-V28 WeakPolarHBondContact O-CG2 3.28Å; T24-V28 PolarHBondContact O-N 3.34Å |
| 25 | Q | 34.7 | Very low | 38.7 | Very low | 136 Ų | 136 | 83.1 Ų | 83.1 | 64% | 0.636 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -67.5 | -36.6 | 175.3 | -75.2 | 178.5 | -17.4 | 0 | 0 | 112.6 | T21 V27 V28 G29 | T21-Q25 HydrophobicContact CG2-CG 4.37Å; T21-Q25 WeakPolarHBondContact O-CB 3.49Å; T21-Q25 VanDerWaalsContact O-CG 3.3Å; T21-Q25 WeakPolarHBondContact O-CG 3.38Å; T21-Q25 PolarHBondContact O-N 2.92Å; Q25-V27 VanDerWaalsContact C-N 3.3Å; Q25-V27 PolarHBondContact O-N 3.06Å; Q25-V28 PolarHBondContact O-N 3.5Å; Q25-G29 PolarHBondContact O-N 3.28Å |
| 26 | A | 38 | Very low | 38.5 | Very low | 62 Ų | 62 | 81.4 Ų | 81.4 | 51% | 0.512 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.1 | -34.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A22 T30 | A22-A26 WeakPolarHBondContact O-CB 3.47Å; A22-A26 PolarHBondContact O-N 3.08Å; A22-A26 VanDerWaalsContact O-N 3.09Å; A26-T30 PolarHBondContact O-N 3.33Å; A26-T30 PolarHBondContact O-OG1 2.89Å |
| 27 | V | 40.7 | Very low | 38.7 | Very low | 82 Ų | 82 | 83 Ų | 83 | 50% | 0.497 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -77.4 | -34.7 | 179 | 172.7 | 0 | 0 | 0 | 0 | 112.3 | T23 T24 Q25 T30 S31 | T23-V27 VanDerWaalsContact O-CG2 3.24Å; T23-V27 WeakPolarHBondContact O-CG2 3.3Å; T23-V27 PolarHBondContact O-N 3.46Å; T24-V27 PolarHBondContact O-N 2.87Å; Q25-V27 VanDerWaalsContact C-N 3.3Å; Q25-V27 PolarHBondContact O-N 3.06Å; V27-T30 WeakPolarHBondContact CA-OG1 3.5Å; V27-T30 PolarHBondContact O-OG1 3.06Å; V27-T30 VanDerWaalsContact O-OG1 3.05Å; V27-S31 PolarHBondContact O-N 3.38Å |
| 28 | V | 37.9 | Very low | 38.7 | Very low | 86 Ų | 86 | 89.7 Ų | 89.7 | 52% | 0.521 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -73.2 | -42.7 | 176.5 | 174 | 0 | 0 | 0 | 0 | 111.2 | T24 Q25 T30 S31 E32 | T24-V28 WeakPolarHBondContact O-CG2 3.28Å; T24-V28 PolarHBondContact O-N 3.34Å; Q25-V28 PolarHBondContact O-N 3.5Å; V28-T30 VanDerWaalsContact C-N 3.27Å; V28-T30 PolarHBondContact O-N 2.8Å; V28-S31 PolarHBondContact O-N 3.33Å; V28-S31 VanDerWaalsContact O-N 3.17Å; V28-E32 PolarHBondContact O-N 2.93Å; V28-E32 VanDerWaalsContact O-N 3.13Å |
| 29 | G | 33.8 | Very low | 38.8 | Very low | 32 Ų | 32 | 95.5 Ų | 95.5 | 33% | 0.33 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.7 | -25.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | Q25 N33 | Q25-G29 PolarHBondContact O-N 3.28Å; G29-N33 PolarHBondContact O-N 3.41Å; G29-N33 PolarHBondContact O-ND2 3.46Å |
| 30 | T | 41.1 | Very low | 38.7 | Very low | 79 Ų | 79 | 97.8 Ų | 97.8 | 49% | 0.485 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -79.3 | -32.2 | 173.1 | 37.1 | 0 | 0 | 0 | 0 | 112.4 | A26 V27 V28 L34 | A26-T30 PolarHBondContact O-N 3.33Å; A26-T30 PolarHBondContact O-OG1 2.89Å; V27-T30 WeakPolarHBondContact CA-OG1 3.5Å; V27-T30 PolarHBondContact O-OG1 3.06Å; V27-T30 VanDerWaalsContact O-OG1 3.05Å; V28-T30 VanDerWaalsContact C-N 3.27Å; V28-T30 PolarHBondContact O-N 2.8Å; T30-L34 PolarHBondContact O-N 3.2Å |
| 31 | S | 35.7 | Very low | 38.6 | Very low | 79 Ų | 79 | 105.7 Ų | 105.7 | 55% | 0.552 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -68.1 | -41.5 | 174.7 | -175.1 | 0 | 0 | 0 | 0 | 112.7 | V27 V28 L34 S35 | V27-S31 PolarHBondContact O-N 3.38Å; V28-S31 PolarHBondContact O-N 3.33Å; V28-S31 VanDerWaalsContact O-N 3.17Å; S31-L34 PolarHBondContact O-N 2.9Å; S31-S35 PolarHBondContact O-N 3.46Å; S31-S35 VanDerWaalsContact O-N 3.12Å; S31-S35 PolarHBondContact O-OG 3.46Å |
| 32 | E | 36.6 | Very low | 38.5 | Very low | 129 Ų | 129 | 106 Ų | 106 | 60% | 0.603 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.4 | -38.4 | 179.1 | -75.1 | -174.1 | 155 | 0 | 0 | 112.4 | V28 L34 S35 A36 | V28-E32 PolarHBondContact O-N 2.93Å; V28-E32 VanDerWaalsContact O-N 3.13Å; E32-L34 VanDerWaalsContact C-N 3.32Å; E32-L34 PolarHBondContact O-N 3.11Å; E32-S35 WeakPolarHBondContact CA-OG 3.48Å; E32-S35 PolarHBondContact O-N 3.03Å; E32-S35 PolarHBondContact O-OG 2.73Å; E32-A36 PolarHBondContact O-N 3.11Å |
| 33 | N | 38.6 | Very low | 38.8 | Very low | 109 Ų | 109 | 109.2 Ų | 109.2 | 58% | 0.583 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.8 | -32.9 | 173.9 | -79.7 | -26.8 | 0 | 0 | 0 | 112.5 | G29 L37 | G29-N33 PolarHBondContact O-N 3.41Å; G29-N33 PolarHBondContact O-ND2 3.46Å; N33-L37 WeakPolarHBondContact O-CB 3.49Å; N33-L37 PolarHBondContact O-N 2.95Å; N33-L37 VanDerWaalsContact O-N 3.09Å |
| 34 | L | 41.8 | Very low | 38.6 | Very low | 128 Ų | 128 | 112.9 Ų | 112.9 | 67% | 0.67 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -71.9 | -33.4 | 176.3 | -130.5 | 92.6 | 0 | 0 | 0 | 112.6 | T30 S31 E32 R38 | T30-L34 PolarHBondContact O-N 3.2Å; S31-L34 PolarHBondContact O-N 2.9Å; E32-L34 VanDerWaalsContact C-N 3.32Å; E32-L34 PolarHBondContact O-N 3.11Å; L34-R38 PolarHBondContact O-N 3.31Å |
| 35 | S | 41.4 | Very low | 38.6 | Very low | 67 Ų | 67 | 115.1 Ų | 115.1 | 47% | 0.469 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -70.9 | -40.5 | 172.7 | 40.4 | 0 | 0 | 0 | 0 | 112.1 | S31 E32 L37 R38 E39 | S31-S35 PolarHBondContact O-N 3.46Å; S31-S35 VanDerWaalsContact O-N 3.12Å; S31-S35 PolarHBondContact O-OG 3.46Å; E32-S35 WeakPolarHBondContact CA-OG 3.48Å; E32-S35 PolarHBondContact O-N 3.03Å; E32-S35 PolarHBondContact O-OG 2.73Å; S35-L37 VanDerWaalsContact C-N 3.33Å; S35-L37 PolarHBondContact O-N 2.88Å; S35-R38 PolarHBondContact O-N 2.8Å; S35-R38 VanDerWaalsContact O-N 3.09Å; S35-E39 PolarHBondContact O-N 3.05Å |
| 36 | A | 38.8 | Very low | 38.8 | Very low | 57 Ų | 57 | 114 Ų | 114 | 47% | 0.471 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -64.4 | -35.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | E32 R38 | E32-A36 PolarHBondContact O-N 3.11Å; A36-R38 VanDerWaalsContact C-N 3.3Å; A36-R38 PolarHBondContact O-N 3.48Å |
| 37 | L | 43.2 | Very low | 38.4 | Very low | 120 Ų | 120 | 120.7 Ų | 120.7 | 63% | 0.628 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -71.8 | -20.6 | 173.8 | -83.4 | 161.8 | 0 | 0 | 0 | 113.7 | N33 S35 | N33-L37 WeakPolarHBondContact O-CB 3.49Å; N33-L37 PolarHBondContact O-N 2.95Å; N33-L37 VanDerWaalsContact O-N 3.09Å; S35-L37 VanDerWaalsContact C-N 3.33Å; S35-L37 PolarHBondContact O-N 2.88Å |
| 38 | R | 41.3 | Very low | 38.5 | Very low | 216 Ų | 216 | 123.3 Ų | 123.3 | 82% | 0.815 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -85.4 | -26.8 | -179.1 | -161.6 | 171.8 | -173.2 | 161 | 1 | 112.7 | L34 S35 A36 Q40 | L34-R38 PolarHBondContact O-N 3.31Å; S35-R38 PolarHBondContact O-N 2.8Å; S35-R38 VanDerWaalsContact O-N 3.09Å; A36-R38 VanDerWaalsContact C-N 3.3Å; A36-R38 PolarHBondContact O-N 3.48Å; R38-Q40 VanDerWaalsContact C-N 3.34Å |
| 39 | E | 39.2 | Very low | 38.2 | Very low | 176 Ų | 176 | 127.9 Ų | 127.9 | 82% | 0.822 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -73.7 | -21.1 | 175 | -94 | -178.7 | 151.7 | 0 | 0 | 113.7 | S35 | S35-E39 PolarHBondContact O-N 3.05Å |
| 40 | Q | 38.6 | Very low | 38.7 | Very low | 168 Ų | 168 | 131.3 Ų | 131.3 | 79% | 0.785 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.9 | -7.4 | -178.2 | -121.6 | 178.7 | -7 | 0 | 0 | 114.8 | R38 G42 | R38-Q40 VanDerWaalsContact C-N 3.34Å; Q40-G42 PolarHBondContact O-N 2.84Å |
| 41 | R | 40 | Very low | 38.5 | Very low | 233 Ų | 233 | 133.1 Ų | 133.1 | 88% | 0.879 | 72% | 0.722 | S | S | * | * | trans | -88.9 | 30.1 | -178.4 | -162.4 | 178.4 | -84.6 | -178.6 | -6.3 | 112.7 | ||||
| 42 | G | 36.3 | Very low | 38.8 | Very low | 59 Ų | 59 | 132.4 Ų | 132.4 | 61% | 0.608 | 72% | 0.717 | S | S | * | * | trans | -114.4 | 20.2 | -168.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | Q40 | Q40-G42 PolarHBondContact O-N 2.84Š| ||
| 43 | T | 40.8 | Very low | 39.3 | Very low | 126 Ų | 126 | 131.8 Ų | 131.8 | 77% | 0.773 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -161 | 140 | 170.3 | 17.9 | 0 | 0 | 0 | 0 | 112.7 | ||
| 44 | D | 34.9 | Very low | 39.5 | Very low | 161 Ų | 161 | 129.5 Ų | 129.5 | 86% | 0.861 | 72% | 0.718 | S | S | * | * | trans | 92.2 | 130.6 | 161.3 | -64.1 | -17.5 | 0 | 0 | 0 | 122 | ||||
| 45 | S | 37.6 | Very low | 39.5 | Very low | 112 Ų | 112 | 125.9 Ų | 125.9 | 78% | 0.783 | 71% | 0.707 | S | S | * | * | trans | -102.6 | 153.9 | -167.9 | -61.3 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 46 | S | 39.1 | Very low | 39.8 | Very low | 114 Ų | 114 | 127.2 Ų | 127.2 | 80% | 0.797 | 71% | 0.712 | S | S | * | * | trans | 59.4 | 106.4 | 148.4 | -56.8 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 47 | E | 28.7 | Very low | 40.2 | Very low | 202 Ų | 202 | 130.3 Ų | 130.3 | 94% | 0.944 | 72% | 0.72 | S | S | * | * | -172.1 | 158 | 122.7 | -124.3 | 169.7 | 136.1 | 0 | 0 | 112.8 | |||||
| 48 | V | 43.3 | Very low | 40.5 | Very low | 137 Ų | 137 | 127.8 Ų | 127.8 | 83% | 0.83 | 71% | 0.713 | S | S | * | * | trans | -88.5 | 117.7 | -172.6 | 173.1 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 49 | Q | 31.6 | Very low | 40.6 | Very low | 181 Ų | 181 | 119.9 Ų | 119.9 | 85% | 0.846 | 69% | 0.693 | S | S | * | * | trans | -165.9 | 170.8 | 164.2 | -112.3 | 166.4 | -21.8 | 0 | 0 | 112.7 | ||||
| 50 | P | 43.4 | Very low | 41 | Very low | 104 Ų | 104 | 114.3 Ų | 114.3 | 68% | 0.675 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -74.4 | 177.5 | -143 | 43.2 | -41.2 | 0 | 0 | 0 | 112.6 | S52 | P50-S52 PolarHBondContact O-N 3.5Š|
| 51 | P | 38.7 | Very low | 41.6 | Very low | 117 Ų | 117 | 108.7 Ų | 108.7 | 76% | 0.76 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -51.5 | 112.9 | -151 | 27.3 | -32.3 | 0 | 0 | 0 | 110.6 | ||
| 52 | S | 40.3 | Very low | 42.2 | Very low | 65 Ų | 65 | 101.7 Ų | 101.7 | 46% | 0.455 | 64% | 0.642 | S | S | . | * | trans | -61.5 | 145.4 | -164.6 | 51.8 | 0 | 0 | 0 | 0 | 110.6 | P50 A54 A55 V56 | P50-S52 PolarHBondContact O-N 3.5Å; S52-A54 PolarHBondContact O-N 3.32Å; S52-A55 WeakPolarHBondContact O-CA 3.45Å; S52-A55 WeakPolarHBondContact O-CB 3.23Å; S52-A55 PolarHBondContact O-N 2.94Å; S52-V56 PolarHBondContact O-N 2.86Å | ||
| 53 | T | 47.1 | Very low | 43.1 | Very low | 115 Ų | 115 | 104 Ų | 104 | 71% | 0.706 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -49 | -26.4 | 168.9 | 42.5 | 0 | 0 | 0 | 0 | 112.1 | V56 L57 | T53-V56 PolarHBondContact O-N 2.73Å; T53-L57 VanDerWaalsContact O-CB 3.27Å; T53-L57 WeakPolarHBondContact O-CB 3.41Å; T53-L57 WeakPolarHBondContact O-CD1 3.48Å; T53-L57 WeakPolarHBondContact O-CG 3.29Å; T53-L57 PolarHBondContact O-N 3.33Å |
| 54 | A | 43.8 | Very low | 43.9 | Very low | 61 Ų | 61 | 99.8 Ų | 99.8 | 50% | 0.504 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -64.2 | -35.2 | 170.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | S52 S58 | S52-A54 PolarHBondContact O-N 3.32Å; A54-S58 WeakPolarHBondContact O-CB 3.46Å; A54-S58 PolarHBondContact O-N 2.99Å |
| 55 | A | 41.5 | Very low | 45.3 | Very low | 52 Ų | 52 | 97.1 Ų | 97.1 | 43% | 0.43 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -72.1 | -37.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | S52 S58 A59 | S52-A55 WeakPolarHBondContact O-CA 3.45Å; S52-A55 WeakPolarHBondContact O-CB 3.23Å; S52-A55 PolarHBondContact O-N 2.94Å; A55-S58 PolarHBondContact O-N 3.1Å; A55-A59 WeakPolarHBondContact O-CB 3.44Å; A55-A59 PolarHBondContact O-N 3.06Å |
| 56 | V | 48.3 | Very low | 46.7 | Very low | 96 Ų | 96 | 94.8 Ų | 94.8 | 58% | 0.582 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -70.9 | -40 | 174.4 | -178.1 | 0 | 0 | 0 | 0 | 111.3 | S52 T53 A59 A60 | S52-V56 PolarHBondContact O-N 2.86Å; T53-V56 PolarHBondContact O-N 2.73Å; V56-A59 PolarHBondContact O-N 3.21Å; V56-A60 VanDerWaalsContact O-CB 3.28Å; V56-A60 WeakPolarHBondContact O-CB 3.29Å; V56-A60 PolarHBondContact O-N 2.97Å |
| 57 | L | 46.4 | Very low | 48.1 | Very low | 121 Ų | 121 | 92.5 Ų | 92.5 | 63% | 0.634 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -67.2 | -36 | 172.1 | -86 | 153.8 | 0 | 0 | 0 | 112 | T53 A61 | T53-L57 VanDerWaalsContact O-CB 3.27Å; T53-L57 WeakPolarHBondContact O-CB 3.41Å; T53-L57 WeakPolarHBondContact O-CD1 3.48Å; T53-L57 WeakPolarHBondContact O-CG 3.29Å; T53-L57 PolarHBondContact O-N 3.33Å; L57-A61 WeakPolarHBondContact O-CB 3.37Å; L57-A61 PolarHBondContact O-N 3.37Å |
| 58 | S | 49 | Very low | 50.1 | Low | 68 Ų | 68 | 87.2 Ų | 87.2 | 48% | 0.476 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -68.2 | -40.1 | 172.9 | -176.1 | 0 | 0 | 0 | 0 | 111.4 | A54 A55 A61 V62 | A54-S58 WeakPolarHBondContact O-CB 3.46Å; A54-S58 PolarHBondContact O-N 2.99Å; A55-S58 PolarHBondContact O-N 3.1Å; S58-A61 PolarHBondContact O-N 3.44Å; S58-V62 VanDerWaalsContact O-CB 3.28Å; S58-V62 WeakPolarHBondContact O-CB 3.15Å; S58-V62 WeakPolarHBondContact O-CG2 3.11Å; S58-V62 PolarHBondContact O-N 3.03Å |
| 59 | A | 44.5 | Very low | 51.5 | Low | 49 Ų | 49 | 86.4 Ų | 86.4 | 41% | 0.405 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66.3 | -45.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111 | A55 V56 A61 V62 D63 | A55-A59 WeakPolarHBondContact O-CB 3.44Å; A55-A59 PolarHBondContact O-N 3.06Å; V56-A59 PolarHBondContact O-N 3.21Å; A59-A61 VanDerWaalsContact C-N 3.34Å; A59-A61 PolarHBondContact O-N 3.28Å; A59-V62 PolarHBondContact O-N 2.71Å; A59-D63 WeakPolarHBondContact O-CB 3.3Å; A59-D63 VanDerWaalsContact O-CG 3.29Å; A59-D63 PolarHBondContact O-N 2.98Å |
| 60 | A | 47.3 | Very low | 53.6 | Low | 60 Ų | 60 | 79.8 Ų | 79.8 | 50% | 0.496 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.3 | -33.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | V56 G64 | V56-A60 VanDerWaalsContact O-CB 3.28Å; V56-A60 WeakPolarHBondContact O-CB 3.29Å; V56-A60 PolarHBondContact O-N 2.97Å; A60-G64 PolarHBondContact O-N 3.08Å |
| 61 | A | 51.3 | Low | 55.3 | Low | 49 Ų | 49 | 80 Ų | 80 | 41% | 0.405 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -73.8 | -33.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L57 S58 A59 N65 | L57-A61 WeakPolarHBondContact O-CB 3.37Å; L57-A61 PolarHBondContact O-N 3.37Å; S58-A61 PolarHBondContact O-N 3.44Å; A59-A61 VanDerWaalsContact C-N 3.34Å; A59-A61 PolarHBondContact O-N 3.28Å; A61-N65 WeakPolarHBondContact O-CB 3.36Å; A61-N65 PolarHBondContact O-N 3.33Å; A61-N65 PolarHBondContact O-ND2 2.77Å; A61-N65 PolarHBondContact O-OD1 2.84Å |
| 62 | V | 52.8 | Low | 57.1 | Low | 86 Ų | 86 | 79.5 Ų | 79.5 | 52% | 0.521 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -69.6 | -39.4 | 173.1 | 168.2 | 0 | 0 | 0 | 0 | 110.7 | S58 A59 S66 | S58-V62 VanDerWaalsContact O-CB 3.28Å; S58-V62 WeakPolarHBondContact O-CB 3.15Å; S58-V62 WeakPolarHBondContact O-CG2 3.11Å; S58-V62 PolarHBondContact O-N 3.03Å; A59-V62 PolarHBondContact O-N 2.71Å; V62-S66 VanDerWaalsContact O-CB 3.24Å; V62-S66 WeakPolarHBondContact O-CB 3.39Å; V62-S66 PolarHBondContact O-N 2.91Å; V62-S66 PolarHBondContact O-OG 3.25Å |
| 63 | D | 55.3 | Low | 59 | Low | 108 Ų | 108 | 78.3 Ų | 78.3 | 58% | 0.578 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -68.6 | -40 | 173.7 | -70.6 | -25.6 | 0 | 0 | 0 | 111.6 | A59 S66 A67 | A59-D63 WeakPolarHBondContact O-CB 3.3Å; A59-D63 VanDerWaalsContact O-CG 3.29Å; A59-D63 PolarHBondContact O-N 2.98Å; D63-S66 VanDerWaalsContact CA-OG 3.32Å; D63-S66 WeakPolarHBondContact CA-OG 3.4Å; D63-S66 PolarHBondContact O-OG 3.28Å; D63-S66 VanDerWaalsContact O-OG 3.05Å; D63-A67 VanDerWaalsContact O-CB 3.24Å; D63-A67 WeakPolarHBondContact O-CB 3.31Å; D63-A67 PolarHBondContact O-N 3.09Å |
| 64 | G | 57.9 | Low | 60.7 | Low | 38 Ų | 38 | 75.1 Ų | 75.1 | 39% | 0.392 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | A60 L68 | A60-G64 PolarHBondContact O-N 3.08Å; G64-L68 VanDerWaalsContact O-CB 3.29Å; G64-L68 WeakPolarHBondContact O-CB 3.42Å; G64-L68 PolarHBondContact O-N 3.4Å |
| 65 | N | 63.1 | Low | 62.7 | Low | 104 Ų | 104 | 75.8 Ų | 75.8 | 56% | 0.556 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -70.7 | -37 | 178.3 | -71 | -15.2 | 0 | 0 | 0 | 112 | A61 Q69 | A61-N65 WeakPolarHBondContact O-CB 3.36Å; A61-N65 PolarHBondContact O-N 3.33Å; A61-N65 PolarHBondContact O-ND2 2.77Å; A61-N65 PolarHBondContact O-OD1 2.84Å; N65-Q69 WeakPolarHBondContact O-CB 3.32Å; N65-Q69 PolarHBondContact O-N 3.46Å |
| 66 | S | 67.2 | Low | 64.6 | Low | 64 Ų | 64 | 75.2 Ų | 75.2 | 45% | 0.448 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -72.2 | -36.1 | 176.3 | 54.5 | 0 | 0 | 0 | 0 | 112.4 | V62 D63 G70 | V62-S66 VanDerWaalsContact O-CB 3.24Å; V62-S66 WeakPolarHBondContact O-CB 3.39Å; V62-S66 PolarHBondContact O-N 2.91Å; V62-S66 PolarHBondContact O-OG 3.25Å; D63-S66 VanDerWaalsContact CA-OG 3.32Å; D63-S66 WeakPolarHBondContact CA-OG 3.4Å; D63-S66 PolarHBondContact O-OG 3.28Å; D63-S66 VanDerWaalsContact O-OG 3.05Å; S66-G70 PolarHBondContact O-N 3.37Å |
| 67 | A | 67.9 | Low | 66.4 | Low | 66 Ų | 66 | 71.2 Ų | 71.2 | 55% | 0.545 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66 | -42.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | D63 G70 L71 | D63-A67 VanDerWaalsContact O-CB 3.24Å; D63-A67 WeakPolarHBondContact O-CB 3.31Å; D63-A67 PolarHBondContact O-N 3.09Å; A67-G70 PolarHBondContact O-N 2.98Å; A67-L71 WeakPolarHBondContact O-CB 3.33Å; A67-L71 PolarHBondContact O-N 3.39Å |
| 68 | L | 71.7 | Confident | 68.4 | Low | 90 Ų | 90 | 71 Ų | 71 | 47% | 0.471 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -65.2 | -43.1 | 176.8 | -169.8 | 67.6 | 0 | 0 | 0 | 111.5 | G64 G70 L71 E72 | G64-L68 VanDerWaalsContact O-CB 3.29Å; G64-L68 WeakPolarHBondContact O-CB 3.42Å; G64-L68 PolarHBondContact O-N 3.4Å; L68-G70 VanDerWaalsContact C-N 3.34Å; L68-G70 PolarHBondContact O-N 3.49Å; L68-L71 PolarHBondContact O-N 2.92Å; L68-E72 WeakPolarHBondContact O-CG 3.45Å; L68-E72 PolarHBondContact O-N 3.38Å |
| 69 | Q | 71.7 | Confident | 70.2 | Confident | 121 Ų | 121 | 70.3 Ų | 70.3 | 57% | 0.565 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -66.1 | -35.9 | 176.2 | -167.8 | 167.3 | 3.1 | 0 | 0 | 112 | N65 V73 | N65-Q69 WeakPolarHBondContact O-CB 3.32Å; N65-Q69 PolarHBondContact O-N 3.46Å; Q69-V73 VanDerWaalsContact O-CG2 3.26Å; Q69-V73 WeakPolarHBondContact O-CG2 3.28Å; Q69-V73 PolarHBondContact O-N 3.44Å; Q69-V73 VanDerWaalsContact O-N 3.07Å |
| 70 | G | 75.6 | Confident | 72.1 | Confident | 41 Ų | 41 | 68.3 Ų | 68.3 | 42% | 0.423 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.2 | -40.5 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | S66 A67 L68 A74 | S66-G70 PolarHBondContact O-N 3.37Å; A67-G70 PolarHBondContact O-N 2.98Å; L68-G70 VanDerWaalsContact C-N 3.34Å; L68-G70 PolarHBondContact O-N 3.49Å; G70-A74 WeakPolarHBondContact O-CB 3.36Å; G70-A74 PolarHBondContact O-N 2.6Å |
| 71 | L | 79.8 | Confident | 74.2 | Confident | 108 Ų | 108 | 69 Ų | 69 | 57% | 0.565 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -66.1 | -43.9 | 175.5 | -178.7 | 63.4 | 0 | 0 | 0 | 111.6 | A67 L68 A74 V75 | A67-L71 WeakPolarHBondContact O-CB 3.33Å; A67-L71 PolarHBondContact O-N 3.39Å; L68-L71 PolarHBondContact O-N 2.92Å; L71-A74 PolarHBondContact O-N 3.29Å; L71-V75 HydrophobicContact CD1-CG2 4.42Å; L71-V75 WeakPolarHBondContact O-CG2 3.44Å; L71-V75 PolarHBondContact O-N 3.43Å |
| 72 | E | 77 | Confident | 76 | Confident | 107 Ų | 107 | 73.2 Ų | 73.2 | 50% | 0.5 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -55.5 | -55.7 | 174.9 | -76.5 | -175.3 | 174.1 | 0 | 0 | 110.3 | L68 A74 V75 Q76 | L68-E72 WeakPolarHBondContact O-CG 3.45Å; L68-E72 PolarHBondContact O-N 3.38Å; E72-A74 VanDerWaalsContact C-N 3.3Å; E72-A74 PolarHBondContact O-N 3.01Å; E72-V75 PolarHBondContact O-N 3.14Å; E72-V75 VanDerWaalsContact O-N 3.1Å; E72-Q76 WeakPolarHBondContact O-CG 3.35Å; E72-Q76 PolarHBondContact O-N 3.41Å |
| 73 | V | 79.8 | Confident | 77.8 | Confident | 41 Ų | 41 | 69.7 Ų | 69.7 | 25% | 0.248 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -56.6 | -41.9 | 178.7 | 171.4 | 0 | 0 | 0 | 0 | 111.8 | Q69 Q76 A77 L134 | Q69-V73 VanDerWaalsContact O-CG2 3.26Å; Q69-V73 WeakPolarHBondContact O-CG2 3.28Å; Q69-V73 PolarHBondContact O-N 3.44Å; Q69-V73 VanDerWaalsContact O-N 3.07Å; V73-Q76 PolarHBondContact O-N 2.93Å; V73-A77 WeakPolarHBondContact O-CB 3.42Å; V73-A77 PolarHBondContact O-N 3.18Å; V73-L134 HydrophobicContact CG1-CD1 4.46Å; V73-L134 HydrophobicContact CG1-CD2 4.37Å; V73-L134 HydrophobicContact CG1-CG 4.07Å |
| 74 | A | 83.3 | Confident | 79.5 | Confident | 47 Ų | 47 | 67.3 Ų | 67.3 | 39% | 0.388 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -62.7 | -43.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | G70 L71 E72 A77 L78 | G70-A74 WeakPolarHBondContact O-CB 3.36Å; G70-A74 PolarHBondContact O-N 2.6Å; L71-A74 PolarHBondContact O-N 3.29Å; E72-A74 VanDerWaalsContact C-N 3.3Å; E72-A74 PolarHBondContact O-N 3.01Å; A74-A77 PolarHBondContact O-N 3.29Å; A74-L78 VanDerWaalsContact O-CG 3.3Å; A74-L78 WeakPolarHBondContact O-CG 3.27Å; A74-L78 PolarHBondContact O-N 2.9Å |
| 75 | V | 84.5 | Confident | 81.1 | Confident | 75 Ų | 75 | 69.2 Ų | 69.2 | 46% | 0.455 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.1 | -44 | 175.4 | 172.7 | 0 | 0 | 0 | 0 | 110.5 | L71 E72 A77 L78 V79 | L71-V75 HydrophobicContact CD1-CG2 4.42Å; L71-V75 WeakPolarHBondContact O-CG2 3.44Å; L71-V75 PolarHBondContact O-N 3.43Å; E72-V75 PolarHBondContact O-N 3.14Å; E72-V75 VanDerWaalsContact O-N 3.1Å; V75-A77 VanDerWaalsContact C-N 3.33Å; V75-A77 PolarHBondContact O-N 2.92Å; V75-L78 PolarHBondContact O-N 3.27Å; V75-V79 HydrophobicContact CG1-CG2 4.42Å; V75-V79 VanDerWaalsContact O-CG2 3.32Å; V75-V79 WeakPolarHBondContact O-CG2 3.44Å; V75-V79 PolarHBondContact O-N 3.09Å |
| 76 | Q | 82.4 | Confident | 82.4 | Confident | 40 Ų | 40 | 66.4 Ų | 66.4 | 19% | 0.187 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -58.2 | -46.2 | 176.9 | -49 | -145.2 | -26.3 | 0 | 0 | 111.4 | E72 V73 V79 L80 L134 W335 | E72-Q76 WeakPolarHBondContact O-CG 3.35Å; E72-Q76 PolarHBondContact O-N 3.41Å; V73-Q76 PolarHBondContact O-N 2.93Å; Q76-V79 PolarHBondContact O-N 2.87Å; Q76-L80 WeakPolarHBondContact O-CB 3.3Å; Q76-L80 WeakPolarHBondContact O-CG 3.39Å; Q76-L80 PolarHBondContact O-N 3.42Å; Q76-L134 HydrophobicContact CB-CD1 3.8Å; Q76-L134 HydrophobicContact CB-CD2 3.7Å; Q76-L134 HydrophobicContact CB-CG 4.4Å; Q76-L134 HydrophobicContact CG-CD1 4.25Å; Q76-W335 VanDerWaalsContact CA-CH2 3.47Å; Q76-W335 HydrophobicContact CB-CH2 3.4Å; Q76-W335 VanDerWaalsContact CB-CH2 3.4Å; Q76-W335 HydrophobicContact CB-CZ2 3.54Å; Q76-W335 HydrophobicContact CG-CH2 3.44Å; Q76-W335 VanDerWaalsContact CG-CH2 3.44Å; Q76-W335 HydrophobicContact CG-CZ2 3.82Å |
| 77 | A | 85.6 | Confident | 83.6 | Confident | 12 Ų | 12 | 63.5 Ų | 63.5 | 10% | 0.099 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -62.7 | -45.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | V73 A74 V75 V79 L80 L81 F131 L134 F135 | V73-A77 WeakPolarHBondContact O-CB 3.42Å; V73-A77 PolarHBondContact O-N 3.18Å; A74-A77 PolarHBondContact O-N 3.29Å; V75-A77 VanDerWaalsContact C-N 3.33Å; V75-A77 PolarHBondContact O-N 2.92Å; A77-V79 PolarHBondContact O-N 3.21Å; A77-L80 PolarHBondContact O-N 2.93Å; A77-L81 VanDerWaalsContact O-CB 3.23Å; A77-L81 WeakPolarHBondContact O-CB 3.29Å; A77-L81 PolarHBondContact O-N 3.43Å; A77-F131 HydrophobicContact CB-CE2 3.81Å; A77-F131 HydrophobicContact CB-CZ 4.38Å; A77-F131 WeakPolarHBondContact O-CE2 3.18Å; A77-L134 HydrophobicContact CB-CD2 3.63Å; A77-L134 VanDerWaalsContact N-CD2 3.31Å; A77-F135 HydrophobicContact CB-CZ 4.1Å |
| 78 | L | 88.4 | Confident | 84.8 | Confident | 117 Ų | 117 | 61 Ų | 61 | 61% | 0.613 | 33% | 0.33 | S | S | * | . | H | α-helix | trans | -63.2 | -42.4 | 178.9 | -72.9 | 172.4 | 0 | 0 | 0 | 112.1 | A74 V75 F82 | A74-L78 VanDerWaalsContact O-CG 3.3Å; A74-L78 WeakPolarHBondContact O-CG 3.27Å; A74-L78 PolarHBondContact O-N 2.9Å; V75-L78 PolarHBondContact O-N 3.27Å; L78-F82 WeakPolarHBondContact O-CB 3.45Å; L78-F82 PolarHBondContact O-N 3.32Å |
| 79 | V | 87.1 | Confident | 85.7 | Confident | 54 Ų | 54 | 62.2 Ų | 62.2 | 33% | 0.327 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64.5 | -47.8 | 177.8 | 171.3 | 0 | 0 | 0 | 0 | 110.9 | V75 Q76 A77 L81 F82 I83 W335 | V75-V79 HydrophobicContact CG1-CG2 4.42Å; V75-V79 VanDerWaalsContact O-CG2 3.32Å; V75-V79 WeakPolarHBondContact O-CG2 3.44Å; V75-V79 PolarHBondContact O-N 3.09Å; Q76-V79 PolarHBondContact O-N 2.87Å; A77-V79 PolarHBondContact O-N 3.21Å; V79-L81 PolarHBondContact O-N 3.03Å; V79-F82 WeakPolarHBondContact O-CB 3.44Å; V79-F82 PolarHBondContact O-N 3.47Å; V79-I83 HydrophobicContact CG1-CD1 3.89Å; V79-I83 WeakPolarHBondContact O-CG1 3.23Å; V79-I83 PolarHBondContact O-N 2.93Å; V79-W335 HydrophobicContact CB-CZ3 4.46Å; V79-W335 HydrophobicContact CG1-CE3 3.99Å; V79-W335 HydrophobicContact CG1-CZ3 4.32Å |
| 80 | L | 85.3 | Confident | 86.6 | Confident | 7 Ų | 7 | 57.2 Ų | 57.2 | 4% | 0.037 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -63.5 | -41.6 | 178.5 | -74.2 | 174.6 | 0 | 0 | 0 | 112.2 | Q76 A77 F82 I83 F84 F131 L134 W335 W338 | Q76-L80 WeakPolarHBondContact O-CB 3.3Å; Q76-L80 WeakPolarHBondContact O-CG 3.39Å; Q76-L80 PolarHBondContact O-N 3.42Å; A77-L80 PolarHBondContact O-N 2.93Å; L80-F82 VanDerWaalsContact C-N 3.32Å; L80-F82 PolarHBondContact O-N 2.97Å; L80-I83 PolarHBondContact O-N 3.13Å; L80-F84 VanDerWaalsContact O-CB 3.29Å; L80-F84 WeakPolarHBondContact O-CB 3.31Å; L80-F84 PolarHBondContact O-N 3.01Å; L80-F131 HydrophobicContact CB-CD2 4.14Å; L80-L134 HydrophobicContact CD1-CD2 4.49Å; L80-W335 HydrophobicContact CD2-CG 4.35Å; L80-W338 HydrophobicContact CD2-CE3 3.67Å; L80-W338 HydrophobicContact CD2-CZ3 3.68Å |
| 81 | L | 89.9 | Confident | 87.4 | Confident | 75 Ų | 75 | 55.2 Ų | 55.2 | 39% | 0.393 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -61 | -43 | 175 | -179.1 | 65.1 | 0 | 0 | 0 | 111 | A77 V79 F84 L85 F131 | A77-L81 VanDerWaalsContact O-CB 3.23Å; A77-L81 WeakPolarHBondContact O-CB 3.29Å; A77-L81 PolarHBondContact O-N 3.43Å; V79-L81 PolarHBondContact O-N 3.03Å; L81-F84 HydrophobicContact CD1-CD1 4.47Å; L81-F84 PolarHBondContact O-N 3.17Å; L81-L85 HydrophobicContact CD1-CD1 4.34Å; L81-L85 HydrophobicContact CD1-CG 4.34Å; L81-L85 HydrophobicContact CG-CD1 4.17Å; L81-L85 WeakPolarHBondContact O-CB 3.29Å; L81-L85 VanDerWaalsContact O-CG 3.31Å; L81-L85 WeakPolarHBondContact O-CG 3.32Å; L81-L85 PolarHBondContact O-N 2.94Å; L81-F131 HydrophobicContact CB-CE2 4.43Å |
| 82 | F | 90.1 | Very high | 88 | Confident | 136 Ų | 136 | 51.9 Ų | 51.9 | 60% | 0.596 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -62.7 | -46.9 | 176.9 | -179.4 | -98.3 | 0 | 0 | 0 | 112 | L78 V79 L80 F84 L85 L86 | L78-F82 WeakPolarHBondContact O-CB 3.45Å; L78-F82 PolarHBondContact O-N 3.32Å; V79-F82 WeakPolarHBondContact O-CB 3.44Å; V79-F82 PolarHBondContact O-N 3.47Å; L80-F82 VanDerWaalsContact C-N 3.32Å; L80-F82 PolarHBondContact O-N 2.97Å; F82-F84 VanDerWaalsContact C-N 3.33Å; F82-F84 PolarHBondContact O-N 3.38Å; F82-L85 PolarHBondContact O-N 3.44Å; F82-L86 HydrophobicContact CE1-CD2 4Å; F82-L86 HydrophobicContact CZ-CD2 4.15Å; F82-L86 VanDerWaalsContact O-CB 3.31Å; F82-L86 WeakPolarHBondContact O-CB 3.37Å; F82-L86 PolarHBondContact O-N 2.98Å |
| 83 | I | 90.3 | Very high | 88.5 | Confident | 13 Ų | 13 | 49.3 Ų | 49.3 | 7% | 0.067 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60 | -45.1 | 176.1 | -67.5 | 168.7 | 0 | 0 | 0 | 110.3 | V79 L80 L86 S87 L127 W338 A339 A342 | V79-I83 HydrophobicContact CG1-CD1 3.89Å; V79-I83 WeakPolarHBondContact O-CG1 3.23Å; V79-I83 PolarHBondContact O-N 2.93Å; L80-I83 PolarHBondContact O-N 3.13Å; I83-L86 PolarHBondContact O-N 3.24Å; I83-S87 WeakPolarHBondContact O-CB 3.48Å; I83-S87 PolarHBondContact O-N 3.34Å; I83-L127 HydrophobicContact CG2-CD1 4.14Å; I83-W338 HydrophobicContact CG2-CB 4.31Å; I83-A339 HydrophobicContact CD1-CB 4.41Å; I83-A342 HydrophobicContact CG2-CB 4.45Å |
| 84 | F | 91.3 | Very high | 89 | Confident | 58 Ų | 58 | 48.5 Ų | 48.5 | 25% | 0.254 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -58.5 | -52 | 178.1 | 167.6 | -101.5 | 0 | 0 | 0 | 112 | L80 L81 F82 L86 S88 A123 L127 P128 | L80-F84 VanDerWaalsContact O-CB 3.29Å; L80-F84 WeakPolarHBondContact O-CB 3.31Å; L80-F84 PolarHBondContact O-N 3.01Å; L81-F84 HydrophobicContact CD1-CD1 4.47Å; L81-F84 PolarHBondContact O-N 3.17Å; F82-F84 VanDerWaalsContact C-N 3.33Å; F82-F84 PolarHBondContact O-N 3.38Å; F84-L86 PolarHBondContact O-N 3.49Å; F84-S88 VanDerWaalsContact O-CB 3.24Å; F84-S88 WeakPolarHBondContact O-CB 3.19Å; F84-S88 PolarHBondContact O-N 2.68Å; F84-S88 PolarHBondContact O-OG 3.5Å; F84-A123 WeakPolarHBondContact CD2-O 3.44Å; F84-A123 VanDerWaalsContact CE2-O 3.27Å; F84-A123 WeakPolarHBondContact CE2-O 3.27Å; F84-L127 HydrophobicContact CB-CD1 4.15Å; F84-L127 HydrophobicContact CD2-CB 4.2Å; F84-L127 HydrophobicContact CD2-CD1 4.45Å; F84-P128 HydrophobicContact CD2-CG 4.32Å; F84-P128 HydrophobicContact CE2-CG 3.91Å |
| 85 | L | 91.7 | Very high | 89.3 | Confident | 77 Ų | 77 | 47.5 Ų | 47.5 | 40% | 0.403 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -62.8 | -46.2 | -178.8 | -70.8 | 174.6 | 0 | 0 | 0 | 111.2 | L81 F82 S88 L89 | L81-L85 HydrophobicContact CD1-CD1 4.34Å; L81-L85 HydrophobicContact CD1-CG 4.34Å; L81-L85 HydrophobicContact CG-CD1 4.17Å; L81-L85 WeakPolarHBondContact O-CB 3.29Å; L81-L85 VanDerWaalsContact O-CG 3.31Å; L81-L85 WeakPolarHBondContact O-CG 3.32Å; L81-L85 PolarHBondContact O-N 2.94Å; F82-L85 PolarHBondContact O-N 3.44Å; L85-S88 PolarHBondContact O-OG 2.95Å; L85-L89 WeakPolarHBondContact O-CB 3.33Å; L85-L89 VanDerWaalsContact O-CG 3.25Å; L85-L89 WeakPolarHBondContact O-CG 3.24Å; L85-L89 PolarHBondContact O-N 3.35Å |
| 86 | L | 91 | Very high | 89.5 | Confident | 46 Ų | 46 | 48 Ų | 48 | 24% | 0.241 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -67.6 | -42.8 | -177.7 | -174.6 | 61.7 | 0 | 0 | 0 | 111.8 | F82 I83 F84 G90 A342 L346 | F82-L86 HydrophobicContact CE1-CD2 4Å; F82-L86 HydrophobicContact CZ-CD2 4.15Å; F82-L86 VanDerWaalsContact O-CB 3.31Å; F82-L86 WeakPolarHBondContact O-CB 3.37Å; F82-L86 PolarHBondContact O-N 2.98Å; I83-L86 PolarHBondContact O-N 3.24Å; F84-L86 PolarHBondContact O-N 3.49Å; L86-G90 WeakPolarHBondContact O-CA 3.26Å; L86-G90 PolarHBondContact O-N 2.92Å; L86-A342 HydrophobicContact CB-CB 4.1Å; L86-A342 HydrophobicContact CD2-CB 3.84Å; L86-A342 HydrophobicContact CG-CB 3.96Å; L86-L346 HydrophobicContact CD1-CD2 4.38Å; L86-L346 HydrophobicContact CD1-CG 4.38Å; L86-L346 HydrophobicContact CD2-CD1 3.68Å; L86-L346 HydrophobicContact CD2-CG 4.13Å |
| 87 | S | 91.8 | Very high | 89.7 | Confident | 3 Ų | 3 | 48.8 Ų | 48.8 | 2% | 0.021 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -67.8 | -48.5 | 178.2 | -171.9 | 0 | 0 | 0 | 0 | 111.8 | I83 N91 | I83-S87 WeakPolarHBondContact O-CB 3.48Å; I83-S87 PolarHBondContact O-N 3.34Å; S87-N91 VanDerWaalsContact O-CB 3.23Å; S87-N91 WeakPolarHBondContact O-CB 3.18Å; S87-N91 PolarHBondContact O-N 3.38Å; S87-N91 PolarHBondContact O-ND2 3.37Å; S87-N91 PolarHBondContact OG-ND2 3.01Å |
| 88 | S | 92.7 | Very high | 89.7 | Confident | 12 Ų | 12 | 49 Ų | 49 | 8% | 0.084 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -66.3 | -51.4 | -178.1 | 60.1 | 0 | 0 | 0 | 0 | 112.2 | F84 L85 S92 | F84-S88 VanDerWaalsContact O-CB 3.24Å; F84-S88 WeakPolarHBondContact O-CB 3.19Å; F84-S88 PolarHBondContact O-N 2.68Å; F84-S88 PolarHBondContact O-OG 3.5Å; L85-S88 PolarHBondContact O-OG 2.95Å; S88-S92 WeakPolarHBondContact O-CB 3.48Å; S88-S92 PolarHBondContact O-N 3.49Å; S88-S92 VanDerWaalsContact O-N 3.08Å; S88-S92 PolarHBondContact O-OG 3.21Å |
| 89 | L | 91.6 | Very high | 89.7 | Confident | 117 Ų | 117 | 47.5 Ų | 47.5 | 61% | 0.613 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -69 | -43.7 | -179 | -63.2 | 173.1 | 0 | 0 | 0 | 111.5 | L85 A93 | L85-L89 WeakPolarHBondContact O-CB 3.33Å; L85-L89 VanDerWaalsContact O-CG 3.25Å; L85-L89 WeakPolarHBondContact O-CG 3.24Å; L85-L89 PolarHBondContact O-N 3.35Å; L89-A93 VanDerWaalsContact O-CB 3.31Å; L89-A93 WeakPolarHBondContact O-CB 3.47Å; L89-A93 PolarHBondContact O-N 2.83Å |
| 90 | G | 89.9 | Confident | 89.6 | Confident | 15 Ų | 15 | 52.6 Ų | 52.6 | 16% | 0.155 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -63.5 | -51.5 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L86 A93 V94 | L86-G90 WeakPolarHBondContact O-CA 3.26Å; L86-G90 PolarHBondContact O-N 2.92Å; G90-A93 PolarHBondContact O-N 2.75Å; G90-V94 WeakPolarHBondContact O-CG2 3.18Å; G90-V94 PolarHBondContact O-N 3.46Å; G90-V94 VanDerWaalsContact O-N 3.11Å |
| 91 | N | 92.7 | Very high | 89.3 | Confident | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -69.9 | -37 | -179 | -72.2 | -61 | 0 | 0 | 0 | 112.3 | S87 A93 V94 V95 S116 D119 F120 G341 P345 | S87-N91 VanDerWaalsContact O-CB 3.23Å; S87-N91 WeakPolarHBondContact O-CB 3.18Å; S87-N91 PolarHBondContact O-N 3.38Å; S87-N91 PolarHBondContact O-ND2 3.37Å; S87-N91 PolarHBondContact OG-ND2 3.01Å; N91-A93 VanDerWaalsContact C-N 3.33Å; N91-A93 PolarHBondContact O-N 2.95Å; N91-V94 PolarHBondContact O-N 3.44Å; N91-V95 WeakPolarHBondContact O-CG2 3.19Å; N91-V95 PolarHBondContact O-N 3.39Å; N91-S116 WeakPolarHBondContact CB-O 3.44Å; N91-S116 WeakPolarHBondContact OD1-CA 3.2Å; N91-S116 PolarHBondContact OD1-OG 3.41Å; N91-D119 WeakPolarHBondContact ND2-CB 3.31Å; N91-F120 HydrophobicContact CB-CB 4.02Å; N91-G341 PolarHBondContact ND2-O 3.36Å; N91-P345 HydrophobicContact CB-CG 4.4Å; N91-P345 WeakPolarHBondContact OD1-CG 3.22Å |
| 92 | S | 91.7 | Very high | 88.9 | Confident | 38 Ų | 38 | 62.7 Ų | 62.7 | 27% | 0.266 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -59 | -44.4 | 172.2 | -62.2 | 0 | 0 | 0 | 0 | 111.8 | S88 V94 V95 V96 F120 | S88-S92 WeakPolarHBondContact O-CB 3.48Å; S88-S92 PolarHBondContact O-N 3.49Å; S88-S92 VanDerWaalsContact O-N 3.08Å; S88-S92 PolarHBondContact O-OG 3.21Å; S92-V94 VanDerWaalsContact C-N 3.35Å; S92-V94 PolarHBondContact O-N 2.98Å; S92-V95 PolarHBondContact O-N 3.27Å; S92-V96 WeakPolarHBondContact O-CB 3.48Å; S92-V96 VanDerWaalsContact O-CG2 3.27Å; S92-V96 WeakPolarHBondContact O-CG2 3.29Å; S92-V96 PolarHBondContact O-N 3.36Å; S92-F120 WeakPolarHBondContact OG-CD2 3.15Å; S92-F120 WeakPolarHBondContact OG-CE2 3.25Å |
| 93 | A | 88.8 | Confident | 88.3 | Confident | 53 Ų | 53 | 67.9 Ų | 67.9 | 44% | 0.438 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L89 G90 N91 V96 V97 | L89-A93 VanDerWaalsContact O-CB 3.31Å; L89-A93 WeakPolarHBondContact O-CB 3.47Å; L89-A93 PolarHBondContact O-N 2.83Å; G90-A93 PolarHBondContact O-N 2.75Å; N91-A93 VanDerWaalsContact C-N 3.33Å; N91-A93 PolarHBondContact O-N 2.95Å; A93-V96 PolarHBondContact O-N 3.25Å; A93-V97 VanDerWaalsContact O-CB 3.31Å; A93-V97 WeakPolarHBondContact O-CB 3.44Å; A93-V97 WeakPolarHBondContact O-CG2 3.35Å; A93-V97 PolarHBondContact O-N 3.33Å |
| 94 | V | 89.2 | Confident | 87.6 | Confident | 24 Ų | 24 | 70.2 Ų | 70.2 | 15% | 0.145 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -59.8 | -48.5 | 176 | 174.5 | 0 | 0 | 0 | 0 | 110.8 | G90 N91 S92 V97 I98 I112 S116 P345 Y348 | G90-V94 WeakPolarHBondContact O-CG2 3.18Å; G90-V94 PolarHBondContact O-N 3.46Å; G90-V94 VanDerWaalsContact O-N 3.11Å; N91-V94 PolarHBondContact O-N 3.44Å; S92-V94 VanDerWaalsContact C-N 3.35Å; S92-V94 PolarHBondContact O-N 2.98Å; V94-V97 PolarHBondContact O-N 3.45Å; V94-I98 HydrophobicContact CG1-CD1 3.78Å; V94-I98 VanDerWaalsContact O-CG1 3.29Å; V94-I98 WeakPolarHBondContact O-CG1 3.32Å; V94-I98 PolarHBondContact O-N 3.31Å; V94-I98 VanDerWaalsContact O-N 3.08Å; V94-I112 HydrophobicContact CG1-CG2 4.02Å; V94-S116 WeakPolarHBondContact CG1-OG 3.37Å; V94-P345 HydrophobicContact CG2-CB 4.43Å; V94-Y348 HydrophobicContact CG1-CD2 4.43Å; V94-Y348 HydrophobicContact CG2-CD2 3.99Å |
| 95 | V | 90.4 | Very high | 87.3 | Confident | 25 Ų | 25 | 72.5 Ų | 72.5 | 15% | 0.152 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -58.8 | -50.1 | 177.6 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | N91 S92 V97 I98 I99 M113 | N91-V95 WeakPolarHBondContact O-CG2 3.19Å; N91-V95 PolarHBondContact O-N 3.39Å; S92-V95 PolarHBondContact O-N 3.27Å; V95-V97 PolarHBondContact O-N 3.12Å; V95-I98 PolarHBondContact O-N 3.48Å; V95-I99 HydrophobicContact CG1-CD1 3.74Å; V95-I99 VanDerWaalsContact O-CG1 3.3Å; V95-I99 WeakPolarHBondContact O-CG1 3.39Å; V95-I99 PolarHBondContact O-N 3.02Å; V95-M113 HydrophobicContact CG1-CE 4.1Å; V95-M113 HydrophobicContact CG2-CG 4.5Å |
| 96 | V | 88.1 | Confident | 87 | Confident | 86 Ų | 86 | 72 Ų | 72 | 52% | 0.521 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -61.8 | -43.8 | -179.5 | 170.1 | 0 | 0 | 0 | 0 | 111.7 | S92 A93 I98 I99 K100 | S92-V96 WeakPolarHBondContact O-CB 3.48Å; S92-V96 VanDerWaalsContact O-CG2 3.27Å; S92-V96 WeakPolarHBondContact O-CG2 3.29Å; S92-V96 PolarHBondContact O-N 3.36Å; A93-V96 PolarHBondContact O-N 3.25Å; V96-I98 PolarHBondContact O-N 2.89Å; V96-I99 PolarHBondContact O-N 3.41Å; V96-K100 VanDerWaalsContact O-CB 3.23Å; V96-K100 WeakPolarHBondContact O-CB 3.35Å; V96-K100 PolarHBondContact O-N 3.41Å |
| 97 | V | 86.3 | Confident | 86.8 | Confident | 57 Ų | 57 | 71 Ų | 71 | 35% | 0.345 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -62.2 | -43.7 | 179.4 | 166 | 0 | 0 | 0 | 0 | 111 | A93 V94 V95 K100 H101 L104 | A93-V97 VanDerWaalsContact O-CB 3.31Å; A93-V97 WeakPolarHBondContact O-CB 3.44Å; A93-V97 WeakPolarHBondContact O-CG2 3.35Å; A93-V97 PolarHBondContact O-N 3.33Å; V94-V97 PolarHBondContact O-N 3.45Å; V95-V97 PolarHBondContact O-N 3.12Å; V97-K100 PolarHBondContact O-N 2.9Å; V97-H101 WeakPolarHBondContact O-CB 3.45Å; V97-H101 PolarHBondContact O-CD2 3.13Å; V97-H101 VanDerWaalsContact O-CD2 3.25Å; V97-H101 PolarHBondContact O-N 2.9Å; V97-L104 HydrophobicContact CG1-CD1 3.73Å |
| 98 | I | 86.3 | Confident | 86.4 | Confident | 15 Ų | 15 | 71.7 Ų | 71.7 | 8% | 0.077 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -66.7 | -41.6 | 178.9 | -66 | 168.2 | 0 | 0 | 0 | 111 | V94 V95 V96 N109 I112 M113 | V94-I98 HydrophobicContact CG1-CD1 3.78Å; V94-I98 VanDerWaalsContact O-CG1 3.29Å; V94-I98 WeakPolarHBondContact O-CG1 3.32Å; V94-I98 PolarHBondContact O-N 3.31Å; V94-I98 VanDerWaalsContact O-N 3.08Å; V95-I98 PolarHBondContact O-N 3.48Å; V96-I98 PolarHBondContact O-N 2.89Å; I98-N109 HydrophobicContact CG2-CB 4.48Å; I98-I112 HydrophobicContact CD1-CG2 4.15Å; I98-M113 HydrophobicContact CD1-CB 4.11Å; I98-M113 HydrophobicContact CG2-CB 4.43Å; I98-M113 HydrophobicContact CG2-SD 4.22Å |
| 99 | I | 87.6 | Confident | 86.2 | Confident | 86 Ų | 86 | 72.9 Ų | 72.9 | 44% | 0.441 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.3 | -49.4 | 176.6 | -67.2 | 169.8 | 0 | 0 | 0 | 110.3 | V95 V96 H101 R105 M113 | V95-I99 HydrophobicContact CG1-CD1 3.74Å; V95-I99 VanDerWaalsContact O-CG1 3.3Å; V95-I99 WeakPolarHBondContact O-CG1 3.39Å; V95-I99 PolarHBondContact O-N 3.02Å; V96-I99 PolarHBondContact O-N 3.41Å; I99-H101 PolarHBondContact O-N 3.34Å; I99-R105 PolarHBondContact O-NE 3.08Å; I99-R105 PolarHBondContact O-NH2 3.28Å; I99-M113 HydrophobicContact CD1-CE 3.64Å; I99-M113 HydrophobicContact CG1-CE 3.54Å; I99-M113 HydrophobicContact CG1-SD 4.38Å |
| 100 | K | 84.4 | Confident | 86.1 | Confident | 161 Ų | 161 | 69.2 Ų | 69.2 | 70% | 0.7 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -65.8 | -40.5 | -174.1 | -172.2 | 172.2 | -177.5 | 174.3 | 0 | 112.4 | V96 V97 | V96-K100 VanDerWaalsContact O-CB 3.23Å; V96-K100 WeakPolarHBondContact O-CB 3.35Å; V96-K100 PolarHBondContact O-N 3.41Å; V97-K100 PolarHBondContact O-N 2.9Å |
| 101 | H | 80.3 | Confident | 86.2 | Confident | 96 Ų | 96 | 68.6 Ų | 68.6 | 44% | 0.444 | 34% | 0.339 | S | S | . | . | trans | -96.4 | 103.4 | -174.9 | -66.2 | -73.5 | 0 | 0 | 0 | 112.4 | V97 I99 R103 L104 | V97-H101 WeakPolarHBondContact O-CB 3.45Å; V97-H101 PolarHBondContact O-CD2 3.13Å; V97-H101 VanDerWaalsContact O-CD2 3.25Å; V97-H101 PolarHBondContact O-N 2.9Å; I99-H101 PolarHBondContact O-N 3.34Å; H101-R103 PolarHBondContact O-N 3.3Å; H101-R103 VanDerWaalsContact O-N 3.1Å; H101-L104 HydrophobicContact CB-CB 4.39Å; H101-L104 HydrophobicContact CB-CD1 3.89Å; H101-L104 HydrophobicContact CB-CG 4Å; H101-L104 PolarHBondContact O-N 3.48Å | ||
| 102 | R | 81.9 | Confident | 86.1 | Confident | 199 Ų | 199 | 69.7 Ų | 69.7 | 75% | 0.751 | 35% | 0.345 | S | S | * | . | G | 310 helix | trans | -54.5 | -32.6 | 177.9 | -68.7 | -133.3 | -176.5 | -172.1 | 2.2 | 114.3 | L104 R105 | R102-L104 PolarHBondContact O-N 3.36Å; R102-R105 WeakPolarHBondContact O-CB 3.25Å; R102-R105 PolarHBondContact O-N 2.82Å; R102-R105 VanDerWaalsContact O-N 3.17Å |
| 103 | R | 75.8 | Confident | 86.1 | Confident | 244 Ų | 244 | 70.8 Ų | 70.8 | 92% | 0.921 | 35% | 0.347 | S | S | * | . | G | 310 helix | trans | -65.2 | -21.2 | 178 | -65.1 | -173.1 | -178.9 | -175.7 | 0.6 | 113.3 | H101 | H101-R103 PolarHBondContact O-N 3.3Å; H101-R103 VanDerWaalsContact O-N 3.1Å |
| 104 | L | 77.4 | Confident | 86.3 | Confident | 63 Ų | 63 | 68.7 Ų | 68.7 | 33% | 0.33 | 33% | 0.329 | S | S | . | . | G | 310 helix | trans | -92 | 1.5 | 177.8 | -60.5 | 179.2 | 0 | 0 | 0 | 112.7 | V97 H101 R102 T106 N109 | V97-L104 HydrophobicContact CG1-CD1 3.73Å; H101-L104 HydrophobicContact CB-CB 4.39Å; H101-L104 HydrophobicContact CB-CD1 3.89Å; H101-L104 HydrophobicContact CB-CG 4Å; H101-L104 PolarHBondContact O-N 3.48Å; R102-L104 PolarHBondContact O-N 3.36Å; L104-T106 VanDerWaalsContact C-N 3.26Å; L104-T106 PolarHBondContact O-N 3.32Å; L104-N109 WeakPolarHBondContact O-CB 3.49Å; L104-N109 PolarHBondContact O-ND2 3.02Å |
| 105 | R | 83.1 | Confident | 86.5 | Confident | 106 Ų | 106 | 67.6 Ų | 67.6 | 40% | 0.4 | 32% | 0.322 | S | S | . | . | trans | -83.7 | 66.4 | -178.2 | -60.8 | -178 | -171.1 | 174.2 | -1.1 | 112.2 | I99 R102 | I99-R105 PolarHBondContact O-NE 3.08Å; I99-R105 PolarHBondContact O-NH2 3.28Å; R102-R105 WeakPolarHBondContact O-CB 3.25Å; R102-R105 PolarHBondContact O-N 2.82Å; R102-R105 VanDerWaalsContact O-N 3.17Å | ||
| 106 | T | 85.2 | Confident | 86.6 | Confident | 67 Ų | 67 | 66.4 Ų | 66.4 | 41% | 0.411 | 32% | 0.315 | S | S | . | . | trans | -101.2 | 165.4 | 175.2 | 66.8 | 0 | 0 | 0 | 0 | 111 | L104 N109 A110 | L104-T106 VanDerWaalsContact C-N 3.26Å; L104-T106 PolarHBondContact O-N 3.32Å; T106-N109 PolarHBondContact O-N 2.96Å; T106-N109 WeakPolarHBondContact OG1-CB 3.42Å; T106-N109 PolarHBondContact OG1-N 3.39Å; T106-N109 PolarHBondContact OG1-ND2 3.45Å; T106-A110 PolarHBondContact O-N 2.93Å | ||
| 107 | V | 87.1 | Confident | 86.9 | Confident | 25 Ų | 25 | 65.4 Ų | 65.4 | 15% | 0.152 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -59.5 | -47.1 | 178.1 | 168.6 | 0 | 0 | 0 | 0 | 111.4 | N109 A110 F111 I185 R187 A190 | V107-N109 VanDerWaalsContact C-N 3.31Å; V107-N109 PolarHBondContact O-N 3.18Å; V107-A110 WeakPolarHBondContact O-CB 3.3Å; V107-A110 PolarHBondContact O-N 3.39Å; V107-A110 VanDerWaalsContact O-N 3.08Å; V107-F111 HydrophobicContact CG1-CE2 3.74Å; V107-F111 HydrophobicContact CG1-CZ 3.86Å; V107-F111 PolarHBondContact O-N 2.68Å; V107-I185 HydrophobicContact CG1-CG2 4.39Å; V107-R187 HydrophobicContact CG2-CG 4.34Å; V107-A190 HydrophobicContact CB-CB 4.42Å; V107-A190 HydrophobicContact CG1-CB 3.51Å; V107-A190 HydrophobicContact CG2-CB 4.23Å |
| 108 | T | 84.8 | Confident | 87.4 | Confident | 17 Ų | 17 | 62.7 Ų | 62.7 | 10% | 0.104 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -60.6 | -40.2 | 176.9 | -45.5 | 0 | 0 | 0 | 0 | 112.1 | A110 F111 I112 D172 R173 | T108-A110 VanDerWaalsContact C-N 3.29Å; T108-A110 PolarHBondContact O-N 2.67Å; T108-F111 WeakPolarHBondContact O-CB 3.36Å; T108-F111 PolarHBondContact O-N 3.49Å; T108-I112 WeakPolarHBondContact O-CG1 3.49Å; T108-I112 PolarHBondContact O-N 3.26Å; T108-D172 WeakPolarHBondContact CG2-OD2 3.48Å; T108-D172 PolarHBondContact OG1-OD2 3Å; T108-R173 PolarHBondContact OG1-NH2 2.94Å |
| 109 | N | 87.1 | Confident | 87.7 | Confident | 37 Ų | 37 | 62.3 Ų | 62.3 | 20% | 0.198 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -72.5 | -22.7 | 177.7 | -68.9 | -7.4 | 0 | 0 | 0 | 112.5 | I98 L104 T106 V107 M113 | I98-N109 HydrophobicContact CG2-CB 4.48Å; L104-N109 WeakPolarHBondContact O-CB 3.49Å; L104-N109 PolarHBondContact O-ND2 3.02Å; T106-N109 PolarHBondContact O-N 2.96Å; T106-N109 WeakPolarHBondContact OG1-CB 3.42Å; T106-N109 PolarHBondContact OG1-N 3.39Å; T106-N109 PolarHBondContact OG1-ND2 3.45Å; V107-N109 VanDerWaalsContact C-N 3.31Å; V107-N109 PolarHBondContact O-N 3.18Å; N109-M113 VanDerWaalsContact O-CB 3.28Å; N109-M113 WeakPolarHBondContact O-CB 3.47Å; N109-M113 PolarHBondContact O-N 3.27Å |
| 110 | A | 89.9 | Confident | 88 | Confident | 39 Ų | 39 | 61.1 Ų | 61.1 | 32% | 0.322 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -68.6 | -37.9 | 169.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | T106 V107 T108 M113 S114 L194 | T106-A110 PolarHBondContact O-N 2.93Å; V107-A110 WeakPolarHBondContact O-CB 3.3Å; V107-A110 PolarHBondContact O-N 3.39Å; V107-A110 VanDerWaalsContact O-N 3.08Å; T108-A110 VanDerWaalsContact C-N 3.29Å; T108-A110 PolarHBondContact O-N 2.67Å; A110-M113 PolarHBondContact O-N 3.38Å; A110-S114 PolarHBondContact O-N 2.89Å; A110-L194 HydrophobicContact CB-CD1 4.44Å |
| 111 | F | 91.6 | Very high | 88.4 | Confident | 2 Ų | 2 | 55.4 Ų | 55.4 | 1% | 0.009 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -65.1 | -44.3 | 171.6 | -57.2 | -40.1 | 0 | 0 | 0 | 111.8 | V107 T108 M113 S114 L115 T165 L168 I169 D172 A190 L194 | V107-F111 HydrophobicContact CG1-CE2 3.74Å; V107-F111 HydrophobicContact CG1-CZ 3.86Å; V107-F111 PolarHBondContact O-N 2.68Å; T108-F111 WeakPolarHBondContact O-CB 3.36Å; T108-F111 PolarHBondContact O-N 3.49Å; F111-M113 VanDerWaalsContact C-N 3.28Å; F111-M113 PolarHBondContact O-N 3.07Å; F111-S114 WeakPolarHBondContact O-CB 3.37Å; F111-S114 PolarHBondContact O-N 2.97Å; F111-L115 PolarHBondContact O-N 3.45Å; F111-T165 HydrophobicContact CB-CG2 4.35Å; F111-T165 WeakPolarHBondContact O-CG2 3.34Å; F111-L168 HydrophobicContact CE1-CD1 4.34Å; F111-I169 HydrophobicContact CB-CD1 4.21Å; F111-I169 HydrophobicContact CB-CG1 3.58Å; F111-I169 HydrophobicContact CG-CG1 4.43Å; F111-D172 HydrophobicContact CD2-CB 4.31Å; F111-D172 HydrophobicContact CE2-CB 3.97Å; F111-A190 HydrophobicContact CE1-CB 4.17Å; F111-A190 HydrophobicContact CZ-CB 4.02Å; F111-L194 HydrophobicContact CD1-CD1 4.05Å; F111-L194 HydrophobicContact CD1-CD2 3.75Å; F111-L194 HydrophobicContact CD1-CG 3.77Å; F111-L194 HydrophobicContact CE1-CD1 4.35Å; F111-L194 HydrophobicContact CE1-CD2 4.32Å; F111-L194 HydrophobicContact CE1-CG 3.93Å |
| 112 | I | 90.4 | Very high | 89 | Confident | 23 Ų | 23 | 51.8 Ų | 51.8 | 12% | 0.118 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -60.1 | -40.4 | 174.5 | -66.1 | 169 | 0 | 0 | 0 | 111 | V94 I98 T108 L115 S116 I169 Y348 | V94-I112 HydrophobicContact CG1-CG2 4.02Å; I98-I112 HydrophobicContact CD1-CG2 4.15Å; T108-I112 WeakPolarHBondContact O-CG1 3.49Å; T108-I112 PolarHBondContact O-N 3.26Å; I112-L115 WeakPolarHBondContact O-CB 3.43Å; I112-L115 PolarHBondContact O-N 2.93Å; I112-S116 PolarHBondContact O-N 3.4Å; I112-S116 PolarHBondContact O-OG 3.37Å; I112-I169 HydrophobicContact CG1-CD1 4.28Å; I112-Y348 HydrophobicContact CG2-CD2 4.47Å; I112-Y348 HydrophobicContact CG2-CE1 4.4Å; I112-Y348 HydrophobicContact CG2-CE2 3.75Å |
| 113 | M | 91.7 | Very high | 89.4 | Confident | 61 Ų | 61 | 42.4 Ų | 42.4 | 30% | 0.3 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -63.5 | -41.8 | 175.8 | -176.5 | -179.4 | 176.9 | 0 | 0 | 112 | V95 I98 I99 N109 A110 F111 L115 S116 L117 | V95-M113 HydrophobicContact CG1-CE 4.1Å; V95-M113 HydrophobicContact CG2-CG 4.5Å; I98-M113 HydrophobicContact CD1-CB 4.11Å; I98-M113 HydrophobicContact CG2-CB 4.43Å; I98-M113 HydrophobicContact CG2-SD 4.22Å; I99-M113 HydrophobicContact CD1-CE 3.64Å; I99-M113 HydrophobicContact CG1-CE 3.54Å; I99-M113 HydrophobicContact CG1-SD 4.38Å; N109-M113 VanDerWaalsContact O-CB 3.28Å; N109-M113 WeakPolarHBondContact O-CB 3.47Å; N109-M113 PolarHBondContact O-N 3.27Å; A110-M113 PolarHBondContact O-N 3.38Å; F111-M113 VanDerWaalsContact C-N 3.28Å; F111-M113 PolarHBondContact O-N 3.07Å; M113-L115 VanDerWaalsContact C-N 3.34Å; M113-S116 PolarHBondContact O-N 3.29Å; M113-L117 VanDerWaalsContact O-CB 3.32Å; M113-L117 WeakPolarHBondContact O-CB 3.48Å; M113-L117 PolarHBondContact O-N 3.18Å |
| 114 | S | 94.1 | Very high | 90.2 | Very high | 10 Ų | 10 | 33.7 Ų | 33.7 | 7% | 0.07 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -62.2 | -41.9 | 174.7 | -175.2 | 0 | 0 | 0 | 0 | 111.8 | A110 F111 L117 S118 L194 W198 | A110-S114 PolarHBondContact O-N 2.89Å; F111-S114 WeakPolarHBondContact O-CB 3.37Å; F111-S114 PolarHBondContact O-N 2.97Å; S114-L117 PolarHBondContact O-N 3.15Å; S114-S118 PolarHBondContact O-N 3.33Å; S114-S118 PolarHBondContact O-OG 3.05Å; S114-L194 VanDerWaalsContact CB-CD2 3.46Å; S114-L194 WeakPolarHBondContact OG-CD2 3.21Å; S114-W198 PolarHBondContact OG-NE1 3.31Å |
| 115 | L | 92.4 | Very high | 90.7 | Very high | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -61.8 | -50.3 | 176.8 | -179.6 | 65.9 | 0 | 0 | 0 | 111.4 | F111 I112 M113 L117 S118 D119 S162 T165 M166 I169 M300 Y348 | F111-L115 PolarHBondContact O-N 3.45Å; I112-L115 WeakPolarHBondContact O-CB 3.43Å; I112-L115 PolarHBondContact O-N 2.93Å; M113-L115 VanDerWaalsContact C-N 3.34Å; L115-L117 VanDerWaalsContact C-N 3.25Å; L115-L117 PolarHBondContact O-N 2.84Å; L115-S118 PolarHBondContact O-N 2.59Å; L115-S118 PolarHBondContact O-OG 3.46Å; L115-D119 VanDerWaalsContact O-CG 3.31Å; L115-D119 PolarHBondContact O-N 3.04Å; L115-D119 VanDerWaalsContact O-N 3.07Å; L115-S162 WeakPolarHBondContact CD1-O 3.48Å; L115-S162 WeakPolarHBondContact CD1-OG 3.29Å; L115-T165 HydrophobicContact CB-CG2 3.88Å; L115-M166 HydrophobicContact CD1-CE 4.25Å; L115-M166 HydrophobicContact CD1-CG 3.9Å; L115-M166 HydrophobicContact CD1-SD 4.38Å; L115-M166 HydrophobicContact CD2-CE 3.69Å; L115-M166 HydrophobicContact CD2-CG 4.27Å; L115-M166 HydrophobicContact CD2-SD 3.68Å; L115-I169 HydrophobicContact CD2-CD1 4.15Å; L115-M300 HydrophobicContact CD2-CE 3.83Å; L115-Y348 WeakPolarHBondContact CD2-OH 3.4Å |
| 116 | S | 93.2 | Very high | 90.8 | Very high | 0 Ų | 0 | 28.7 Ų | 28.7 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.7 | -32.4 | 176.6 | -69.5 | 0 | 0 | 0 | 0 | 112.3 | N91 V94 I112 M113 F120 | N91-S116 WeakPolarHBondContact CB-O 3.44Å; N91-S116 WeakPolarHBondContact OD1-CA 3.2Å; N91-S116 PolarHBondContact OD1-OG 3.41Å; V94-S116 WeakPolarHBondContact CG1-OG 3.37Å; I112-S116 PolarHBondContact O-N 3.4Å; I112-S116 PolarHBondContact O-OG 3.37Å; M113-S116 PolarHBondContact O-N 3.29Å; S116-F120 WeakPolarHBondContact O-CB 3.19Å; S116-F120 PolarHBondContact O-N 2.63Å |
| 117 | L | 94.8 | Very high | 90.8 | Very high | 66 Ų | 66 | 25.9 Ų | 25.9 | 35% | 0.346 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -66.6 | -44.6 | 175.5 | -177.3 | 62 | 0 | 0 | 0 | 111.9 | M113 S114 L115 F120 L121 W198 | M113-L117 VanDerWaalsContact O-CB 3.32Å; M113-L117 WeakPolarHBondContact O-CB 3.48Å; M113-L117 PolarHBondContact O-N 3.18Å; S114-L117 PolarHBondContact O-N 3.15Å; L115-L117 VanDerWaalsContact C-N 3.25Å; L115-L117 PolarHBondContact O-N 2.84Å; L117-F120 PolarHBondContact O-N 3.07Å; L117-L121 HydrophobicContact CD1-CD1 4.31Å; L117-L121 HydrophobicContact CD1-CG 4.33Å; L117-L121 HydrophobicContact CG-CD1 4.13Å; L117-L121 WeakPolarHBondContact O-CB 3.48Å; L117-L121 VanDerWaalsContact O-CG 3.24Å; L117-L121 WeakPolarHBondContact O-CG 3.27Å; L117-L121 PolarHBondContact O-N 3.1Å; L117-W198 HydrophobicContact CD2-CH2 4.17Å; L117-W198 HydrophobicContact CD2-CZ2 4.04Å; L117-W198 HydrophobicContact CG-CH2 4.41Å; L117-W198 HydrophobicContact CG-CZ2 4.42Å |
| 118 | S | 95.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.1 | -40.1 | 176.5 | 51 | 0 | 0 | 0 | 0 | 112.5 | S114 L115 L121 T122 | S114-S118 PolarHBondContact O-N 3.33Å; S114-S118 PolarHBondContact O-OG 3.05Å; L115-S118 PolarHBondContact O-N 2.59Å; L115-S118 PolarHBondContact O-OG 3.46Å; S118-L121 PolarHBondContact O-N 2.91Å; S118-T122 PolarHBondContact O-N 3.23Å; S118-T122 PolarHBondContact O-OG1 3.4Å |
| 119 | D | 93.7 | Very high | 90.6 | Very high | 6 Ų | 6 | 28.1 Ų | 28.1 | 3% | 0.032 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -70.7 | -37.7 | 179.9 | -64 | -19.4 | 0 | 0 | 0 | 111.3 | N91 L115 T122 A123 S162 N344 | N91-D119 WeakPolarHBondContact ND2-CB 3.31Å; L115-D119 VanDerWaalsContact O-CG 3.31Å; L115-D119 PolarHBondContact O-N 3.04Å; L115-D119 VanDerWaalsContact O-N 3.07Å; D119-T122 PolarHBondContact O-N 3.36Å; D119-A123 WeakPolarHBondContact O-CB 3.5Å; D119-A123 PolarHBondContact O-N 3.03Å; D119-S162 PolarHBondContact OD1-OG 2.87Å; D119-N344 PolarHBondContact OD2-ND2 3.22Å |
| 120 | F | 94.1 | Very high | 90.2 | Very high | 62 Ų | 62 | 26.8 Ų | 26.8 | 27% | 0.272 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -62.8 | -46.2 | 172.3 | 171.6 | -104 | 0 | 0 | 0 | 112 | N91 S92 S116 L117 T122 A123 V124 | N91-F120 HydrophobicContact CB-CB 4.02Å; S92-F120 WeakPolarHBondContact OG-CD2 3.15Å; S92-F120 WeakPolarHBondContact OG-CE2 3.25Å; S116-F120 WeakPolarHBondContact O-CB 3.19Å; S116-F120 PolarHBondContact O-N 2.63Å; L117-F120 PolarHBondContact O-N 3.07Å; F120-T122 VanDerWaalsContact C-N 3.31Å; F120-T122 PolarHBondContact O-N 2.7Å; F120-A123 WeakPolarHBondContact O-CB 3.42Å; F120-A123 PolarHBondContact O-N 3.48Å; F120-A123 VanDerWaalsContact O-N 3.09Å; F120-V124 HydrophobicContact CD2-CG2 4.1Å; F120-V124 HydrophobicContact CE1-CG2 4.21Å; F120-V124 HydrophobicContact CE2-CG2 3.56Å; F120-V124 HydrophobicContact CZ-CG2 3.64Å; F120-V124 PolarHBondContact O-N 2.89Å |
| 121 | L | 93.4 | Very high | 89.8 | Confident | 40 Ų | 40 | 27.9 Ų | 27.9 | 21% | 0.209 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -62.2 | -40.2 | 177.4 | -71.8 | 171.5 | 0 | 0 | 0 | 111.2 | L117 S118 A123 V124 L125 F158 W198 | L117-L121 HydrophobicContact CD1-CD1 4.31Å; L117-L121 HydrophobicContact CD1-CG 4.33Å; L117-L121 HydrophobicContact CG-CD1 4.13Å; L117-L121 WeakPolarHBondContact O-CB 3.48Å; L117-L121 VanDerWaalsContact O-CG 3.24Å; L117-L121 WeakPolarHBondContact O-CG 3.27Å; L117-L121 PolarHBondContact O-N 3.1Å; S118-L121 PolarHBondContact O-N 2.91Å; L121-A123 VanDerWaalsContact C-N 3.31Å; L121-A123 PolarHBondContact O-N 3.45Å; L121-V124 PolarHBondContact O-N 3.24Å; L121-L125 HydrophobicContact CB-CD1 4.43Å; L121-L125 HydrophobicContact CD2-CD1 4.11Å; L121-L125 WeakPolarHBondContact O-CB 3.46Å; L121-L125 WeakPolarHBondContact O-CG 3.28Å; L121-L125 PolarHBondContact O-N 2.97Å; L121-F158 HydrophobicContact CB-CD1 4.17Å; L121-F158 HydrophobicContact CB-CD2 4.1Å; L121-F158 HydrophobicContact CB-CE1 3.87Å; L121-F158 HydrophobicContact CB-CE2 3.77Å; L121-F158 HydrophobicContact CB-CG 4.31Å; L121-F158 HydrophobicContact CB-CZ 3.67Å; L121-F158 HydrophobicContact CD1-CD1 4.29Å; L121-F158 HydrophobicContact CD1-CE1 3.62Å; L121-F158 HydrophobicContact CD1-CZ 3.94Å; L121-F158 HydrophobicContact CG-CE1 4.38Å; L121-F158 HydrophobicContact CG-CZ 4.33Å; L121-W198 HydrophobicContact CD1-CH2 3.94Å |
| 122 | T | 91.3 | Very high | 89.2 | Confident | 21 Ų | 21 | 31 Ų | 31 | 13% | 0.129 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -59.5 | -43.3 | 172 | -53.9 | 0 | 0 | 0 | 0 | 111.3 | S118 D119 F120 V124 C126 L127 F158 | S118-T122 PolarHBondContact O-N 3.23Å; S118-T122 PolarHBondContact O-OG1 3.4Å; D119-T122 PolarHBondContact O-N 3.36Å; F120-T122 VanDerWaalsContact C-N 3.31Å; F120-T122 PolarHBondContact O-N 2.7Å; T122-V124 VanDerWaalsContact C-N 3.35Å; T122-V124 PolarHBondContact O-N 3.26Å; T122-C126 HydrophobicContact CG2-CB 4.31Å; T122-C126 VanDerWaalsContact O-CB 3.23Å; T122-C126 WeakPolarHBondContact O-CB 3.35Å; T122-C126 PolarHBondContact O-N 2.94Å; T122-L127 PolarHBondContact O-N 2.77Å; T122-F158 WeakPolarHBondContact OG1-CB 3.16Å |
| 123 | A | 91.8 | Very high | 88.4 | Confident | 1 Ų | 1 | 30.4 Ų | 30.4 | 1% | 0.008 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -66.2 | -34.5 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | F84 D119 F120 L121 L127 P128 | F84-A123 WeakPolarHBondContact CD2-O 3.44Å; F84-A123 VanDerWaalsContact CE2-O 3.27Å; F84-A123 WeakPolarHBondContact CE2-O 3.27Å; D119-A123 WeakPolarHBondContact O-CB 3.5Å; D119-A123 PolarHBondContact O-N 3.03Å; F120-A123 WeakPolarHBondContact O-CB 3.42Å; F120-A123 PolarHBondContact O-N 3.48Å; F120-A123 VanDerWaalsContact O-N 3.09Å; L121-A123 VanDerWaalsContact C-N 3.31Å; L121-A123 PolarHBondContact O-N 3.45Å; A123-L127 HydrophobicContact CB-CD1 4.02Å; A123-L127 WeakPolarHBondContact O-CB 3.25Å; A123-P128 VanDerWaalsContact O-CD 3.32Å; A123-P128 WeakPolarHBondContact O-CD 3.26Å |
| 124 | V | 91.5 | Very high | 87.4 | Confident | 61 Ų | 61 | 28 Ų | 28 | 37% | 0.37 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -90.1 | -37.6 | -177.9 | 175.6 | 0 | 0 | 0 | 0 | 112.4 | F120 L121 T122 P128 | F120-V124 HydrophobicContact CD2-CG2 4.1Å; F120-V124 HydrophobicContact CE1-CG2 4.21Å; F120-V124 HydrophobicContact CE2-CG2 3.56Å; F120-V124 HydrophobicContact CZ-CG2 3.64Å; F120-V124 PolarHBondContact O-N 2.89Å; L121-V124 PolarHBondContact O-N 3.24Å; T122-V124 VanDerWaalsContact C-N 3.35Å; T122-V124 PolarHBondContact O-N 3.26Å; V124-P128 WeakPolarHBondContact O-CD 3.32Å; V124-P128 WeakPolarHBondContact O-CG 3.33Å |
| 125 | L | 89 | Confident | 86.3 | Confident | 64 Ų | 64 | 33.3 Ų | 33.3 | 34% | 0.335 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -95.5 | -16.1 | -172.2 | -60.2 | 176.5 | 0 | 0 | 0 | 113.9 | L121 F129 F158 | L121-L125 HydrophobicContact CB-CD1 4.43Å; L121-L125 HydrophobicContact CD2-CD1 4.11Å; L121-L125 WeakPolarHBondContact O-CB 3.46Å; L121-L125 WeakPolarHBondContact O-CG 3.28Å; L121-L125 PolarHBondContact O-N 2.97Å; L125-F129 WeakPolarHBondContact O-CD2 3.43Å; L125-F129 VanDerWaalsContact O-CE2 3.24Å; L125-F129 WeakPolarHBondContact O-CE2 3.03Å; L125-F158 HydrophobicContact CB-CE2 4.49Å; L125-F158 HydrophobicContact CD1-CE2 3.85Å; L125-F158 HydrophobicContact CD1-CZ 3.96Å |
| 126 | C | 85.2 | Confident | 85.2 | Confident | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 17% | 0.172 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -117.8 | -50.4 | -177.5 | -51.8 | 0 | 0 | 0 | 0 | 112.5 | T122 F129 S130 N155 | T122-C126 HydrophobicContact CG2-CB 4.31Å; T122-C126 VanDerWaalsContact O-CB 3.23Å; T122-C126 WeakPolarHBondContact O-CB 3.35Å; T122-C126 PolarHBondContact O-N 2.94Å; C126-F129 PolarHBondContact O-N 3.33Å; C126-S130 PolarHBondContact O-N 2.88Å; C126-S130 VanDerWaalsContact O-N 3.16Å; C126-S130 PolarHBondContact O-OG 3.4Å; C126-N155 WeakPolarHBondContact CB-ND2 3.31Å |
| 127 | L | 85.1 | Confident | 83.2 | Confident | 8 Ų | 8 | 43.5 Ų | 43.5 | 4% | 0.042 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.2 | -39.8 | -172.8 | -63.6 | -179.9 | 0 | 0 | 0 | 115.3 | I83 F84 T122 A123 F129 S130 F131 W338 | I83-L127 HydrophobicContact CG2-CD1 4.14Å; F84-L127 HydrophobicContact CB-CD1 4.15Å; F84-L127 HydrophobicContact CD2-CB 4.2Å; F84-L127 HydrophobicContact CD2-CD1 4.45Å; T122-L127 PolarHBondContact O-N 2.77Å; A123-L127 HydrophobicContact CB-CD1 4.02Å; A123-L127 WeakPolarHBondContact O-CB 3.25Å; L127-F129 VanDerWaalsContact C-N 3.31Å; L127-F129 PolarHBondContact O-N 2.91Å; L127-S130 PolarHBondContact O-N 2.89Å; L127-F131 WeakPolarHBondContact O-CB 3.5Å; L127-F131 PolarHBondContact O-N 2.98Å; L127-W338 HydrophobicContact CD2-CB 3.91Å; L127-W338 HydrophobicContact CD2-CD2 3.33Å; L127-W338 HydrophobicContact CD2-CE3 3.46Å; L127-W338 VanDerWaalsContact CD2-CE3 3.46Å; L127-W338 HydrophobicContact CD2-CG 3.55Å; L127-W338 HydrophobicContact CD2-CZ3 4.18Å |
| 128 | P | 85.8 | Confident | 81.3 | Confident | 41 Ų | 41 | 46.6 Ų | 46.6 | 27% | 0.266 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -65.9 | -36.4 | -178.4 | -22.9 | 36.3 | 0 | 0 | 0 | 112 | F84 A123 V124 F131 I132 | F84-P128 HydrophobicContact CD2-CG 4.32Å; F84-P128 HydrophobicContact CE2-CG 3.91Å; A123-P128 VanDerWaalsContact O-CD 3.32Å; A123-P128 WeakPolarHBondContact O-CD 3.26Å; V124-P128 WeakPolarHBondContact O-CD 3.32Å; V124-P128 WeakPolarHBondContact O-CG 3.33Å; P128-F131 WeakPolarHBondContact O-CB 3.36Å; P128-F131 PolarHBondContact O-N 3.08Å; P128-I132 VanDerWaalsContact O-CG1 3.28Å; P128-I132 WeakPolarHBondContact O-CG1 3.27Å; P128-I132 PolarHBondContact O-N 2.94Å |
| 129 | F | 82.1 | Confident | 79.4 | Confident | 48 Ų | 48 | 47.1 Ų | 47.1 | 21% | 0.211 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -70.9 | -39.5 | 177.6 | -56.4 | -70.5 | 0 | 0 | 0 | 111.3 | L125 C126 L127 F131 I132 M133 W141 F143 F147 | L125-F129 WeakPolarHBondContact O-CD2 3.43Å; L125-F129 VanDerWaalsContact O-CE2 3.24Å; L125-F129 WeakPolarHBondContact O-CE2 3.03Å; C126-F129 PolarHBondContact O-N 3.33Å; L127-F129 VanDerWaalsContact C-N 3.31Å; L127-F129 PolarHBondContact O-N 2.91Å; F129-F131 VanDerWaalsContact C-N 3.31Å; F129-F131 PolarHBondContact O-N 3.45Å; F129-I132 PolarHBondContact O-N 2.87Å; F129-M133 PolarHBondContact O-N 3.21Å; F129-M133 VanDerWaalsContact O-N 3.08Å; F129-W141 HydrophobicContact CB-CH2 4.02Å; F129-F143 HydrophobicContact CD1-CD2 4.45Å; F129-F143 HydrophobicContact CD1-CE2 4.12Å; F129-F143 HydrophobicContact CD1-CZ 4.2Å; F129-F147 HydrophobicContact CB-CE1 4.5Å; F129-F147 AromaticContact CD1-CE1 3.47Å; F129-F147 HydrophobicContact CD1-CE1 3.47Å; F129-F147 VanDerWaalsContact CD1-CE1 3.47Å; F129-F147 AromaticContact CD1-CZ 3.91Å; F129-F147 HydrophobicContact CD1-CZ 3.91Å; F129-F147 HydrophobicContact CD2-CE1 4.06Å; F129-F147 HydrophobicContact CD2-CZ 4.03Å; F129-F147 AromaticContact CE1-CE1 3.56Å; F129-F147 HydrophobicContact CE1-CE1 3.56Å; F129-F147 AromaticContact CE1-CZ 3.54Å; F129-F147 HydrophobicContact CE1-CZ 3.54Å; F129-F147 HydrophobicContact CE2-CE1 4.15Å; F129-F147 AromaticContact CE2-CZ 3.69Å; F129-F147 HydrophobicContact CE2-CZ 3.69Å; F129-F147 AromaticContact CG-CE1 3.73Å; F129-F147 HydrophobicContact CG-CE1 3.73Å; F129-F147 HydrophobicContact CG-CZ 4.14Å; F129-F147 AromaticContact CZ-CE1 3.92Å; F129-F147 HydrophobicContact CZ-CE1 3.92Å; F129-F147 AromaticContact CZ-CZ 3.43Å; F129-F147 HydrophobicContact CZ-CZ 3.43Å; F129-F147 VanDerWaalsContact CZ-CZ 3.43Å |
| 130 | S | 78 | Confident | 77.6 | Confident | 9 Ų | 9 | 51.6 Ų | 51.6 | 6% | 0.063 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.9 | -37.5 | 170.7 | -59.8 | 0 | 0 | 0 | 0 | 112.7 | C126 L127 M133 W338 | C126-S130 PolarHBondContact O-N 2.88Å; C126-S130 VanDerWaalsContact O-N 3.16Å; C126-S130 PolarHBondContact O-OG 3.4Å; L127-S130 PolarHBondContact O-N 2.89Å; S130-M133 PolarHBondContact O-N 3.34Å; S130-W338 WeakPolarHBondContact OG-CH2 3.11Å; S130-W338 WeakPolarHBondContact OG-CZ2 3.17Å |
| 131 | F | 81.8 | Confident | 76.3 | Confident | 63 Ų | 63 | 49.7 Ų | 49.7 | 28% | 0.276 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -66.8 | -41.1 | 175.5 | 178.4 | -93.2 | 0 | 0 | 0 | 112 | A77 L80 L81 L127 P128 F129 M133 L134 F135 | A77-F131 HydrophobicContact CB-CE2 3.81Å; A77-F131 HydrophobicContact CB-CZ 4.38Å; A77-F131 WeakPolarHBondContact O-CE2 3.18Å; L80-F131 HydrophobicContact CB-CD2 4.14Å; L81-F131 HydrophobicContact CB-CE2 4.43Å; L127-F131 WeakPolarHBondContact O-CB 3.5Å; L127-F131 PolarHBondContact O-N 2.98Å; P128-F131 WeakPolarHBondContact O-CB 3.36Å; P128-F131 PolarHBondContact O-N 3.08Å; F129-F131 VanDerWaalsContact C-N 3.31Å; F129-F131 PolarHBondContact O-N 3.45Å; F131-M133 VanDerWaalsContact C-N 3.31Å; F131-M133 PolarHBondContact O-N 3.42Å; F131-L134 VanDerWaalsContact O-CB 3.24Å; F131-L134 WeakPolarHBondContact O-CB 3.31Å; F131-L134 PolarHBondContact O-N 3.16Å; F131-F135 HydrophobicContact CD1-CE2 4.15Å; F131-F135 HydrophobicContact CE1-CD2 4.36Å; F131-F135 AromaticContact CE1-CE2 3.56Å; F131-F135 HydrophobicContact CE1-CE2 3.56Å; F131-F135 HydrophobicContact CE1-CZ 4.43Å; F131-F135 HydrophobicContact CE2-CE2 4.16Å; F131-F135 AromaticContact CZ-CE2 3.57Å; F131-F135 HydrophobicContact CZ-CE2 3.57Å; F131-F135 HydrophobicContact CZ-CZ 4.09Å |
| 132 | I | 79.4 | Confident | 75.1 | Confident | 66 Ų | 66 | 53.9 Ų | 53.9 | 34% | 0.338 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -64.9 | -37.7 | 177.4 | -67.5 | 164.2 | 0 | 0 | 0 | 111 | P128 F129 L134 F135 M142 F143 | P128-I132 VanDerWaalsContact O-CG1 3.28Å; P128-I132 WeakPolarHBondContact O-CG1 3.27Å; P128-I132 PolarHBondContact O-N 2.94Å; F129-I132 PolarHBondContact O-N 2.87Å; I132-L134 PolarHBondContact O-N 3.44Å; I132-F135 PolarHBondContact O-N 2.95Å; I132-F135 VanDerWaalsContact O-N 3.11Å; I132-M142 HydrophobicContact CG2-CE 3.87Å; I132-F143 HydrophobicContact CB-CE2 4.4Å; I132-F143 HydrophobicContact CD1-CZ 3.94Å; I132-F143 HydrophobicContact CG2-CE2 3.97Å; I132-F143 HydrophobicContact CG2-CZ 3.97Å |
| 133 | M | 72.3 | Confident | 74.1 | Confident | 12 Ų | 12 | 56.9 Ų | 56.9 | 6% | 0.059 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -58.9 | -27.8 | 175.7 | -78.1 | -156.4 | -69.7 | 0 | 0 | 113.8 | F129 S130 F131 F135 S136 W141 F223 | F129-M133 PolarHBondContact O-N 3.21Å; F129-M133 VanDerWaalsContact O-N 3.08Å; S130-M133 PolarHBondContact O-N 3.34Å; F131-M133 VanDerWaalsContact C-N 3.31Å; F131-M133 PolarHBondContact O-N 3.42Å; M133-F135 PolarHBondContact O-N 3.32Å; M133-S136 PolarHBondContact O-N 2.92Å; M133-W141 HydrophobicContact CE-CE3 4.17Å; M133-W141 HydrophobicContact CE-CZ3 3.74Å; M133-W141 HydrophobicContact CG-CE3 3.8Å; M133-W141 HydrophobicContact CG-CZ3 3.83Å; M133-W141 HydrophobicContact SD-CE3 3.29Å; M133-W141 HydrophobicContact SD-CZ3 3.46Å; M133-W141 WeakPolarHBondContact SD-CZ3 3.22Å; M133-F223 WeakPolarHBondContact CE-O 3.44Å |
| 134 | L | 71.1 | Confident | 73.1 | Confident | 11 Ų | 11 | 58.6 Ų | 58.6 | 6% | 0.058 | 30% | 0.299 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.8 | -28.6 | 178.5 | -174.9 | 66 | 0 | 0 | 0 | 112.5 | V73 Q76 A77 L80 F131 I132 | V73-L134 HydrophobicContact CG1-CD1 4.46Å; V73-L134 HydrophobicContact CG1-CD2 4.37Å; V73-L134 HydrophobicContact CG1-CG 4.07Å; Q76-L134 HydrophobicContact CB-CD1 3.8Å; Q76-L134 HydrophobicContact CB-CD2 3.7Å; Q76-L134 HydrophobicContact CB-CG 4.4Å; Q76-L134 HydrophobicContact CG-CD1 4.25Å; A77-L134 HydrophobicContact CB-CD2 3.63Å; A77-L134 VanDerWaalsContact N-CD2 3.31Å; L80-L134 HydrophobicContact CD1-CD2 4.49Å; F131-L134 VanDerWaalsContact O-CB 3.24Å; F131-L134 WeakPolarHBondContact O-CB 3.31Å; F131-L134 PolarHBondContact O-N 3.16Å; I132-L134 PolarHBondContact O-N 3.44Å |
| 135 | F | 71 | Confident | 72.2 | Confident | 121 Ų | 121 | 60 Ų | 60 | 53% | 0.531 | 31% | 0.305 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.1 | -8.2 | 179 | -64 | -80.1 | 0 | 0 | 0 | 113.5 | A77 F131 I132 M133 K137 | A77-F135 HydrophobicContact CB-CZ 4.1Å; F131-F135 HydrophobicContact CD1-CE2 4.15Å; F131-F135 HydrophobicContact CE1-CD2 4.36Å; F131-F135 AromaticContact CE1-CE2 3.56Å; F131-F135 HydrophobicContact CE1-CE2 3.56Å; F131-F135 HydrophobicContact CE1-CZ 4.43Å; F131-F135 HydrophobicContact CE2-CE2 4.16Å; F131-F135 AromaticContact CZ-CE2 3.57Å; F131-F135 HydrophobicContact CZ-CE2 3.57Å; F131-F135 HydrophobicContact CZ-CZ 4.09Å; I132-F135 PolarHBondContact O-N 2.95Å; I132-F135 VanDerWaalsContact O-N 3.11Å; M133-F135 PolarHBondContact O-N 3.32Å; F135-K137 PolarHBondContact O-N 3.22Å |
| 136 | S | 68.4 | Low | 71.5 | Confident | 11 Ų | 11 | 60.6 Ų | 60.6 | 8% | 0.077 | 32% | 0.319 | C | S | . | . | trans | -75.3 | 106.6 | 176.2 | -73.3 | 0 | 0 | 0 | 0 | 110.3 | M133 D138 G139 M142 | M133-S136 PolarHBondContact O-N 2.92Å; S136-D138 PolarHBondContact O-N 2.99Å; S136-D138 VanDerWaalsContact O-N 3.07Å; S136-G139 PolarHBondContact O-N 3.38Å; S136-G139 VanDerWaalsContact O-N 3.16Å; S136-M142 WeakPolarHBondContact OG-CE 3.44Å; S136-M142 PolarHBondContact OG-SD 3.04Å | ||
| 137 | K | 51.3 | Low | 71.2 | Confident | 203 Ų | 203 | 64 Ų | 64 | 88% | 0.883 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.1 | -24.4 | -176 | -76.7 | -176.7 | 174.4 | 179.1 | 0 | 115.1 | F135 | F135-K137 PolarHBondContact O-N 3.22Š|
| 138 | D | 54.8 | Low | 70.7 | Confident | 131 Ų | 131 | 64.1 Ų | 64.1 | 70% | 0.701 | 34% | 0.335 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.8 | -1.3 | -175.4 | -55.4 | -44.6 | 0 | 0 | 0 | 113.6 | S136 I140 | S136-D138 PolarHBondContact O-N 2.99Å; S136-D138 VanDerWaalsContact O-N 3.07Å; D138-I140 HydrophobicContact CB-CB 4.45Å; D138-I140 HydrophobicContact CB-CD1 3.69Å; D138-I140 HydrophobicContact CB-CG1 3.78Å; D138-I140 PolarHBondContact O-N 3.24Å; D138-I140 VanDerWaalsContact O-N 3.11Å |
| 139 | G | 55.2 | Low | 70.2 | Confident | 11 Ų | 11 | 63.5 Ų | 63.5 | 11% | 0.113 | 33% | 0.331 | C | S | . | . | trans | 67.2 | -0.8 | -170.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | S136 H225 | S136-G139 PolarHBondContact O-N 3.38Å; S136-G139 VanDerWaalsContact O-N 3.16Å; G139-H225 PolarHBondContact O-CD2 2.97Å; G139-H225 PolarHBondContact O-NE2 3.31Å | ||
| 140 | I | 57.8 | Low | 70 | Confident | 100 Ų | 100 | 62.5 Ų | 62.5 | 51% | 0.513 | 33% | 0.331 | S | S | . | . | trans | -74.7 | 132.4 | -175.4 | -56.4 | 169.9 | 0 | 0 | 0 | 110.4 | D138 M142 | D138-I140 HydrophobicContact CB-CB 4.45Å; D138-I140 HydrophobicContact CB-CD1 3.69Å; D138-I140 HydrophobicContact CB-CG1 3.78Å; D138-I140 PolarHBondContact O-N 3.24Å; D138-I140 VanDerWaalsContact O-N 3.11Å; I140-M142 PolarHBondContact O-N 2.94Å; I140-M142 VanDerWaalsContact O-N 3.15Å | ||
| 141 | W | 66.3 | Low | 70.2 | Confident | 22 Ų | 22 | 62.2 Ų | 62.2 | 8% | 0.083 | 33% | 0.329 | C | S | . | . | trans | -67.7 | 108.7 | 176.7 | -177.2 | -97.4 | 0 | 0 | 0 | 111.4 | F129 M133 F143 G144 F147 C148 N151 | F129-W141 HydrophobicContact CB-CH2 4.02Å; M133-W141 HydrophobicContact CE-CE3 4.17Å; M133-W141 HydrophobicContact CE-CZ3 3.74Å; M133-W141 HydrophobicContact CG-CE3 3.8Å; M133-W141 HydrophobicContact CG-CZ3 3.83Å; M133-W141 HydrophobicContact SD-CE3 3.29Å; M133-W141 HydrophobicContact SD-CZ3 3.46Å; M133-W141 WeakPolarHBondContact SD-CZ3 3.22Å; W141-F143 VanDerWaalsContact C-N 3.31Å; W141-F143 HydrophobicContact CZ2-CB 4.36Å; W141-F143 HydrophobicContact CZ2-CD2 4.37Å; W141-F143 PolarHBondContact O-N 3.32Å; W141-G144 PolarHBondContact NE1-O 3.43Å; W141-F147 AromaticContact CE2-CD1 3.95Å; W141-F147 HydrophobicContact CH2-CD1 4.3Å; W141-F147 HydrophobicContact CH2-CE1 4.41Å; W141-F147 AromaticContact CZ2-CD1 3.33Å; W141-F147 HydrophobicContact CZ2-CD1 3.33Å; W141-F147 AromaticContact CZ2-CE1 3.85Å; W141-F147 HydrophobicContact CZ2-CE1 3.85Å; W141-F147 HydrophobicContact CZ2-CG 4.3Å; W141-C148 HydrophobicContact CD2-CB 3.98Å; W141-C148 VanDerWaalsContact CE2-CA 3.45Å; W141-C148 HydrophobicContact CG-CB 3.89Å; W141-C148 HydrophobicContact CZ2-CB 4.31Å; W141-C148 VanDerWaalsContact NE1-N 3.11Å; W141-N151 HydrophobicContact CH2-CB 3.88Å; W141-N151 HydrophobicContact CZ2-CB 4.06Å | ||
| 142 | M | 67.3 | Low | 70 | Confident | 127 Ų | 127 | 59.8 Ų | 59.8 | 63% | 0.626 | 32% | 0.322 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.1 | -13 | -173.8 | -58.3 | -172.9 | -59.3 | 0 | 0 | 114.3 | I132 S136 I140 | I132-M142 HydrophobicContact CG2-CE 3.87Å; S136-M142 WeakPolarHBondContact OG-CE 3.44Å; S136-M142 PolarHBondContact OG-SD 3.04Å; I140-M142 PolarHBondContact O-N 2.94Å; I140-M142 VanDerWaalsContact O-N 3.15Å |
| 143 | F | 70.6 | Confident | 70.2 | Confident | 85 Ų | 85 | 58.6 Ų | 58.6 | 37% | 0.373 | 32% | 0.315 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.2 | 9.2 | -174 | -58.9 | -79.7 | 0 | 0 | 0 | 113.8 | F129 I132 W141 F147 | F129-F143 HydrophobicContact CD1-CD2 4.45Å; F129-F143 HydrophobicContact CD1-CE2 4.12Å; F129-F143 HydrophobicContact CD1-CZ 4.2Å; I132-F143 HydrophobicContact CB-CE2 4.4Å; I132-F143 HydrophobicContact CD1-CZ 3.94Å; I132-F143 HydrophobicContact CG2-CE2 3.97Å; I132-F143 HydrophobicContact CG2-CZ 3.97Å; W141-F143 VanDerWaalsContact C-N 3.31Å; W141-F143 HydrophobicContact CZ2-CB 4.36Å; W141-F143 HydrophobicContact CZ2-CD2 4.37Å; W141-F143 PolarHBondContact O-N 3.32Å; F143-F147 HydrophobicContact CB-CB 4.1Å; F143-F147 HydrophobicContact CB-CD1 3.46Å; F143-F147 VanDerWaalsContact CB-CD1 3.46Å; F143-F147 HydrophobicContact CB-CE1 4.3Å; F143-F147 HydrophobicContact CB-CG 4.07Å; F143-F147 HydrophobicContact CD2-CD1 4.48Å; F143-F147 HydrophobicContact CG-CD1 4.01Å; F143-F147 HydrophobicContact CG-CE1 4.4Å; F143-F147 VanDerWaalsContact O-CB 3.31Å; F143-F147 WeakPolarHBondContact O-CB 3.46Å |
| 144 | G | 71.6 | Confident | 70.9 | Confident | 36 Ų | 36 | 61.8 Ų | 61.8 | 37% | 0.371 | 33% | 0.328 | S | S | . | . | trans | 78.4 | 156 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | W141 A146 F147 C148 | W141-G144 PolarHBondContact NE1-O 3.43Å; G144-A146 VanDerWaalsContact C-N 3.34Å; G144-A146 PolarHBondContact O-N 3.42Å; G144-F147 PolarHBondContact O-N 3.4Å; G144-F147 VanDerWaalsContact O-N 3.14Å; G144-C148 PolarHBondContact O-N 3.43Å; G144-C148 VanDerWaalsContact O-N 3.14Å | ||
| 145 | D | 71.8 | Confident | 71.5 | Confident | 90 Ų | 90 | 61.6 Ų | 61.6 | 48% | 0.481 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60.3 | -39.7 | -170.4 | -61.3 | -27.1 | 0 | 0 | 0 | 113.2 | F147 C148 V149 | D145-F147 VanDerWaalsContact C-N 3.27Å; D145-F147 PolarHBondContact O-N 3.33Å; D145-C148 WeakPolarHBondContact O-CB 3.21Å; D145-C148 PolarHBondContact O-N 2.86Å; D145-C148 VanDerWaalsContact O-N 3.15Å; D145-V149 WeakPolarHBondContact O-CG2 3.38Å; D145-V149 PolarHBondContact O-N 3.35Å |
| 146 | A | 74.3 | Confident | 72.2 | Confident | 78 Ų | 78 | 57.9 Ų | 57.9 | 65% | 0.645 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -59.3 | -39.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G144 A150 | G144-A146 VanDerWaalsContact C-N 3.34Å; G144-A146 PolarHBondContact O-N 3.42Å; A146-A150 WeakPolarHBondContact O-CB 3.43Å; A146-A150 PolarHBondContact O-N 3.01Å; A146-A150 VanDerWaalsContact O-N 3.07Å |
| 147 | F | 78.1 | Confident | 73.2 | Confident | 72 Ų | 72 | 57.6 Ų | 57.6 | 32% | 0.316 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -75.5 | -32.5 | 178.8 | -164.7 | -105.2 | 0 | 0 | 0 | 111.8 | F129 W141 F143 G144 D145 A150 N151 | F129-F147 HydrophobicContact CB-CE1 4.5Å; F129-F147 AromaticContact CD1-CE1 3.47Å; F129-F147 HydrophobicContact CD1-CE1 3.47Å; F129-F147 VanDerWaalsContact CD1-CE1 3.47Å; F129-F147 AromaticContact CD1-CZ 3.91Å; F129-F147 HydrophobicContact CD1-CZ 3.91Å; F129-F147 HydrophobicContact CD2-CE1 4.06Å; F129-F147 HydrophobicContact CD2-CZ 4.03Å; F129-F147 AromaticContact CE1-CE1 3.56Å; F129-F147 HydrophobicContact CE1-CE1 3.56Å; F129-F147 AromaticContact CE1-CZ 3.54Å; F129-F147 HydrophobicContact CE1-CZ 3.54Å; F129-F147 HydrophobicContact CE2-CE1 4.15Å; F129-F147 AromaticContact CE2-CZ 3.69Å; F129-F147 HydrophobicContact CE2-CZ 3.69Å; F129-F147 AromaticContact CG-CE1 3.73Å; F129-F147 HydrophobicContact CG-CE1 3.73Å; F129-F147 HydrophobicContact CG-CZ 4.14Å; F129-F147 AromaticContact CZ-CE1 3.92Å; F129-F147 HydrophobicContact CZ-CE1 3.92Å; F129-F147 AromaticContact CZ-CZ 3.43Å; F129-F147 HydrophobicContact CZ-CZ 3.43Å; F129-F147 VanDerWaalsContact CZ-CZ 3.43Å; W141-F147 AromaticContact CE2-CD1 3.95Å; W141-F147 HydrophobicContact CH2-CD1 4.3Å; W141-F147 HydrophobicContact CH2-CE1 4.41Å; W141-F147 AromaticContact CZ2-CD1 3.33Å; W141-F147 HydrophobicContact CZ2-CD1 3.33Å; W141-F147 AromaticContact CZ2-CE1 3.85Å; W141-F147 HydrophobicContact CZ2-CE1 3.85Å; W141-F147 HydrophobicContact CZ2-CG 4.3Å; F143-F147 HydrophobicContact CB-CB 4.1Å; F143-F147 HydrophobicContact CB-CD1 3.46Å; F143-F147 VanDerWaalsContact CB-CD1 3.46Å; F143-F147 HydrophobicContact CB-CE1 4.3Å; F143-F147 HydrophobicContact CB-CG 4.07Å; F143-F147 HydrophobicContact CD2-CD1 4.48Å; F143-F147 HydrophobicContact CG-CD1 4.01Å; F143-F147 HydrophobicContact CG-CE1 4.4Å; F143-F147 VanDerWaalsContact O-CB 3.31Å; F143-F147 WeakPolarHBondContact O-CB 3.46Å; G144-F147 PolarHBondContact O-N 3.4Å; G144-F147 VanDerWaalsContact O-N 3.14Å; D145-F147 VanDerWaalsContact C-N 3.27Å; D145-F147 PolarHBondContact O-N 3.33Å; F147-A150 PolarHBondContact O-N 3.42Å; F147-N151 WeakPolarHBondContact O-CB 3.23Å; F147-N151 PolarHBondContact O-N 3.21Å |
| 148 | C | 75.1 | Confident | 75.2 | Confident | 9 Ų | 9 | 48.5 Ų | 48.5 | 6% | 0.061 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -59.1 | -52.1 | 172.7 | 175.9 | 0 | 0 | 0 | 0 | 111.1 | W141 G144 D145 A150 N151 G152 C226 | W141-C148 HydrophobicContact CD2-CB 3.98Å; W141-C148 VanDerWaalsContact CE2-CA 3.45Å; W141-C148 HydrophobicContact CG-CB 3.89Å; W141-C148 HydrophobicContact CZ2-CB 4.31Å; W141-C148 VanDerWaalsContact NE1-N 3.11Å; G144-C148 PolarHBondContact O-N 3.43Å; G144-C148 VanDerWaalsContact O-N 3.14Å; D145-C148 WeakPolarHBondContact O-CB 3.21Å; D145-C148 PolarHBondContact O-N 2.86Å; D145-C148 VanDerWaalsContact O-N 3.15Å; C148-A150 VanDerWaalsContact C-N 3.33Å; C148-A150 PolarHBondContact O-N 3.37Å; C148-N151 PolarHBondContact O-N 2.83Å; C148-G152 PolarHBondContact O-N 3.11Å; C148-C226 WeakPolarHBondContact CA-SG 3.34Å; C148-C226 HydrophobicContact CB-CB 4.09Å; C148-C226 WeakPolarHBondContact CB-SG 3.38Å; C148-C226 WeakPolarHBondContact O-CB 3.48Å; C148-C226 VanDerWaalsContact SG-CA 3.58Å; C148-C226 WeakPolarHBondContact SG-CB 3.39Å; C148-C226 CovalentContact SG-SG 2.01Å; C148-C226 PolarHBondContact SG-SG 3.4Å |
| 149 | V | 74.8 | Confident | 76.8 | Confident | 28 Ų | 28 | 42.5 Ų | 42.5 | 17% | 0.17 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -66 | -38.1 | 179.8 | -168.5 | 0 | 0 | 0 | 0 | 110.9 | D145 G152 F153 Y209 V212 | D145-V149 WeakPolarHBondContact O-CG2 3.38Å; D145-V149 PolarHBondContact O-N 3.35Å; V149-G152 PolarHBondContact O-N 3.41Å; V149-F153 PolarHBondContact O-N 3.46Å; V149-Y209 HydrophobicContact CB-CD2 4.16Å; V149-Y209 HydrophobicContact CB-CE2 4.26Å; V149-Y209 HydrophobicContact CG1-CD2 3.3Å; V149-Y209 HydrophobicContact CG1-CE2 3.84Å; V149-Y209 HydrophobicContact CG1-CG 4.12Å; V149-V212 HydrophobicContact CG1-CG1 4.36Å; V149-V212 HydrophobicContact CG2-CG1 3.8Å |
| 150 | A | 79.6 | Confident | 78.5 | Confident | 27 Ų | 27 | 42 Ų | 42 | 22% | 0.223 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -61.8 | -43.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A146 F147 C148 G152 F153 F154 | A146-A150 WeakPolarHBondContact O-CB 3.43Å; A146-A150 PolarHBondContact O-N 3.01Å; A146-A150 VanDerWaalsContact O-N 3.07Å; F147-A150 PolarHBondContact O-N 3.42Å; C148-A150 VanDerWaalsContact C-N 3.33Å; C148-A150 PolarHBondContact O-N 3.37Å; A150-G152 PolarHBondContact O-N 2.91Å; A150-F153 WeakPolarHBondContact O-CB 3.36Å; A150-F153 PolarHBondContact O-N 3.4Å; A150-F154 HydrophobicContact CB-CE2 4.37Å; A150-F154 WeakPolarHBondContact O-CD2 3.33Å; A150-F154 PolarHBondContact O-N 2.86Å |
| 151 | N | 80.7 | Confident | 80.2 | Confident | 4 Ų | 4 | 37.2 Ų | 37.2 | 2% | 0.021 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -61.7 | -42.7 | 177 | -177.9 | 69.4 | 0 | 0 | 0 | 111.7 | W141 F147 C148 F154 N155 | W141-N151 HydrophobicContact CH2-CB 3.88Å; W141-N151 HydrophobicContact CZ2-CB 4.06Å; F147-N151 WeakPolarHBondContact O-CB 3.23Å; F147-N151 PolarHBondContact O-N 3.21Å; C148-N151 PolarHBondContact O-N 2.83Å; N151-F154 PolarHBondContact O-N 2.91Å; N151-N155 WeakPolarHBondContact O-CB 3.38Å; N151-N155 PolarHBondContact O-N 2.84Å |
| 152 | G | 77.9 | Confident | 81.5 | Confident | 12 Ų | 12 | 36.2 Ų | 36.2 | 12% | 0.124 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.8 | -41.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | C148 V149 A150 N155 T156 C226 | C148-G152 PolarHBondContact O-N 3.11Å; V149-G152 PolarHBondContact O-N 3.41Å; A150-G152 PolarHBondContact O-N 2.91Å; G152-N155 PolarHBondContact O-N 2.96Å; G152-T156 WeakPolarHBondContact O-CB 3.07Å; G152-T156 PolarHBondContact O-N 3.2Å; G152-T156 PolarHBondContact O-OG1 3.06Å; G152-C226 VanDerWaalsContact CA-O 3.3Å; G152-C226 WeakPolarHBondContact CA-O 3.32Å |
| 153 | F | 83.5 | Confident | 82.6 | Confident | 41 Ų | 41 | 30.4 Ų | 30.4 | 18% | 0.18 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -60 | -50.9 | 174.1 | 168.2 | -93.8 | 0 | 0 | 0 | 111.8 | V149 A150 N155 T156 C157 V202 L206 | V149-F153 PolarHBondContact O-N 3.46Å; A150-F153 WeakPolarHBondContact O-CB 3.36Å; A150-F153 PolarHBondContact O-N 3.4Å; F153-N155 VanDerWaalsContact C-N 3.34Å; F153-N155 PolarHBondContact O-N 3.26Å; F153-T156 PolarHBondContact O-N 3.26Å; F153-C157 HydrophobicContact CE1-CB 4.48Å; F153-C157 HydrophobicContact CZ-CB 4.44Å; F153-C157 WeakPolarHBondContact O-CB 3.08Å; F153-C157 PolarHBondContact O-N 3.43Å; F153-V202 HydrophobicContact CZ-CG1 4.44Å; F153-L206 HydrophobicContact CE2-CD2 3.95Å; F153-L206 HydrophobicContact CE2-CG 4.09Å |
| 154 | F | 86.9 | Confident | 83.7 | Confident | 78 Ų | 78 | 27.8 Ų | 27.8 | 34% | 0.342 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -62.9 | -41.5 | -179.6 | -75.6 | -58 | 0 | 0 | 0 | 111.9 | A150 N151 T156 C157 F158 | A150-F154 HydrophobicContact CB-CE2 4.37Å; A150-F154 WeakPolarHBondContact O-CD2 3.33Å; A150-F154 PolarHBondContact O-N 2.86Å; N151-F154 PolarHBondContact O-N 2.91Å; F154-T156 PolarHBondContact O-N 2.85Å; F154-C157 PolarHBondContact O-N 2.87Å; F154-F158 HydrophobicContact CB-CD2 4.15Å; F154-F158 HydrophobicContact CB-CE2 3.75Å; F154-F158 AromaticContact CD1-CE2 3.75Å; F154-F158 HydrophobicContact CD1-CE2 3.75Å; F154-F158 AromaticContact CD1-CZ 3.72Å; F154-F158 HydrophobicContact CD1-CZ 3.72Å; F154-F158 HydrophobicContact CE1-CZ 4.43Å; F154-F158 HydrophobicContact CG-CE2 4.09Å; F154-F158 WeakPolarHBondContact O-CB 3.44Å; F154-F158 WeakPolarHBondContact O-CD2 3.13Å; F154-F158 WeakPolarHBondContact O-CG 3.03Å; F154-F158 PolarHBondContact O-N 2.96Å |
| 155 | N | 85.4 | Confident | 84.8 | Confident | 7 Ų | 7 | 26.1 Ų | 26.1 | 4% | 0.037 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -60.6 | -47.2 | 178.1 | -155 | -72.6 | 0 | 0 | 0 | 111.8 | C126 N151 G152 F153 G159 M227 W338 | C126-N155 WeakPolarHBondContact CB-ND2 3.31Å; N151-N155 WeakPolarHBondContact O-CB 3.38Å; N151-N155 PolarHBondContact O-N 2.84Å; G152-N155 PolarHBondContact O-N 2.96Å; F153-N155 VanDerWaalsContact C-N 3.34Å; F153-N155 PolarHBondContact O-N 3.26Å; N155-G159 PolarHBondContact O-N 2.65Å; N155-M227 WeakPolarHBondContact OD1-CE 2.98Å; N155-W338 PolarHBondContact ND2-NE1 3.45Å |
| 156 | T | 84.8 | Confident | 85.7 | Confident | 44 Ų | 44 | 21.9 Ų | 21.9 | 27% | 0.27 | 13% | 0.13 | S | C | . | . | H | α-helix | trans | -64.9 | -47.5 | 177.8 | -54.1 | 0 | 0 | 0 | 0 | 110.9 | G152 F153 F154 G159 I160 | G152-T156 WeakPolarHBondContact O-CB 3.07Å; G152-T156 PolarHBondContact O-N 3.2Å; G152-T156 PolarHBondContact O-OG1 3.06Å; F153-T156 PolarHBondContact O-N 3.26Å; F154-T156 PolarHBondContact O-N 2.85Å; T156-G159 PolarHBondContact O-N 3.11Å; T156-I160 HydrophobicContact CG2-CD1 3.87Å; T156-I160 HydrophobicContact CG2-CG1 4.47Å; T156-I160 VanDerWaalsContact O-CG1 3.28Å; T156-I160 WeakPolarHBondContact O-CG1 3.47Å; T156-I160 PolarHBondContact O-N 2.97Å |
| 157 | C | 90.3 | Very high | 86.5 | Confident | 5 Ų | 5 | 18.6 Ų | 18.6 | 3% | 0.034 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -60.7 | -50.7 | -177.5 | -174.4 | 0 | 0 | 0 | 0 | 111.8 | F153 F154 G159 I160 I161 S205 | F153-C157 HydrophobicContact CE1-CB 4.48Å; F153-C157 HydrophobicContact CZ-CB 4.44Å; F153-C157 WeakPolarHBondContact O-CB 3.08Å; F153-C157 PolarHBondContact O-N 3.43Å; F154-C157 PolarHBondContact O-N 2.87Å; C157-G159 VanDerWaalsContact C-N 3.34Å; C157-G159 PolarHBondContact O-N 3.32Å; C157-I160 PolarHBondContact O-N 3.08Å; C157-I161 VanDerWaalsContact O-CG1 3.31Å; C157-I161 WeakPolarHBondContact O-CG1 3.33Å; C157-I161 PolarHBondContact O-N 3.48Å; C157-S205 WeakPolarHBondContact CA-OG 3.21Å; C157-S205 PolarHBondContact N-OG 3.44Å |
| 158 | F | 92 | Very high | 87.2 | Confident | 12 Ų | 12 | 16.4 Ų | 16.4 | 5% | 0.053 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -68.2 | -33.4 | 179.5 | -59.9 | -44.7 | 0 | 0 | 0 | 112.6 | L121 T122 L125 F154 I161 S162 | L121-F158 HydrophobicContact CB-CD1 4.17Å; L121-F158 HydrophobicContact CB-CD2 4.1Å; L121-F158 HydrophobicContact CB-CE1 3.87Å; L121-F158 HydrophobicContact CB-CE2 3.77Å; L121-F158 HydrophobicContact CB-CG 4.31Å; L121-F158 HydrophobicContact CB-CZ 3.67Å; L121-F158 HydrophobicContact CD1-CD1 4.29Å; L121-F158 HydrophobicContact CD1-CE1 3.62Å; L121-F158 HydrophobicContact CD1-CZ 3.94Å; L121-F158 HydrophobicContact CG-CE1 4.38Å; L121-F158 HydrophobicContact CG-CZ 4.33Å; T122-F158 WeakPolarHBondContact OG1-CB 3.16Å; L125-F158 HydrophobicContact CB-CE2 4.49Å; L125-F158 HydrophobicContact CD1-CE2 3.85Å; L125-F158 HydrophobicContact CD1-CZ 3.96Å; F154-F158 HydrophobicContact CB-CD2 4.15Å; F154-F158 HydrophobicContact CB-CE2 3.75Å; F154-F158 AromaticContact CD1-CE2 3.75Å; F154-F158 HydrophobicContact CD1-CE2 3.75Å; F154-F158 AromaticContact CD1-CZ 3.72Å; F154-F158 HydrophobicContact CD1-CZ 3.72Å; F154-F158 HydrophobicContact CE1-CZ 4.43Å; F154-F158 HydrophobicContact CG-CE2 4.09Å; F154-F158 WeakPolarHBondContact O-CB 3.44Å; F154-F158 WeakPolarHBondContact O-CD2 3.13Å; F154-F158 WeakPolarHBondContact O-CG 3.03Å; F154-F158 PolarHBondContact O-N 2.96Å; F158-I161 HydrophobicContact CD1-CD1 4.07Å; F158-I161 PolarHBondContact O-N 3.35Å; F158-S162 WeakPolarHBondContact O-CB 3.4Å; F158-S162 PolarHBondContact O-N 3.44Å |
| 159 | G | 89 | Confident | 87.9 | Confident | 5 Ų | 5 | 16.1 Ų | 16.1 | 5% | 0.052 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -60.9 | -43.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113 | N155 T156 C157 S162 T163 | N155-G159 PolarHBondContact O-N 2.65Å; T156-G159 PolarHBondContact O-N 3.11Å; C157-G159 VanDerWaalsContact C-N 3.34Å; C157-G159 PolarHBondContact O-N 3.32Å; G159-S162 PolarHBondContact O-N 2.84Å; G159-T163 PolarHBondContact O-N 2.98Å; G159-T163 VanDerWaalsContact O-N 3.07Å; G159-T163 PolarHBondContact O-OG1 2.99Å |
| 160 | I | 90.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 14.8 Ų | 14.8 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -66.4 | -44.4 | 175.9 | -63.4 | 169.8 | 0 | 0 | 0 | 110.6 | T156 C157 S162 T163 L164 A201 F204 L245 C249 | T156-I160 HydrophobicContact CG2-CD1 3.87Å; T156-I160 HydrophobicContact CG2-CG1 4.47Å; T156-I160 VanDerWaalsContact O-CG1 3.28Å; T156-I160 WeakPolarHBondContact O-CG1 3.47Å; T156-I160 PolarHBondContact O-N 2.97Å; C157-I160 PolarHBondContact O-N 3.08Å; I160-S162 VanDerWaalsContact C-N 3.31Å; I160-S162 PolarHBondContact O-N 2.95Å; I160-T163 PolarHBondContact O-N 3.09Å; I160-L164 HydrophobicContact CG2-CD1 3.63Å; I160-L164 HydrophobicContact CG2-CG 4Å; I160-L164 WeakPolarHBondContact O-CB 3.16Å; I160-L164 WeakPolarHBondContact O-CG 3.48Å; I160-L164 PolarHBondContact O-N 2.96Å; I160-A201 HydrophobicContact CB-CB 3.92Å; I160-A201 HydrophobicContact CG2-CB 3.72Å; I160-F204 HydrophobicContact CD1-CB 4.09Å; I160-L245 HydrophobicContact CD1-CD2 4.12Å; I160-C249 HydrophobicContact CD1-CB 4.21Å; I160-C249 HydrophobicContact CG1-CB 3.95Å; I160-C249 HydrophobicContact CG2-CB 4.21Å |
| 161 | I | 94.2 | Very high | 89.1 | Confident | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -57.3 | -46.9 | 176.5 | -67.5 | 164.8 | 0 | 0 | 0 | 110.5 | C157 F158 T163 T165 V197 W198 A201 | C157-I161 VanDerWaalsContact O-CG1 3.31Å; C157-I161 WeakPolarHBondContact O-CG1 3.33Å; C157-I161 PolarHBondContact O-N 3.48Å; F158-I161 HydrophobicContact CD1-CD1 4.07Å; F158-I161 PolarHBondContact O-N 3.35Å; I161-T163 PolarHBondContact O-N 3.44Å; I161-T165 WeakPolarHBondContact O-CB 3.44Å; I161-T165 PolarHBondContact O-N 3.49Å; I161-T165 PolarHBondContact O-OG1 3.07Å; I161-V197 HydrophobicContact CG2-CG1 4.32Å; I161-W198 HydrophobicContact CD1-CD2 3.73Å; I161-W198 HydrophobicContact CD1-CE3 3.52Å; I161-W198 HydrophobicContact CD1-CG 4.31Å; I161-W198 HydrophobicContact CD1-CH2 4.21Å; I161-W198 HydrophobicContact CD1-CZ2 4.39Å; I161-W198 HydrophobicContact CD1-CZ3 3.78Å; I161-W198 HydrophobicContact CG1-CD2 4.39Å; I161-W198 HydrophobicContact CG2-CD2 4.43Å; I161-W198 HydrophobicContact CG2-CZ2 4.21Å; I161-A201 HydrophobicContact CB-CB 4.48Å; I161-A201 HydrophobicContact CD1-CB 4.11Å; I161-A201 HydrophobicContact CG1-CB 3.35Å |
| 162 | S | 92.8 | Very high | 89.5 | Confident | 1 Ų | 1 | 17.2 Ų | 17.2 | 1% | 0.007 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -58.7 | -49.1 | 179.7 | -168.5 | 0 | 0 | 0 | 0 | 110.7 | L115 D119 F158 G159 I160 T165 M166 | L115-S162 WeakPolarHBondContact CD1-O 3.48Å; L115-S162 WeakPolarHBondContact CD1-OG 3.29Å; D119-S162 PolarHBondContact OD1-OG 2.87Å; F158-S162 WeakPolarHBondContact O-CB 3.4Å; F158-S162 PolarHBondContact O-N 3.44Å; G159-S162 PolarHBondContact O-N 2.84Å; I160-S162 VanDerWaalsContact C-N 3.31Å; I160-S162 PolarHBondContact O-N 2.95Å; S162-T165 PolarHBondContact O-N 3.13Å; S162-M166 WeakPolarHBondContact O-CB 3.28Å; S162-M166 VanDerWaalsContact O-CG 3.22Å; S162-M166 WeakPolarHBondContact O-CG 3.37Å; S162-M166 PolarHBondContact O-N 3.43Å |
| 163 | T | 91.3 | Very high | 89.9 | Confident | 5 Ų | 5 | 17.3 Ų | 17.3 | 3% | 0.031 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -66 | -44.7 | -178.8 | -55.8 | 0 | 0 | 0 | 0 | 113.4 | G159 I160 I161 M166 T167 C249 F250 P253 | G159-T163 PolarHBondContact O-N 2.98Å; G159-T163 VanDerWaalsContact O-N 3.07Å; G159-T163 PolarHBondContact O-OG1 2.99Å; I160-T163 PolarHBondContact O-N 3.09Å; I161-T163 PolarHBondContact O-N 3.44Å; T163-M166 WeakPolarHBondContact O-CB 3.27Å; T163-M166 PolarHBondContact O-N 3.4Å; T163-T167 PolarHBondContact O-N 3.45Å; T163-T167 VanDerWaalsContact O-N 3.08Å; T163-T167 PolarHBondContact O-OG1 2.92Å; T163-C249 WeakPolarHBondContact CG2-O 3.36Å; T163-F250 HydrophobicContact CG2-CD1 4.34Å; T163-P253 HydrophobicContact CG2-CB 3.85Å; T163-P253 HydrophobicContact CG2-CG 4.46Å |
| 164 | L | 93.4 | Very high | 90 | Very high | 30 Ų | 30 | 16.6 Ų | 16.6 | 16% | 0.157 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -68.7 | -36.2 | 177.6 | -68.8 | -179.1 | 0 | 0 | 0 | 111.7 | I160 T167 L168 V197 T200 P253 | I160-L164 HydrophobicContact CG2-CD1 3.63Å; I160-L164 HydrophobicContact CG2-CG 4Å; I160-L164 WeakPolarHBondContact O-CB 3.16Å; I160-L164 WeakPolarHBondContact O-CG 3.48Å; I160-L164 PolarHBondContact O-N 2.96Å; L164-T167 WeakPolarHBondContact O-CB 3.48Å; L164-T167 PolarHBondContact O-N 3.23Å; L164-L168 PolarHBondContact O-N 3.44Å; L164-V197 HydrophobicContact CB-CB 4.42Å; L164-V197 HydrophobicContact CB-CG1 3.68Å; L164-V197 HydrophobicContact CB-CG2 3.97Å; L164-V197 HydrophobicContact CD1-CG1 4.33Å; L164-T200 HydrophobicContact CD1-CG2 3.93Å; L164-P253 HydrophobicContact CD2-CG 3.84Å |
| 165 | T | 93.6 | Very high | 89.9 | Confident | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -65.4 | -41.7 | 175.3 | -57.5 | 0 | 0 | 0 | 0 | 111.2 | F111 L115 I161 S162 T167 L168 I169 | F111-T165 HydrophobicContact CB-CG2 4.35Å; F111-T165 WeakPolarHBondContact O-CG2 3.34Å; L115-T165 HydrophobicContact CB-CG2 3.88Å; I161-T165 WeakPolarHBondContact O-CB 3.44Å; I161-T165 PolarHBondContact O-N 3.49Å; I161-T165 PolarHBondContact O-OG1 3.07Å; S162-T165 PolarHBondContact O-N 3.13Å; T165-T167 VanDerWaalsContact C-N 3.26Å; T165-T167 PolarHBondContact O-N 3.18Å; T165-L168 WeakPolarHBondContact O-CB 3.16Å; T165-L168 PolarHBondContact O-N 3.11Å; T165-I169 HydrophobicContact CG2-CD1 4.31Å; T165-I169 VanDerWaalsContact O-CG1 3.32Å; T165-I169 WeakPolarHBondContact O-CG1 3.44Å; T165-I169 PolarHBondContact O-N 3.39Å |
| 166 | M | 90.4 | Very high | 89.7 | Confident | 1 Ų | 1 | 19.2 Ų | 19.2 | 1% | 0.005 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -57 | -40.4 | 171.9 | -76 | -72.4 | -153.1 | 0 | 0 | 112.3 | L115 S162 T163 I169 S170 M257 M300 I304 N344 | L115-M166 HydrophobicContact CD1-CE 4.25Å; L115-M166 HydrophobicContact CD1-CG 3.9Å; L115-M166 HydrophobicContact CD1-SD 4.38Å; L115-M166 HydrophobicContact CD2-CE 3.69Å; L115-M166 HydrophobicContact CD2-CG 4.27Å; L115-M166 HydrophobicContact CD2-SD 3.68Å; S162-M166 WeakPolarHBondContact O-CB 3.28Å; S162-M166 VanDerWaalsContact O-CG 3.22Å; S162-M166 WeakPolarHBondContact O-CG 3.37Å; S162-M166 PolarHBondContact O-N 3.43Å; T163-M166 WeakPolarHBondContact O-CB 3.27Å; T163-M166 PolarHBondContact O-N 3.4Å; M166-I169 PolarHBondContact O-N 3.48Å; M166-S170 PolarHBondContact O-N 2.96Å; M166-S170 PolarHBondContact O-OG 3.44Å; M166-M257 HydrophobicContact CB-CE 3.62Å; M166-M257 HydrophobicContact CB-SD 4.04Å; M166-M300 HydrophobicContact CE-CB 4.05Å; M166-M300 HydrophobicContact CE-CE 3.41Å; M166-M300 VanDerWaalsContact CE-CE 3.41Å; M166-M300 HydrophobicContact SD-CB 4.33Å; M166-M300 HydrophobicContact SD-CE 3.36Å; M166-M300 WeakPolarHBondContact SD-CE 3.49Å; M166-I304 HydrophobicContact CB-CD1 4.45Å; M166-I304 HydrophobicContact CG-CD1 4.23Å; M166-N344 VanDerWaalsContact CE-OD1 3.27Å; M166-N344 WeakPolarHBondContact CE-OD1 3.23Å |
| 167 | T | 92.6 | Very high | 89.4 | Confident | 9 Ų | 9 | 17.4 Ų | 17.4 | 6% | 0.055 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -65.7 | -43.8 | 175.6 | -56.1 | 0 | 0 | 0 | 0 | 111.7 | T163 L164 T165 I169 S170 F171 P253 L256 M257 | T163-T167 PolarHBondContact O-N 3.45Å; T163-T167 VanDerWaalsContact O-N 3.08Å; T163-T167 PolarHBondContact O-OG1 2.92Å; L164-T167 WeakPolarHBondContact O-CB 3.48Å; L164-T167 PolarHBondContact O-N 3.23Å; T165-T167 VanDerWaalsContact C-N 3.26Å; T165-T167 PolarHBondContact O-N 3.18Å; T167-I169 VanDerWaalsContact C-N 3.34Å; T167-I169 PolarHBondContact O-N 2.83Å; T167-S170 WeakPolarHBondContact O-CB 3.16Å; T167-S170 PolarHBondContact O-N 2.92Å; T167-S170 VanDerWaalsContact O-N 3.13Å; T167-F171 HydrophobicContact CG2-CD2 3.92Å; T167-F171 HydrophobicContact CG2-CE2 3.67Å; T167-F171 VanDerWaalsContact O-CD2 3.31Å; T167-F171 WeakPolarHBondContact O-CD2 3.29Å; T167-F171 PolarHBondContact O-N 3.41Å; T167-P253 WeakPolarHBondContact OG1-CB 3.5Å; T167-L256 HydrophobicContact CG2-CB 4.1Å; T167-L256 HydrophobicContact CG2-CD1 4.37Å; T167-M257 HydrophobicContact CG2-CG 4.3Å |
| 168 | L | 92.3 | Very high | 88.9 | Confident | 27 Ų | 27 | 18.9 Ų | 18.9 | 14% | 0.141 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -59.7 | -42.6 | 173.6 | -75 | -175.8 | 0 | 0 | 0 | 112.5 | F111 L164 T165 S170 F171 D172 L193 V197 | F111-L168 HydrophobicContact CE1-CD1 4.34Å; L164-L168 PolarHBondContact O-N 3.44Å; T165-L168 WeakPolarHBondContact O-CB 3.16Å; T165-L168 PolarHBondContact O-N 3.11Å; L168-S170 VanDerWaalsContact C-N 3.28Å; L168-S170 PolarHBondContact O-N 3.48Å; L168-F171 PolarHBondContact O-N 3.25Å; L168-D172 WeakPolarHBondContact O-CB 3.34Å; L168-D172 PolarHBondContact O-N 2.94Å; L168-L193 HydrophobicContact CD1-CB 4.14Å; L168-L193 HydrophobicContact CD2-CB 4.38Å; L168-L193 HydrophobicContact CD2-CD2 4.46Å; L168-V197 HydrophobicContact CD1-CB 4.49Å; L168-V197 HydrophobicContact CD1-CG2 3.44Å; L168-V197 VanDerWaalsContact CD1-CG2 3.44Å; L168-V197 HydrophobicContact CG-CG2 4.01Å |
| 169 | I | 90.4 | Very high | 88.1 | Confident | 3 Ų | 3 | 25.7 Ų | 25.7 | 2% | 0.015 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.3 | -43.6 | 175.4 | -66.3 | 166.3 | 0 | 0 | 0 | 109.7 | F111 I112 L115 T165 M166 T167 F171 D172 R173 V297 | F111-I169 HydrophobicContact CB-CD1 4.21Å; F111-I169 HydrophobicContact CB-CG1 3.58Å; F111-I169 HydrophobicContact CG-CG1 4.43Å; I112-I169 HydrophobicContact CG1-CD1 4.28Å; L115-I169 HydrophobicContact CD2-CD1 4.15Å; T165-I169 HydrophobicContact CG2-CD1 4.31Å; T165-I169 VanDerWaalsContact O-CG1 3.32Å; T165-I169 WeakPolarHBondContact O-CG1 3.44Å; T165-I169 PolarHBondContact O-N 3.39Å; M166-I169 PolarHBondContact O-N 3.48Å; T167-I169 VanDerWaalsContact C-N 3.34Å; T167-I169 PolarHBondContact O-N 2.83Å; I169-F171 PolarHBondContact O-N 2.73Å; I169-D172 PolarHBondContact O-N 3.36Å; I169-R173 WeakPolarHBondContact O-CG 3.25Å; I169-R173 PolarHBondContact O-N 3.04Å; I169-V297 HydrophobicContact CG2-CG1 4.17Å; I169-V297 HydrophobicContact CG2-CG2 3.51Å |
| 170 | S | 89.9 | Confident | 86.8 | Confident | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.9 | -43.3 | 177.8 | -58.5 | 0 | 0 | 0 | 0 | 112.5 | M166 T167 L168 R173 Y174 M257 H261 V297 | M166-S170 PolarHBondContact O-N 2.96Å; M166-S170 PolarHBondContact O-OG 3.44Å; T167-S170 WeakPolarHBondContact O-CB 3.16Å; T167-S170 PolarHBondContact O-N 2.92Å; T167-S170 VanDerWaalsContact O-N 3.13Å; L168-S170 VanDerWaalsContact C-N 3.28Å; L168-S170 PolarHBondContact O-N 3.48Å; S170-R173 PolarHBondContact O-N 3.38Å; S170-Y174 WeakPolarHBondContact O-CB 3.22Å; S170-Y174 PolarHBondContact O-N 3.42Å; S170-M257 VanDerWaalsContact OG-CE 3.3Å; S170-M257 WeakPolarHBondContact OG-CE 3.49Å; S170-H261 PolarHBondContact OG-CE1 3.31Å; S170-V297 WeakPolarHBondContact OG-CG1 3.5Å |
| 171 | F | 89.9 | Confident | 85.3 | Confident | 64 Ų | 64 | 33 Ų | 33 | 28% | 0.281 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -64 | -45.9 | 174.7 | -83.2 | -64.7 | 0 | 0 | 0 | 112.4 | T167 L168 I169 R173 Y174 Y175 L256 C260 | T167-F171 HydrophobicContact CG2-CD2 3.92Å; T167-F171 HydrophobicContact CG2-CE2 3.67Å; T167-F171 VanDerWaalsContact O-CD2 3.31Å; T167-F171 WeakPolarHBondContact O-CD2 3.29Å; T167-F171 PolarHBondContact O-N 3.41Å; L168-F171 PolarHBondContact O-N 3.25Å; I169-F171 PolarHBondContact O-N 2.73Å; F171-R173 VanDerWaalsContact C-N 3.27Å; F171-R173 PolarHBondContact O-N 2.88Å; F171-Y174 WeakPolarHBondContact O-CB 3.33Å; F171-Y174 PolarHBondContact O-N 3.07Å; F171-Y174 VanDerWaalsContact O-N 3.11Å; F171-Y175 HydrophobicContact CD1-CE2 4.46Å; F171-Y175 WeakPolarHBondContact O-CD2 3.19Å; F171-Y175 PolarHBondContact O-N 2.72Å; F171-L256 HydrophobicContact CE2-CB 4.25Å; F171-L256 HydrophobicContact CE2-CD1 4.08Å; F171-L256 HydrophobicContact CZ-CB 4.16Å; F171-L256 HydrophobicContact CZ-CD1 4.1Å; F171-L256 HydrophobicContact CZ-CD2 4.21Å; F171-L256 HydrophobicContact CZ-CG 4.39Å; F171-C260 VanDerWaalsContact CD1-SG 3.59Å; F171-C260 VanDerWaalsContact CE1-SG 3.59Å |
| 172 | D | 87.2 | Confident | 83.3 | Confident | 17 Ų | 17 | 42.9 Ų | 42.9 | 9% | 0.091 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -55.8 | -43.3 | 177.2 | 176.7 | 65.8 | 0 | 0 | 0 | 111.3 | T108 F111 L168 I169 A176 | T108-D172 WeakPolarHBondContact CG2-OD2 3.48Å; T108-D172 PolarHBondContact OG1-OD2 3Å; F111-D172 HydrophobicContact CD2-CB 4.31Å; F111-D172 HydrophobicContact CE2-CB 3.97Å; L168-D172 WeakPolarHBondContact O-CB 3.34Å; L168-D172 PolarHBondContact O-N 2.94Å; I169-D172 PolarHBondContact O-N 3.36Å; D172-A176 WeakPolarHBondContact O-CB 3.43Å; D172-A176 PolarHBondContact O-N 3.06Å; D172-A176 VanDerWaalsContact O-N 3.11Å |
| 173 | R | 86.3 | Confident | 81.7 | Confident | 14 Ų | 14 | 46.8 Ų | 46.8 | 5% | 0.053 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -67.4 | -42 | 174.7 | -61.8 | -55.7 | 86.8 | -166.3 | -11 | 112.8 | T108 I169 S170 F171 A176 I177 I264 E290 V297 | T108-R173 PolarHBondContact OG1-NH2 2.94Å; I169-R173 WeakPolarHBondContact O-CG 3.25Å; I169-R173 PolarHBondContact O-N 3.04Å; S170-R173 PolarHBondContact O-N 3.38Å; F171-R173 VanDerWaalsContact C-N 3.27Å; F171-R173 PolarHBondContact O-N 2.88Å; R173-A176 PolarHBondContact O-N 3.49Å; R173-I177 WeakPolarHBondContact O-CG1 3.48Å; R173-I177 PolarHBondContact O-N 2.95Å; R173-I264 HydrophobicContact CB-CD1 4.1Å; R173-E290 IonicContact CZ-OE2 3.37Å; R173-E290 IonicContact NH1-OE2 2.6Å; R173-E290 PolarHBondContact NH1-OE2 2.96Å; R173-E290 IonicContact NH2-OE2 3.67Å; R173-V297 HydrophobicContact CG-CG2 4.07Å |
| 174 | Y | 86.7 | Confident | 80.5 | Confident | 26 Ų | 26 | 53.8 Ų | 53.8 | 10% | 0.102 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.5 | -48 | 177.6 | 168.9 | -96.9 | 0 | 0 | 0 | 111.6 | S170 F171 A176 I177 V178 R179 C260 N263 I264 | S170-Y174 WeakPolarHBondContact O-CB 3.22Å; S170-Y174 PolarHBondContact O-N 3.42Å; F171-Y174 WeakPolarHBondContact O-CB 3.33Å; F171-Y174 PolarHBondContact O-N 3.07Å; F171-Y174 VanDerWaalsContact O-N 3.11Å; Y174-A176 VanDerWaalsContact C-N 3.35Å; Y174-A176 PolarHBondContact O-N 2.85Å; Y174-I177 PolarHBondContact O-N 3.3Å; Y174-V178 HydrophobicContact CD2-CB 3.95Å; Y174-V178 HydrophobicContact CD2-CG1 4.43Å; Y174-V178 HydrophobicContact CD2-CG2 3.67Å; Y174-V178 HydrophobicContact CE2-CB 3.79Å; Y174-V178 HydrophobicContact CE2-CG1 3.78Å; Y174-V178 HydrophobicContact CE2-CG2 3.84Å; Y174-V178 VanDerWaalsContact O-CB 3.32Å; Y174-V178 WeakPolarHBondContact O-CB 3.4Å; Y174-V178 PolarHBondContact O-N 2.89Å; Y174-R179 HydrophobicContact CE1-CG 4.27Å; Y174-C260 HydrophobicContact CG-CB 4.43Å; Y174-N263 HydrophobicContact CD2-CB 4.04Å; Y174-N263 HydrophobicContact CE2-CB 3.58Å; Y174-I264 HydrophobicContact CD2-CG1 4.42Å |
| 175 | Y | 85 | Confident | 79.5 | Confident | 111 Ų | 111 | 55.1 Ų | 55.1 | 44% | 0.435 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63.9 | -39.4 | 177.1 | -85.9 | -81.7 | 0 | 0 | 0 | 112.4 | F171 R179 Q180 | F171-Y175 HydrophobicContact CD1-CE2 4.46Å; F171-Y175 WeakPolarHBondContact O-CD2 3.19Å; F171-Y175 PolarHBondContact O-N 2.72Å; Y175-R179 HydrophobicContact CD1-CB 4.25Å; Y175-Q180 PolarHBondContact O-N 3.36Å |
| 176 | A | 80.6 | Confident | 78.8 | Confident | 29 Ų | 29 | 56.9 Ų | 56.9 | 24% | 0.24 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -66.1 | -39 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | D172 R173 Y174 | D172-A176 WeakPolarHBondContact O-CB 3.43Å; D172-A176 PolarHBondContact O-N 3.06Å; D172-A176 VanDerWaalsContact O-N 3.11Å; R173-A176 PolarHBondContact O-N 3.49Å; Y174-A176 VanDerWaalsContact C-N 3.35Å; Y174-A176 PolarHBondContact O-N 2.85Å |
| 177 | I | 78.3 | Confident | 78.5 | Confident | 6 Ų | 6 | 65.6 Ų | 65.6 | 3% | 0.031 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -96.4 | -47.3 | -171.8 | -61.4 | 169 | 0 | 0 | 0 | 112.1 | R173 Y174 I264 V268 F287 E290 A294 | R173-I177 WeakPolarHBondContact O-CG1 3.48Å; R173-I177 PolarHBondContact O-N 2.95Å; Y174-I177 PolarHBondContact O-N 3.3Å; I177-I264 HydrophobicContact CD1-CG2 3.99Å; I177-I264 HydrophobicContact CG2-CG2 4.24Å; I177-V268 HydrophobicContact CG2-CG2 4.4Å; I177-F287 HydrophobicContact CG2-CE2 4.04Å; I177-E290 HydrophobicContact CD1-CB 4.25Å; I177-E290 HydrophobicContact CG1-CB 3.94Å; I177-A294 HydrophobicContact CD1-CB 3.54Å |
| 178 | V | 80.8 | Confident | 78.2 | Confident | 37 Ų | 37 | 72.9 Ų | 72.9 | 22% | 0.224 | 36% | 0.357 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.6 | -44 | -171.2 | -179.3 | 0 | 0 | 0 | 0 | 111.7 | Y174 I264 | Y174-V178 HydrophobicContact CD2-CB 3.95Å; Y174-V178 HydrophobicContact CD2-CG1 4.43Å; Y174-V178 HydrophobicContact CD2-CG2 3.67Å; Y174-V178 HydrophobicContact CE2-CB 3.79Å; Y174-V178 HydrophobicContact CE2-CG1 3.78Å; Y174-V178 HydrophobicContact CE2-CG2 3.84Å; Y174-V178 VanDerWaalsContact O-CB 3.32Å; Y174-V178 WeakPolarHBondContact O-CB 3.4Å; Y174-V178 PolarHBondContact O-N 2.89Å; V178-I264 HydrophobicContact CG2-CB 4.39Å; V178-I264 HydrophobicContact CG2-CG1 3.86Å |
| 179 | R | 73.9 | Confident | 78 | Confident | 155 Ų | 155 | 78.3 Ų | 78.3 | 59% | 0.585 | 38% | 0.379 | S | S | * | . | S | Bend | trans | -96.7 | 0.3 | -173.7 | -74.4 | -166.7 | 175.4 | -150.7 | 2.4 | 114.8 | Y174 Y175 | Y174-R179 HydrophobicContact CE1-CG 4.27Å; Y175-R179 HydrophobicContact CD1-CB 4.25Å |
| 180 | Q | 62.2 | Low | 78 | Confident | 98 Ų | 98 | 78.4 Ų | 78.4 | 46% | 0.458 | 38% | 0.38 | S | S | . | . | trans | 29.2 | 91.3 | 180 | -66 | -161 | -1.4 | 0 | 0 | 114 | Y175 Q182 Y283 | Y175-Q180 PolarHBondContact O-N 3.36Å; Q180-Q182 PolarHBondContact O-N 3.07Å; Q180-Y283 PolarHBondContact NE2-OH 3.4Å | ||
| 181 | P | 58.6 | Low | 77.9 | Confident | 60 Ų | 60 | 82.9 Ų | 82.9 | 39% | 0.39 | 41% | 0.408 | S | S | . | . | trans | -69.6 | 130 | -160.4 | 24.8 | -31.2 | 0 | 0 | 0 | 112.5 | A183 | P181-A183 VanDerWaalsContact CB-O 3.27Å; P181-A183 WeakPolarHBondContact CB-O 3.34Å; P181-A183 PolarHBondContact O-N 3.45Å | ||
| 182 | Q | 53.9 | Low | 78.1 | Confident | 208 Ų | 208 | 86.1 Ų | 86.1 | 97% | 0.972 | 42% | 0.424 | S | S | * | . | S | Bend | trans | -66.4 | -17.3 | 154.5 | -69.3 | -93.9 | -27 | 0 | 0 | 111.2 | Q180 | Q180-Q182 PolarHBondContact O-N 3.07Š|
| 183 | A | 59.1 | Low | 78.4 | Confident | 82 Ų | 82 | 88.7 Ų | 88.7 | 68% | 0.678 | 44% | 0.437 | S | S | * | . | S | Bend | trans | -148.5 | 123.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | P181 | P181-A183 VanDerWaalsContact CB-O 3.27Å; P181-A183 WeakPolarHBondContact CB-O 3.34Å; P181-A183 PolarHBondContact O-N 3.45Å |
| 184 | K | 66.2 | Low | 78.8 | Confident | 152 Ų | 152 | 89.2 Ų | 89.2 | 66% | 0.661 | 44% | 0.441 | S | S | * | . | P | Polyproline II helix | trans | -69.2 | 149.5 | 174.8 | -70 | -179.2 | 177.7 | -178.9 | 0 | 110.8 | G186 | K184-G186 PolarHBondContact O-N 2.94Å; K184-G186 VanDerWaalsContact O-N 3.1Å |
| 185 | I | 72.2 | Confident | 79.2 | Confident | 59 Ų | 59 | 90.3 Ų | 90.3 | 30% | 0.303 | 46% | 0.455 | S | S | . | . | P | Polyproline II helix | trans | -57.6 | 117.4 | 169.5 | -60.7 | 174.1 | 0 | 0 | 0 | 108.4 | V107 K189 A190 | V107-I185 HydrophobicContact CG1-CG2 4.39Å; I185-K189 HydrophobicContact CG2-CB 4.18Å; I185-A190 HydrophobicContact CG2-CB 4.23Å |
| 186 | G | 79.4 | Confident | 79.6 | Confident | 37 Ų | 37 | 87.2 Ų | 87.2 | 38% | 0.381 | 45% | 0.453 | S | S | . | . | P | Polyproline II helix | trans | -70.7 | 157.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | K184 Q188 K189 A190 | K184-G186 PolarHBondContact O-N 2.94Å; K184-G186 VanDerWaalsContact O-N 3.1Å; G186-Q188 VanDerWaalsContact C-N 3.31Å; G186-Q188 PolarHBondContact O-N 2.99Å; G186-K189 PolarHBondContact O-N 2.82Å; G186-A190 PolarHBondContact O-N 3.23Å |
| 187 | R | 82.9 | Confident | 80.3 | Confident | 183 Ų | 183 | 86.4 Ų | 86.4 | 69% | 0.691 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -56.8 | -41.2 | -179.9 | -74.8 | -178.9 | 173.6 | 158.3 | -1.5 | 113 | V107 A190 T191 | V107-R187 HydrophobicContact CG2-CG 4.34Å; R187-A190 PolarHBondContact O-N 2.83Å; R187-T191 PolarHBondContact O-N 3.26Å; R187-T191 PolarHBondContact O-OG1 3.19Å; R187-T191 VanDerWaalsContact O-OG1 3.11Å |
| 188 | Q | 87.1 | Confident | 81.2 | Confident | 163 Ų | 163 | 89.8 Ų | 89.8 | 76% | 0.762 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -61 | -47.7 | 178.7 | -71.8 | 176.2 | -18.7 | 0 | 0 | 112.1 | G186 A190 T191 Q192 | G186-Q188 VanDerWaalsContact C-N 3.31Å; G186-Q188 PolarHBondContact O-N 2.99Å; Q188-A190 VanDerWaalsContact C-N 3.32Å; Q188-A190 PolarHBondContact O-N 3.14Å; Q188-T191 PolarHBondContact O-N 3.45Å; Q188-Q192 WeakPolarHBondContact O-CG 3.29Å; Q188-Q192 PolarHBondContact O-N 3.23Å |
| 189 | K | 88.4 | Confident | 81.8 | Confident | 141 Ų | 141 | 93.7 Ų | 93.7 | 61% | 0.613 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -62.6 | -39.6 | 177 | -68.1 | -166.1 | 177.1 | -173.5 | 0 | 111.6 | I185 G186 Q192 L193 | I185-K189 HydrophobicContact CG2-CB 4.18Å; G186-K189 PolarHBondContact O-N 2.82Å; K189-Q192 PolarHBondContact O-N 2.83Å; K189-L193 VanDerWaalsContact O-CG 3.31Å; K189-L193 WeakPolarHBondContact O-CG 3.31Å; K189-L193 PolarHBondContact O-N 3.04Å |
| 190 | A | 88.6 | Confident | 82.7 | Confident | 4 Ų | 4 | 88.8 Ų | 88.8 | 3% | 0.033 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -62.4 | -42.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | V107 F111 I185 G186 R187 Q188 L193 L194 | V107-A190 HydrophobicContact CB-CB 4.42Å; V107-A190 HydrophobicContact CG1-CB 3.51Å; V107-A190 HydrophobicContact CG2-CB 4.23Å; F111-A190 HydrophobicContact CE1-CB 4.17Å; F111-A190 HydrophobicContact CZ-CB 4.02Å; I185-A190 HydrophobicContact CG2-CB 4.23Å; G186-A190 PolarHBondContact O-N 3.23Å; R187-A190 PolarHBondContact O-N 2.83Å; Q188-A190 VanDerWaalsContact C-N 3.32Å; Q188-A190 PolarHBondContact O-N 3.14Å; A190-L193 PolarHBondContact O-N 3.41Å; A190-L194 PolarHBondContact O-N 3.16Å |
| 191 | T | 89.4 | Confident | 84.1 | Confident | 94 Ų | 94 | 84.1 Ų | 84.1 | 58% | 0.577 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -65.1 | -39.3 | 175.2 | -56.4 | 0 | 0 | 0 | 0 | 111.9 | R187 Q188 L194 A195 | R187-T191 PolarHBondContact O-N 3.26Å; R187-T191 PolarHBondContact O-OG1 3.19Å; R187-T191 VanDerWaalsContact O-OG1 3.11Å; Q188-T191 PolarHBondContact O-N 3.45Å; T191-L194 PolarHBondContact O-N 3.46Å; T191-A195 WeakPolarHBondContact O-CB 3.24Å; T191-A195 PolarHBondContact O-N 2.87Å |
| 192 | Q | 93.3 | Very high | 85.7 | Confident | 132 Ų | 132 | 83.8 Ų | 83.8 | 62% | 0.617 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -62.4 | -43.7 | 174.1 | -73.3 | 171.9 | -16.2 | 0 | 0 | 112.1 | Q188 K189 L194 A195 A196 | Q188-Q192 WeakPolarHBondContact O-CG 3.29Å; Q188-Q192 PolarHBondContact O-N 3.23Å; K189-Q192 PolarHBondContact O-N 2.83Å; Q192-L194 PolarHBondContact O-N 3.33Å; Q192-A195 PolarHBondContact O-N 3.25Å; Q192-A196 WeakPolarHBondContact O-CB 3.2Å; Q192-A196 PolarHBondContact O-N 3.21Å |
| 193 | L | 93.3 | Very high | 87.4 | Confident | 71 Ų | 71 | 78.3 Ų | 78.3 | 37% | 0.372 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.8 | -41.2 | 176.3 | -71.6 | 171.2 | 0 | 0 | 0 | 111.9 | L168 K189 A190 A196 V197 | L168-L193 HydrophobicContact CD1-CB 4.14Å; L168-L193 HydrophobicContact CD2-CB 4.38Å; L168-L193 HydrophobicContact CD2-CD2 4.46Å; K189-L193 VanDerWaalsContact O-CG 3.31Å; K189-L193 WeakPolarHBondContact O-CG 3.31Å; K189-L193 PolarHBondContact O-N 3.04Å; A190-L193 PolarHBondContact O-N 3.41Å; L193-A196 PolarHBondContact O-N 3.25Å; L193-V197 WeakPolarHBondContact O-CG2 3.04Å; L193-V197 PolarHBondContact O-N 3.1Å |
| 194 | L | 94.3 | Very high | 88.7 | Confident | 26 Ų | 26 | 77.2 Ų | 77.2 | 14% | 0.136 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -63 | -48.1 | 173.9 | -79.6 | 174.1 | 0 | 0 | 0 | 111.6 | A110 F111 S114 A190 T191 Q192 A196 V197 W198 | A110-L194 HydrophobicContact CB-CD1 4.44Å; F111-L194 HydrophobicContact CD1-CD1 4.05Å; F111-L194 HydrophobicContact CD1-CD2 3.75Å; F111-L194 HydrophobicContact CD1-CG 3.77Å; F111-L194 HydrophobicContact CE1-CD1 4.35Å; F111-L194 HydrophobicContact CE1-CD2 4.32Å; F111-L194 HydrophobicContact CE1-CG 3.93Å; S114-L194 VanDerWaalsContact CB-CD2 3.46Å; S114-L194 WeakPolarHBondContact OG-CD2 3.21Å; A190-L194 PolarHBondContact O-N 3.16Å; T191-L194 PolarHBondContact O-N 3.46Å; Q192-L194 PolarHBondContact O-N 3.33Å; L194-A196 VanDerWaalsContact C-N 3.27Å; L194-A196 PolarHBondContact O-N 3.27Å; L194-V197 WeakPolarHBondContact O-CB 3.28Å; L194-V197 PolarHBondContact O-N 3.28Å; L194-V197 VanDerWaalsContact O-N 3.12Å; L194-W198 PolarHBondContact O-N 3.47Å |
| 195 | A | 94.8 | Very high | 89.5 | Confident | 48 Ų | 48 | 70.1 Ų | 70.1 | 40% | 0.397 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -57.8 | -42.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | T191 Q192 V197 W198 L199 | T191-A195 WeakPolarHBondContact O-CB 3.24Å; T191-A195 PolarHBondContact O-N 2.87Å; Q192-A195 PolarHBondContact O-N 3.25Å; A195-V197 PolarHBondContact O-N 3.02Å; A195-W198 PolarHBondContact O-N 3.07Å; A195-L199 WeakPolarHBondContact O-CB 3.12Å; A195-L199 VanDerWaalsContact O-CG 3.27Å; A195-L199 WeakPolarHBondContact O-CG 3.24Å; A195-L199 PolarHBondContact O-N 3.49Å |
| 196 | A | 95.1 | Very high | 89.8 | Confident | 47 Ų | 47 | 71 Ų | 71 | 39% | 0.388 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q192 L193 L194 L199 T200 | Q192-A196 WeakPolarHBondContact O-CB 3.2Å; Q192-A196 PolarHBondContact O-N 3.21Å; L193-A196 PolarHBondContact O-N 3.25Å; L194-A196 VanDerWaalsContact C-N 3.27Å; L194-A196 PolarHBondContact O-N 3.27Å; A196-L199 PolarHBondContact O-N 3.07Å; A196-T200 VanDerWaalsContact O-CB 3.23Å; A196-T200 WeakPolarHBondContact O-CB 3.27Å; A196-T200 PolarHBondContact O-N 2.91Å; A196-T200 PolarHBondContact O-OG1 3.45Å |
| 197 | V | 95.4 | Very high | 89.4 | Confident | 12 Ų | 12 | 71.4 Ų | 71.4 | 7% | 0.073 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -60.4 | -47.6 | 175.6 | 163.2 | 0 | 0 | 0 | 0 | 112.1 | I161 L164 L168 L193 L194 A195 T200 A201 | I161-V197 HydrophobicContact CG2-CG1 4.32Å; L164-V197 HydrophobicContact CB-CB 4.42Å; L164-V197 HydrophobicContact CB-CG1 3.68Å; L164-V197 HydrophobicContact CB-CG2 3.97Å; L164-V197 HydrophobicContact CD1-CG1 4.33Å; L168-V197 HydrophobicContact CD1-CB 4.49Å; L168-V197 HydrophobicContact CD1-CG2 3.44Å; L168-V197 VanDerWaalsContact CD1-CG2 3.44Å; L168-V197 HydrophobicContact CG-CG2 4.01Å; L193-V197 WeakPolarHBondContact O-CG2 3.04Å; L193-V197 PolarHBondContact O-N 3.1Å; L194-V197 WeakPolarHBondContact O-CB 3.28Å; L194-V197 PolarHBondContact O-N 3.28Å; L194-V197 VanDerWaalsContact O-N 3.12Å; A195-V197 PolarHBondContact O-N 3.02Å; V197-T200 PolarHBondContact O-N 3.05Å; V197-A201 WeakPolarHBondContact O-CB 3.49Å; V197-A201 PolarHBondContact O-N 2.99Å |
| 198 | W | 95.6 | Very high | 88.4 | Confident | 77 Ų | 77 | 63.6 Ų | 63.6 | 29% | 0.292 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.4 | -44.5 | 179.3 | -79.6 | 71.6 | 0 | 0 | 0 | 111.9 | S114 L117 L121 I161 L194 A195 T200 A201 V202 | S114-W198 PolarHBondContact OG-NE1 3.31Å; L117-W198 HydrophobicContact CD2-CH2 4.17Å; L117-W198 HydrophobicContact CD2-CZ2 4.04Å; L117-W198 HydrophobicContact CG-CH2 4.41Å; L117-W198 HydrophobicContact CG-CZ2 4.42Å; L121-W198 HydrophobicContact CD1-CH2 3.94Å; I161-W198 HydrophobicContact CD1-CD2 3.73Å; I161-W198 HydrophobicContact CD1-CE3 3.52Å; I161-W198 HydrophobicContact CD1-CG 4.31Å; I161-W198 HydrophobicContact CD1-CH2 4.21Å; I161-W198 HydrophobicContact CD1-CZ2 4.39Å; I161-W198 HydrophobicContact CD1-CZ3 3.78Å; I161-W198 HydrophobicContact CG1-CD2 4.39Å; I161-W198 HydrophobicContact CG2-CD2 4.43Å; I161-W198 HydrophobicContact CG2-CZ2 4.21Å; L194-W198 PolarHBondContact O-N 3.47Å; A195-W198 PolarHBondContact O-N 3.07Å; W198-T200 PolarHBondContact O-N 3.03Å; W198-A201 PolarHBondContact O-N 2.93Å; W198-V202 WeakPolarHBondContact O-CG2 3.11Å; W198-V202 PolarHBondContact O-N 3Å; W198-V202 VanDerWaalsContact O-N 3.09Å |
| 199 | L | 94.4 | Very high | 87.3 | Confident | 119 Ų | 119 | 59.2 Ų | 59.2 | 62% | 0.623 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -62 | -44 | 176.3 | -72 | 172.1 | 0 | 0 | 0 | 111.6 | A195 A196 A201 V202 V203 | A195-L199 WeakPolarHBondContact O-CB 3.12Å; A195-L199 VanDerWaalsContact O-CG 3.27Å; A195-L199 WeakPolarHBondContact O-CG 3.24Å; A195-L199 PolarHBondContact O-N 3.49Å; A196-L199 PolarHBondContact O-N 3.07Å; L199-A201 VanDerWaalsContact C-N 3.35Å; L199-A201 PolarHBondContact O-N 2.95Å; L199-V202 PolarHBondContact O-N 3.32Å; L199-V203 VanDerWaalsContact O-CG2 3.29Å; L199-V203 WeakPolarHBondContact O-CG2 3.31Å; L199-V203 PolarHBondContact O-N 2.93Å |
| 200 | T | 91.9 | Very high | 86 | Confident | 52 Ų | 52 | 57.9 Ų | 57.9 | 32% | 0.319 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -60.3 | -46.4 | 178.5 | -59.4 | 0 | 0 | 0 | 0 | 110.3 | L164 A196 V197 W198 V202 V203 F204 | L164-T200 HydrophobicContact CD1-CG2 3.93Å; A196-T200 VanDerWaalsContact O-CB 3.23Å; A196-T200 WeakPolarHBondContact O-CB 3.27Å; A196-T200 PolarHBondContact O-N 2.91Å; A196-T200 PolarHBondContact O-OG1 3.45Å; V197-T200 PolarHBondContact O-N 3.05Å; W198-T200 PolarHBondContact O-N 3.03Å; T200-V202 VanDerWaalsContact C-N 3.34Å; T200-V202 PolarHBondContact O-N 2.69Å; T200-V203 PolarHBondContact O-N 2.87Å; T200-F204 HydrophobicContact CG2-CD2 3.58Å; T200-F204 HydrophobicContact CG2-CE2 3.69Å; T200-F204 VanDerWaalsContact O-CD2 3.3Å; T200-F204 WeakPolarHBondContact O-CD2 3.49Å; T200-F204 PolarHBondContact O-N 3.03Å |
| 201 | A | 92.4 | Very high | 84.6 | Confident | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -61.1 | -40.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | I160 I161 V197 W198 L199 S205 | I160-A201 HydrophobicContact CB-CB 3.92Å; I160-A201 HydrophobicContact CG2-CB 3.72Å; I161-A201 HydrophobicContact CB-CB 4.48Å; I161-A201 HydrophobicContact CD1-CB 4.11Å; I161-A201 HydrophobicContact CG1-CB 3.35Å; V197-A201 WeakPolarHBondContact O-CB 3.49Å; V197-A201 PolarHBondContact O-N 2.99Å; W198-A201 PolarHBondContact O-N 2.93Å; L199-A201 VanDerWaalsContact C-N 3.35Å; L199-A201 PolarHBondContact O-N 2.95Å; A201-S205 VanDerWaalsContact O-CB 3.26Å; A201-S205 WeakPolarHBondContact O-CB 3.27Å; A201-S205 PolarHBondContact O-N 3.33Å; A201-S205 PolarHBondContact O-OG 2.95Å |
| 202 | V | 91.2 | Very high | 83 | Confident | 53 Ų | 53 | 57 Ų | 57 | 32% | 0.321 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.9 | -49.6 | 174.7 | 172.2 | 0 | 0 | 0 | 0 | 110.4 | F153 W198 L199 T200 F204 S205 L206 | F153-V202 HydrophobicContact CZ-CG1 4.44Å; W198-V202 WeakPolarHBondContact O-CG2 3.11Å; W198-V202 PolarHBondContact O-N 3Å; W198-V202 VanDerWaalsContact O-N 3.09Å; L199-V202 PolarHBondContact O-N 3.32Å; T200-V202 VanDerWaalsContact C-N 3.34Å; T200-V202 PolarHBondContact O-N 2.69Å; V202-F204 VanDerWaalsContact C-N 3.3Å; V202-F204 PolarHBondContact O-N 2.83Å; V202-S205 PolarHBondContact O-N 2.98Å; V202-S205 VanDerWaalsContact O-N 3.08Å; V202-L206 HydrophobicContact CG1-CD1 3.77Å; V202-L206 HydrophobicContact CG1-CG 4.07Å; V202-L206 VanDerWaalsContact O-CG 3.23Å; V202-L206 WeakPolarHBondContact O-CG 3.32Å; V202-L206 PolarHBondContact O-N 3.3Å |
| 203 | V | 90.1 | Very high | 81 | Confident | 93 Ų | 93 | 59.9 Ų | 59.9 | 56% | 0.564 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -58.4 | -41.4 | -179.6 | 169.2 | 0 | 0 | 0 | 0 | 111.9 | L199 T200 P207 | L199-V203 VanDerWaalsContact O-CG2 3.29Å; L199-V203 WeakPolarHBondContact O-CG2 3.31Å; L199-V203 PolarHBondContact O-N 2.93Å; T200-V203 PolarHBondContact O-N 2.87Å; V203-P207 WeakPolarHBondContact O-CD 3.42Å |
| 204 | F | 85.9 | Confident | 78.7 | Confident | 58 Ų | 58 | 61.8 Ų | 61.8 | 25% | 0.254 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -77.1 | -23.5 | 178.2 | -83.1 | -76.5 | 0 | 0 | 0 | 113.2 | I160 T200 V202 Y241 L245 V248 | I160-F204 HydrophobicContact CD1-CB 4.09Å; T200-F204 HydrophobicContact CG2-CD2 3.58Å; T200-F204 HydrophobicContact CG2-CE2 3.69Å; T200-F204 VanDerWaalsContact O-CD2 3.3Å; T200-F204 WeakPolarHBondContact O-CD2 3.49Å; T200-F204 PolarHBondContact O-N 3.03Å; V202-F204 VanDerWaalsContact C-N 3.3Å; V202-F204 PolarHBondContact O-N 2.83Å; F204-Y241 PolarHBondContact O-OH 3.5Å; F204-L245 HydrophobicContact CB-CD2 3.83Å; F204-L245 HydrophobicContact CD1-CD2 4.1Å; F204-L245 HydrophobicContact CG-CD2 4.39Å; F204-L245 WeakPolarHBondContact O-CD2 3.39Å; F204-V248 HydrophobicContact CE1-CG1 4.15Å; F204-V248 HydrophobicContact CE2-CG1 4.43Å; F204-V248 HydrophobicContact CZ-CG1 3.82Å |
| 205 | S | 84 | Confident | 76.4 | Confident | 3 Ų | 3 | 63.1 Ų | 63.1 | 2% | 0.021 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -86.4 | -24.5 | 179.2 | -55.8 | 0 | 0 | 0 | 0 | 113.5 | C157 A201 V202 | C157-S205 WeakPolarHBondContact CA-OG 3.21Å; C157-S205 PolarHBondContact N-OG 3.44Å; A201-S205 VanDerWaalsContact O-CB 3.26Å; A201-S205 WeakPolarHBondContact O-CB 3.27Å; A201-S205 PolarHBondContact O-N 3.33Å; A201-S205 PolarHBondContact O-OG 2.95Å; V202-S205 PolarHBondContact O-N 2.98Å; V202-S205 VanDerWaalsContact O-N 3.08Å |
| 206 | L | 79.3 | Confident | 73.7 | Confident | 78 Ų | 78 | 67.3 Ų | 67.3 | 41% | 0.408 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -64.5 | -41.2 | -177.7 | -78.9 | 170.1 | 0 | 0 | 0 | 115.4 | F153 V202 G208 Y209 L210 | F153-L206 HydrophobicContact CE2-CD2 3.95Å; F153-L206 HydrophobicContact CE2-CG 4.09Å; V202-L206 HydrophobicContact CG1-CD1 3.77Å; V202-L206 HydrophobicContact CG1-CG 4.07Å; V202-L206 VanDerWaalsContact O-CG 3.23Å; V202-L206 WeakPolarHBondContact O-CG 3.32Å; V202-L206 PolarHBondContact O-N 3.3Å; L206-G208 PolarHBondContact O-N 2.89Å; L206-Y209 WeakPolarHBondContact O-CB 3.15Å; L206-Y209 PolarHBondContact O-N 2.83Å; L206-L210 PolarHBondContact O-N 3.03Å |
| 207 | P | 69.7 | Low | 71.4 | Confident | 45 Ų | 45 | 67.8 Ų | 67.8 | 29% | 0.292 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -64.8 | -29.9 | -174.8 | -20.9 | 31.3 | 0 | 0 | 0 | 112.6 | V203 Y209 L210 L211 Y241 | V203-P207 WeakPolarHBondContact O-CD 3.42Å; P207-Y209 VanDerWaalsContact C-N 3.3Å; P207-Y209 PolarHBondContact O-N 2.88Å; P207-L210 PolarHBondContact O-N 2.96Å; P207-L211 WeakPolarHBondContact O-CB 3.46Å; P207-L211 VanDerWaalsContact O-CG 3.25Å; P207-L211 WeakPolarHBondContact O-CG 3.5Å; P207-L211 PolarHBondContact O-N 3.32Å; P207-Y241 HydrophobicContact CB-CD2 4.04Å; P207-Y241 HydrophobicContact CB-CE2 3.51Å; P207-Y241 HydrophobicContact CG-CE2 3.81Å |
| 208 | G | 62.8 | Low | 69.2 | Low | 20 Ų | 20 | 69.8 Ų | 69.8 | 21% | 0.206 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -60 | -38 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | L206 V212 Y241 | L206-G208 PolarHBondContact O-N 2.89Å; G208-V212 WeakPolarHBondContact O-CG2 3.34Å; G208-V212 PolarHBondContact O-N 2.9Å; G208-Y241 VanDerWaalsContact N-CZ 3.32Å; G208-Y241 PolarHBondContact N-OH 3.34Å |
| 209 | Y | 63.5 | Low | 66.6 | Low | 70 Ų | 70 | 72.8 Ų | 72.8 | 28% | 0.275 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -65.5 | -41.7 | 175.5 | 177 | -89.1 | 0 | 0 | 0 | 112.2 | V149 L206 P207 R213 | V149-Y209 HydrophobicContact CB-CD2 4.16Å; V149-Y209 HydrophobicContact CB-CE2 4.26Å; V149-Y209 HydrophobicContact CG1-CD2 3.3Å; V149-Y209 HydrophobicContact CG1-CE2 3.84Å; V149-Y209 HydrophobicContact CG1-CG 4.12Å; L206-Y209 WeakPolarHBondContact O-CB 3.15Å; L206-Y209 PolarHBondContact O-N 2.83Å; P207-Y209 VanDerWaalsContact C-N 3.3Å; P207-Y209 PolarHBondContact O-N 2.88Å; Y209-R213 PolarHBondContact OH-NH2 3.3Å; Y209-R213 VanDerWaalsContact OH-NH2 3.13Å |
| 210 | L | 61.8 | Low | 64.2 | Low | 113 Ų | 113 | 72.1 Ų | 72.1 | 59% | 0.592 | 40% | 0.4 | S | S | * | . | H | α-helix | trans | -72 | -37.8 | -178.6 | -64 | 174.7 | 0 | 0 | 0 | 112.3 | L206 P207 T214 | L206-L210 PolarHBondContact O-N 3.03Å; P207-L210 PolarHBondContact O-N 2.96Å; L210-T214 PolarHBondContact O-OG1 3.02Å |
| 211 | L | 58.7 | Low | 61.7 | Low | 58 Ų | 58 | 81.6 Ų | 81.6 | 30% | 0.304 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -69.8 | -36.8 | 178.7 | -69.4 | 169.4 | 0 | 0 | 0 | 112.1 | P207 R213 T214 V237 Y241 | P207-L211 WeakPolarHBondContact O-CB 3.46Å; P207-L211 VanDerWaalsContact O-CG 3.25Å; P207-L211 WeakPolarHBondContact O-CG 3.5Å; P207-L211 PolarHBondContact O-N 3.32Å; L211-R213 PolarHBondContact O-N 3.45Å; L211-T214 PolarHBondContact O-N 2.95Å; L211-V237 HydrophobicContact CD2-CG1 4.16Å; L211-Y241 HydrophobicContact CD1-CD1 4.2Å; L211-Y241 HydrophobicContact CD1-CG 4.15Å |
| 212 | V | 56.1 | Low | 59.4 | Low | 21 Ų | 21 | 83.1 Ų | 83.1 | 13% | 0.127 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -65 | -36.5 | 178.6 | 169 | 0 | 0 | 0 | 0 | 112.5 | V149 G208 T214 V229 | V149-V212 HydrophobicContact CG1-CG1 4.36Å; V149-V212 HydrophobicContact CG2-CG1 3.8Å; G208-V212 WeakPolarHBondContact O-CG2 3.34Å; G208-V212 PolarHBondContact O-N 2.9Å; V212-T214 PolarHBondContact O-N 3.3Å; V212-T214 VanDerWaalsContact O-N 3.16Å; V212-V229 HydrophobicContact CG2-CB 4.45Å; V212-V229 HydrophobicContact CG2-CG1 4.07Å; V212-V229 HydrophobicContact CG2-CG2 3.75Å |
| 213 | R | 51.2 | Low | 57 | Low | 193 Ų | 193 | 84.6 Ų | 84.6 | 73% | 0.728 | 45% | 0.447 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | -18.6 | 177.5 | -92.8 | -163.6 | 178 | -179.9 | 0.1 | 114.5 | Y209 L211 | Y209-R213 PolarHBondContact OH-NH2 3.3Å; Y209-R213 VanDerWaalsContact OH-NH2 3.13Å; L211-R213 PolarHBondContact O-N 3.45Å |
| 214 | T | 45.1 | Very low | 55.1 | Low | 112 Ų | 112 | 81.4 Ų | 81.4 | 69% | 0.687 | 43% | 0.426 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.9 | -12.5 | -169.9 | -49.7 | 0 | 0 | 0 | 0 | 112.8 | L210 L211 V212 | L210-T214 PolarHBondContact O-OG1 3.02Å; L211-T214 PolarHBondContact O-N 2.95Å; V212-T214 PolarHBondContact O-N 3.3Å; V212-T214 VanDerWaalsContact O-N 3.16Å |
| 215 | T | 44.8 | Very low | 53.6 | Low | 54 Ų | 54 | 80.7 Ų | 80.7 | 33% | 0.331 | 42% | 0.423 | S | S | . | . | trans | -120.2 | 115.2 | -176.9 | 61.1 | 0 | 0 | 0 | 0 | 111.4 | G217 H231 | T215-G217 PolarHBondContact O-N 3.15Å; T215-H231 PolarHBondContact OG1-CE1 3.02Å; T215-H231 VanDerWaalsContact OG1-CE1 3.26Å | ||
| 216 | S | 39.8 | Very low | 52.2 | Low | 136 Ų | 136 | 81 Ų | 81 | 95% | 0.951 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -69.3 | 29.6 | -174.3 | -45.5 | 0 | 0 | 0 | 0 | 115.4 | ||
| 217 | G | 46.4 | Very low | 50.9 | Low | 56 Ų | 56 | 78.2 Ų | 78.2 | 58% | 0.577 | 41% | 0.41 | S | S | * | . | trans | -130.9 | 53.8 | -173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | T215 H219 | T215-G217 PolarHBondContact O-N 3.15Å; G217-H219 PolarHBondContact O-N 3.29Å; G217-H219 VanDerWaalsContact O-N 3.16Å | ||
| 218 | V | 48 | Very low | 50 | Low | 55 Ų | 55 | 78.4 Ų | 78.4 | 33% | 0.333 | 41% | 0.406 | S | S | . | . | trans | -70.1 | -3.8 | -178 | -175.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 219 | H | 42 | Very low | 49.2 | Very low | 139 Ų | 139 | 80.6 Ų | 80.6 | 64% | 0.644 | 42% | 0.415 | S | S | * | . | trans | -115 | 81.7 | -164.5 | -61.7 | 85.6 | 0 | 0 | 0 | 113.4 | G217 | G217-H219 PolarHBondContact O-N 3.29Å; G217-H219 VanDerWaalsContact O-N 3.16Å | ||
| 220 | K | 44.6 | Very low | 48.6 | Very low | 106 Ų | 106 | 79.2 Ų | 79.2 | 46% | 0.461 | 41% | 0.41 | S | S | . | . | trans | -98.7 | 122.4 | 156.7 | -82.5 | -171.5 | 175.1 | -176.7 | 0 | 109.7 | G222 H225 | K220-G222 PolarHBondContact O-N 2.94Å; K220-H225 PolarHBondContact O-CE1 3.11Å; K220-H225 PolarHBondContact O-ND1 3.3Å | ||
| 221 | R | 38.3 | Very low | 47.9 | Very low | 250 Ų | 250 | 76.3 Ų | 76.3 | 94% | 0.943 | 39% | 0.393 | S | S | * | . | trans | -56.6 | 123.3 | 177.7 | -68 | 177.8 | 178.1 | 176.4 | -1.9 | 112 | ||||
| 222 | G | 44.2 | Very low | 47.2 | Very low | 32 Ų | 32 | 76.3 Ų | 76.3 | 33% | 0.33 | 40% | 0.397 | S | S | . | . | S | Bend | trans | 155.4 | 141.4 | 168.3 | 0 | 0 | 0 | 0 | 0 | 114 | K220 Y224 H225 | K220-G222 PolarHBondContact O-N 2.94Å; G222-Y224 PolarHBondContact O-N 3.14Å; G222-H225 PolarHBondContact N-NE2 3.01Å; G222-H225 PolarHBondContact O-CD2 3.26Å; G222-H225 PolarHBondContact O-N 2.87Å; G222-H225 PolarHBondContact O-NE2 3.38Å |
| 223 | F | 39.9 | Very low | 46.4 | Very low | 84 Ų | 84 | 77.6 Ų | 77.6 | 37% | 0.368 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -47.2 | -9.5 | -168.2 | -67.7 | -84.4 | 0 | 0 | 0 | 119.5 | M133 | M133-F223 WeakPolarHBondContact CE-O 3.44Š|
| 224 | Y | 50.7 | Low | 46.4 | Very low | 27 Ų | 27 | 72.9 Ų | 72.9 | 11% | 0.106 | 43% | 0.426 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -120.2 | 34.9 | -178.4 | -59 | -86.2 | 0 | 0 | 0 | 113.1 | G222 C226 M227 T331 V334 W335 W338 | G222-Y224 PolarHBondContact O-N 3.14Å; Y224-C226 PolarHBondContact O-N 3.19Å; Y224-M227 PolarHBondContact O-N 3.44Å; Y224-M227 VanDerWaalsContact O-N 3.14Å; Y224-T331 HydrophobicContact CE2-CG2 3.75Å; Y224-T331 WeakPolarHBondContact CE2-OG1 3.34Å; Y224-T331 WeakPolarHBondContact OH-CG2 3.37Å; Y224-V334 HydrophobicContact CD1-CB 4.26Å; Y224-V334 HydrophobicContact CD1-CG1 3.94Å; Y224-V334 HydrophobicContact CD1-CG2 4.11Å; Y224-V334 HydrophobicContact CE1-CB 4.22Å; Y224-V334 HydrophobicContact CE1-CG1 3.9Å; Y224-V334 HydrophobicContact CG-CG2 4.41Å; Y224-W335 AromaticContact CZ-NE1 3.83Å; Y224-W335 PolarHBondContact OH-NE1 3.14Å; Y224-W338 HydrophobicContact CD1-CH2 4.3Å; Y224-W338 HydrophobicContact CE1-CH2 4.01Å; Y224-W338 HydrophobicContact CE1-CZ3 4.24Å |
| 225 | H | 55.4 | Low | 46.9 | Very low | 42 Ų | 42 | 70.1 Ų | 70.1 | 19% | 0.194 | 41% | 0.411 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -39.8 | -34.4 | -177.1 | -83.1 | -88.9 | 0 | 0 | 0 | 116.7 | G139 K220 G222 | G139-H225 PolarHBondContact O-CD2 2.97Å; G139-H225 PolarHBondContact O-NE2 3.31Å; K220-H225 PolarHBondContact O-CE1 3.11Å; K220-H225 PolarHBondContact O-ND1 3.3Å; G222-H225 PolarHBondContact N-NE2 3.01Å; G222-H225 PolarHBondContact O-CD2 3.26Å; G222-H225 PolarHBondContact O-N 2.87Å; G222-H225 PolarHBondContact O-NE2 3.38Å |
| 226 | C | 53.5 | Low | 47.9 | Very low | 11 Ų | 11 | 70.5 Ų | 70.5 | 7% | 0.074 | 43% | 0.426 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.4 | -8.1 | -170.9 | -54.1 | 0 | 0 | 0 | 0 | 114.8 | C148 G152 Y224 | C148-C226 WeakPolarHBondContact CA-SG 3.34Å; C148-C226 HydrophobicContact CB-CB 4.09Å; C148-C226 WeakPolarHBondContact CB-SG 3.38Å; C148-C226 WeakPolarHBondContact O-CB 3.48Å; C148-C226 VanDerWaalsContact SG-CA 3.58Å; C148-C226 WeakPolarHBondContact SG-CB 3.39Å; C148-C226 CovalentContact SG-SG 2.01Å; C148-C226 PolarHBondContact SG-SG 3.4Å; G152-C226 VanDerWaalsContact CA-O 3.3Å; G152-C226 WeakPolarHBondContact CA-O 3.32Å; Y224-C226 PolarHBondContact O-N 3.19Å |
| 227 | M | 51.8 | Low | 49.4 | Very low | 18 Ų | 18 | 68.7 Ų | 68.7 | 9% | 0.089 | 41% | 0.409 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.3 | -15.5 | -174.4 | -160.9 | 171.8 | 161.7 | 0 | 0 | 112.6 | N155 Y224 Y311 V334 W338 | N155-M227 WeakPolarHBondContact OD1-CE 2.98Å; Y224-M227 PolarHBondContact O-N 3.44Å; Y224-M227 VanDerWaalsContact O-N 3.14Å; M227-Y311 HydrophobicContact CE-CE2 3.98Å; M227-V334 HydrophobicContact CE-CG1 4.06Å; M227-V334 HydrophobicContact CE-CG2 4.42Å; M227-V334 HydrophobicContact SD-CB 4.49Å; M227-V334 HydrophobicContact SD-CG1 3.56Å; M227-V334 VanDerWaalsContact SD-CG1 3.56Å; M227-V334 HydrophobicContact SD-CG2 4.09Å; M227-W338 HydrophobicContact CE-CZ2 4.41Å; M227-W338 HydrophobicContact SD-CH2 4.41Å; M227-W338 HydrophobicContact SD-CZ2 3.45Å; M227-W338 WeakPolarHBondContact SD-CZ2 3.37Å |
| 228 | Y | 51 | Low | 50.5 | Low | 50 Ų | 50 | 66.3 Ų | 66.3 | 20% | 0.196 | 39% | 0.385 | C | S | . | . | trans | -128.2 | 106.7 | -175.4 | -72.7 | -79.1 | 0 | 0 | 0 | 112.9 | F230 Y311 V334 | Y228-F230 HydrophobicContact CD1-CD2 4.11Å; Y228-F230 HydrophobicContact CD1-CE2 4.14Å; Y228-Y311 HydrophobicContact CD1-CE2 4.48Å; Y228-Y311 HydrophobicContact CE1-CD2 4.14Å; Y228-Y311 AromaticContact CE1-CE2 3.42Å; Y228-Y311 HydrophobicContact CE1-CE2 3.42Å; Y228-Y311 VanDerWaalsContact CE1-CE2 3.42Å; Y228-Y311 AromaticContact CE1-CZ 3.73Å; Y228-Y311 HydrophobicContact CE2-CE2 4.2Å; Y228-Y311 AromaticContact CZ-CD2 3.86Å; Y228-Y311 AromaticContact CZ-CE2 3.26Å; Y228-Y311 WeakPolarHBondContact OH-CD2 3.41Å; Y228-Y311 WeakPolarHBondContact OH-CE2 3.41Å; Y228-V334 HydrophobicContact CD2-CG2 4.44Å; Y228-V334 HydrophobicContact CE2-CG2 3.28Å; Y228-V334 VanDerWaalsContact OH-CG2 3.25Å; Y228-V334 WeakPolarHBondContact OH-CG2 3.39Å | ||
| 229 | V | 46.6 | Very low | 51.7 | Low | 65 Ų | 65 | 65.7 Ų | 65.7 | 39% | 0.394 | 38% | 0.381 | S | S | . | . | trans | -108.7 | 67.9 | 163.9 | -172.7 | 0 | 0 | 0 | 0 | 108.3 | V212 H231 | V212-V229 HydrophobicContact CG2-CB 4.45Å; V212-V229 HydrophobicContact CG2-CG1 4.07Å; V212-V229 HydrophobicContact CG2-CG2 3.75Å; V229-H231 WeakPolarHBondContact CG1-CD2 3.23Å; V229-H231 WeakPolarHBondContact CG1-NE2 3.39Å; V229-H231 PolarHBondContact O-N 3.3Å | ||
| 230 | F | 51 | Low | 53.4 | Low | 41 Ų | 41 | 61.8 Ų | 61.8 | 18% | 0.18 | 37% | 0.373 | C | S | . | . | trans | -88.5 | 92.8 | 152.5 | -72.4 | -78.2 | 0 | 0 | 0 | 106.2 | Y228 P232 S242 I246 G315 T318 A319 | Y228-F230 HydrophobicContact CD1-CD2 4.11Å; Y228-F230 HydrophobicContact CD1-CE2 4.14Å; F230-P232 WeakPolarHBondContact O-CD 3.33Å; F230-S242 VanDerWaalsContact CE1-CB 3.47Å; F230-I246 HydrophobicContact CE1-CD1 4.31Å; F230-I246 HydrophobicContact CZ-CD1 3.97Å; F230-G315 WeakPolarHBondContact CE1-O 3.37Å; F230-G315 WeakPolarHBondContact CZ-O 3.48Å; F230-T318 HydrophobicContact CB-CG2 3.75Å; F230-T318 HydrophobicContact CG-CG2 4.11Å; F230-A319 HydrophobicContact CD1-CB 4.03Å; F230-A319 HydrophobicContact CE1-CB 3.89Å | ||
| 231 | H | 46.2 | Very low | 55.1 | Low | 52 Ų | 52 | 58.7 Ų | 58.7 | 24% | 0.241 | 36% | 0.358 | C | S | . | . | trans | -64.9 | 114.1 | 167.4 | -77 | -70.1 | 0 | 0 | 0 | 108.3 | T215 V229 G233 | T215-H231 PolarHBondContact OG1-CE1 3.02Å; T215-H231 VanDerWaalsContact OG1-CE1 3.26Å; V229-H231 WeakPolarHBondContact CG1-CD2 3.23Å; V229-H231 WeakPolarHBondContact CG1-NE2 3.39Å; V229-H231 PolarHBondContact O-N 3.3Å; H231-G233 PolarHBondContact O-N 3.39Å | ||
| 232 | P | 43.8 | Very low | 56.9 | Low | 59 Ų | 59 | 47.5 Ų | 47.5 | 38% | 0.383 | 32% | 0.318 | S | S | . | . | trans | -91.5 | 50.1 | 161.6 | 25.9 | -5.2 | 0 | 0 | 0 | 107.7 | F230 | F230-P232 WeakPolarHBondContact O-CD 3.33Š| ||
| 233 | G | 40.7 | Very low | 58.7 | Low | 47 Ų | 47 | 48.6 Ų | 48.6 | 49% | 0.485 | 32% | 0.316 | S | S | . | . | S | Bend | trans | -148.9 | 88.8 | -164.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | H231 S235 | H231-G233 PolarHBondContact O-N 3.39Å; G233-S235 PolarHBondContact O-N 3.14Å; G233-S235 VanDerWaalsContact O-N 3.1Å |
| 234 | G | 50 | Low | 60.9 | Low | 95 Ų | 95 | 47.2 Ų | 47.2 | 98% | 0.979 | 32% | 0.316 | S | S | * | . | S | Bend | trans | 82.1 | -21.4 | 146.2 | 0 | 0 | 0 | 0 | 0 | 120 | ||
| 235 | S | 56.4 | Low | 62.5 | Low | 54 Ų | 54 | 47 Ų | 47 | 38% | 0.378 | 32% | 0.317 | S | S | . | . | trans | -125.3 | 118.4 | 179.1 | 64.8 | 0 | 0 | 0 | 0 | 112.3 | G233 V237 G238 | G233-S235 PolarHBondContact O-N 3.14Å; G233-S235 VanDerWaalsContact O-N 3.1Å; S235-V237 PolarHBondContact O-N 3.13Å; S235-G238 PolarHBondContact O-N 2.01Å | ||
| 236 | G | 65.6 | Low | 63.9 | Low | 62 Ų | 62 | 45.7 Ų | 45.7 | 64% | 0.639 | 31% | 0.311 | S | S | * | . | H | α-helix | trans | -58.8 | -18.3 | 179 | 0 | 0 | 0 | 0 | 0 | 114.2 | A240 | G236-A240 VanDerWaalsContact O-CB 3.26Å; G236-A240 WeakPolarHBondContact O-CB 3.39Å; G236-A240 PolarHBondContact O-N 3.23Å |
| 237 | V | 70.4 | Confident | 65.5 | Low | 97 Ų | 97 | 48.1 Ų | 48.1 | 59% | 0.588 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -66.9 | -40.7 | -180 | -175.9 | 0 | 0 | 0 | 0 | 112.3 | L211 S235 Y241 | L211-V237 HydrophobicContact CD2-CG1 4.16Å; S235-V237 PolarHBondContact O-N 3.13Å; V237-Y241 WeakPolarHBondContact O-CB 3.23Å; V237-Y241 PolarHBondContact O-N 2.9Å |
| 238 | G | 70.7 | Confident | 67.3 | Low | 7 Ų | 7 | 49.7 Ų | 49.7 | 7% | 0.072 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -68.2 | -44.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | S235 Y241 S242 | S235-G238 PolarHBondContact O-N 2.01Å; G238-Y241 PolarHBondContact O-N 3.18Å; G238-S242 PolarHBondContact O-N 3.23Å; G238-S242 PolarHBondContact O-OG 2.85Å |
| 239 | T | 72.7 | Confident | 69 | Low | 41 Ų | 41 | 47.4 Ų | 47.4 | 25% | 0.252 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.8 | -45.1 | 176.2 | -52.8 | 0 | 0 | 0 | 0 | 111.6 | Y241 S242 I243 A319 | T239-Y241 VanDerWaalsContact C-N 3.31Å; T239-Y241 PolarHBondContact O-N 3.42Å; T239-S242 PolarHBondContact O-N 3.4Å; T239-I243 HydrophobicContact CG2-CD1 3.97Å; T239-I243 WeakPolarHBondContact O-CG1 3.39Å; T239-I243 PolarHBondContact O-N 3.04Å; T239-A319 HydrophobicContact CG2-CB 4.14Å; T239-A319 WeakPolarHBondContact CG2-O 3.38Å |
| 240 | A | 78.6 | Confident | 70.9 | Confident | 57 Ų | 57 | 45.5 Ų | 45.5 | 47% | 0.471 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61.2 | -39.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | G236 C244 | G236-A240 VanDerWaalsContact O-CB 3.26Å; G236-A240 WeakPolarHBondContact O-CB 3.39Å; G236-A240 PolarHBondContact O-N 3.23Å; A240-C244 VanDerWaalsContact O-CB 3.25Å; A240-C244 WeakPolarHBondContact O-CB 3.37Å; A240-C244 PolarHBondContact O-N 3.23Å |
| 241 | Y | 79.8 | Confident | 72.7 | Confident | 42 Ų | 42 | 47 Ų | 47 | 17% | 0.165 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -63 | -47.8 | 175.1 | 169.8 | -105.2 | 0 | 0 | 0 | 112.3 | F204 P207 G208 L211 V237 G238 T239 I243 C244 L245 | F204-Y241 PolarHBondContact O-OH 3.5Å; P207-Y241 HydrophobicContact CB-CD2 4.04Å; P207-Y241 HydrophobicContact CB-CE2 3.51Å; P207-Y241 HydrophobicContact CG-CE2 3.81Å; G208-Y241 VanDerWaalsContact N-CZ 3.32Å; G208-Y241 PolarHBondContact N-OH 3.34Å; L211-Y241 HydrophobicContact CD1-CD1 4.2Å; L211-Y241 HydrophobicContact CD1-CG 4.15Å; V237-Y241 WeakPolarHBondContact O-CB 3.23Å; V237-Y241 PolarHBondContact O-N 2.9Å; G238-Y241 PolarHBondContact O-N 3.18Å; T239-Y241 VanDerWaalsContact C-N 3.31Å; T239-Y241 PolarHBondContact O-N 3.42Å; Y241-I243 PolarHBondContact O-N 3.49Å; Y241-C244 WeakPolarHBondContact O-CB 3.01Å; Y241-C244 PolarHBondContact O-N 2.8Å; Y241-L245 HydrophobicContact CD1-CD1 4.13Å; Y241-L245 HydrophobicContact CD2-CG 4.48Å; Y241-L245 HydrophobicContact CE1-CD1 3.42Å; Y241-L245 VanDerWaalsContact CE1-CD1 3.42Å; Y241-L245 HydrophobicContact CE1-CG 4.28Å; Y241-L245 HydrophobicContact CE2-CD1 3.94Å; Y241-L245 HydrophobicContact CE2-CG 3.98Å; Y241-L245 PolarHBondContact O-N 2.85Å; Y241-L245 WeakPolarHBondContact OH-CD1 3.4Å |
| 242 | S | 76.4 | Confident | 74.8 | Confident | 14 Ų | 14 | 48.8 Ų | 48.8 | 10% | 0.098 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.9 | -39.9 | 179.2 | -59.6 | 0 | 0 | 0 | 0 | 112.3 | F230 G238 T239 L245 I246 | F230-S242 VanDerWaalsContact CE1-CB 3.47Å; G238-S242 PolarHBondContact O-N 3.23Å; G238-S242 PolarHBondContact O-OG 2.85Å; T239-S242 PolarHBondContact O-N 3.4Å; S242-L245 PolarHBondContact O-N 3.37Å; S242-I246 WeakPolarHBondContact O-CG1 3.18Å; S242-I246 PolarHBondContact O-N 3.14Å |
| 243 | I | 81.7 | Confident | 77.1 | Confident | 55 Ų | 55 | 46 Ų | 46 | 28% | 0.282 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -63 | -46.1 | 173.4 | -66.9 | 170 | 0 | 0 | 0 | 110.4 | T239 Y241 L245 I246 V247 A319 | T239-I243 HydrophobicContact CG2-CD1 3.97Å; T239-I243 WeakPolarHBondContact O-CG1 3.39Å; T239-I243 PolarHBondContact O-N 3.04Å; Y241-I243 PolarHBondContact O-N 3.49Å; I243-L245 VanDerWaalsContact C-N 3.32Å; I243-L245 PolarHBondContact O-N 3.09Å; I243-I246 PolarHBondContact O-N 3.37Å; I243-V247 HydrophobicContact CG2-CG2 4.17Å; I243-V247 WeakPolarHBondContact O-CB 3.21Å; I243-V247 VanDerWaalsContact O-CG2 3.29Å; I243-V247 WeakPolarHBondContact O-CG2 3.3Å; I243-V247 PolarHBondContact O-N 3.22Å; I243-A319 HydrophobicContact CD1-CB 4.16Å; I243-A319 HydrophobicContact CG1-CB 3.76Å |
| 244 | C | 84.9 | Confident | 79.4 | Confident | 56 Ų | 56 | 47 Ų | 47 | 38% | 0.378 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -57.8 | -44.8 | 177.6 | -176.1 | 0 | 0 | 0 | 0 | 111.5 | A240 Y241 V247 V248 | A240-C244 VanDerWaalsContact O-CB 3.25Å; A240-C244 WeakPolarHBondContact O-CB 3.37Å; A240-C244 PolarHBondContact O-N 3.23Å; Y241-C244 WeakPolarHBondContact O-CB 3.01Å; Y241-C244 PolarHBondContact O-N 2.8Å; C244-V247 PolarHBondContact O-N 3.38Å; C244-V248 VanDerWaalsContact O-CB 3.25Å; C244-V248 WeakPolarHBondContact O-CB 2.95Å; C244-V248 WeakPolarHBondContact O-CG2 3.04Å; C244-V248 PolarHBondContact O-N 3.06Å |
| 245 | L | 84.3 | Confident | 81.4 | Confident | 22 Ų | 22 | 45.9 Ų | 45.9 | 12% | 0.115 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58.8 | -50.2 | 175.3 | -86.8 | 179.7 | 0 | 0 | 0 | 112.7 | I160 F204 Y241 S242 I243 V247 C249 | I160-L245 HydrophobicContact CD1-CD2 4.12Å; F204-L245 HydrophobicContact CB-CD2 3.83Å; F204-L245 HydrophobicContact CD1-CD2 4.1Å; F204-L245 HydrophobicContact CG-CD2 4.39Å; F204-L245 WeakPolarHBondContact O-CD2 3.39Å; Y241-L245 HydrophobicContact CD1-CD1 4.13Å; Y241-L245 HydrophobicContact CD2-CG 4.48Å; Y241-L245 HydrophobicContact CE1-CD1 3.42Å; Y241-L245 VanDerWaalsContact CE1-CD1 3.42Å; Y241-L245 HydrophobicContact CE1-CG 4.28Å; Y241-L245 HydrophobicContact CE2-CD1 3.94Å; Y241-L245 HydrophobicContact CE2-CG 3.98Å; Y241-L245 PolarHBondContact O-N 2.85Å; Y241-L245 WeakPolarHBondContact OH-CD1 3.4Å; S242-L245 PolarHBondContact O-N 3.37Å; I243-L245 VanDerWaalsContact C-N 3.32Å; I243-L245 PolarHBondContact O-N 3.09Å; L245-V247 VanDerWaalsContact C-N 3.33Å; L245-V247 PolarHBondContact O-N 3.33Å; L245-C249 WeakPolarHBondContact O-CA 3.26Å; L245-C249 WeakPolarHBondContact O-CB 3.27Å; L245-C249 PolarHBondContact O-N 3.49Å |
| 246 | I | 84.9 | Confident | 83.1 | Confident | 14 Ų | 14 | 46.2 Ų | 46.2 | 7% | 0.072 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.7 | -45.9 | 179.6 | -64.9 | 168.6 | 0 | 0 | 0 | 110.4 | F230 S242 I243 F250 L251 C312 L316 | F230-I246 HydrophobicContact CE1-CD1 4.31Å; F230-I246 HydrophobicContact CZ-CD1 3.97Å; S242-I246 WeakPolarHBondContact O-CG1 3.18Å; S242-I246 PolarHBondContact O-N 3.14Å; I243-I246 PolarHBondContact O-N 3.37Å; I246-F250 WeakPolarHBondContact O-CA 3.2Å; I246-F250 WeakPolarHBondContact O-CB 3.34Å; I246-F250 PolarHBondContact O-N 3.18Å; I246-F250 VanDerWaalsContact O-N 3.16Å; I246-L251 HydrophobicContact CG2-CD1 4.2Å; I246-L251 HydrophobicContact CG2-CG 4.16Å; I246-L251 PolarHBondContact O-N 3.11Å; I246-C312 HydrophobicContact CG2-CB 4.25Å; I246-L316 HydrophobicContact CD1-CB 4.46Å |
| 247 | V | 87.9 | Confident | 84.3 | Confident | 62 Ų | 62 | 43.3 Ų | 43.3 | 38% | 0.376 | 25% | 0.251 | S | S | . | . | I | π-helix | trans | -68.4 | -51.8 | -176.7 | 173.6 | 0 | 0 | 0 | 0 | 111.2 | I243 C244 L245 L251 L252 | I243-V247 HydrophobicContact CG2-CG2 4.17Å; I243-V247 WeakPolarHBondContact O-CB 3.21Å; I243-V247 VanDerWaalsContact O-CG2 3.29Å; I243-V247 WeakPolarHBondContact O-CG2 3.3Å; I243-V247 PolarHBondContact O-N 3.22Å; C244-V247 PolarHBondContact O-N 3.38Å; L245-V247 VanDerWaalsContact C-N 3.33Å; L245-V247 PolarHBondContact O-N 3.33Å; V247-L251 HydrophobicContact CG2-CD1 4.26Å; V247-L251 PolarHBondContact O-N 3.27Å; V247-L252 WeakPolarHBondContact O-CB 3.38Å; V247-L252 PolarHBondContact O-N 3.26Å |
| 248 | V | 89.2 | Confident | 85.2 | Confident | 52 Ų | 52 | 41 Ų | 41 | 32% | 0.315 | 24% | 0.239 | S | C | . | . | I | π-helix | trans | -79.4 | -37.5 | -171.6 | 177.9 | 0 | 0 | 0 | 0 | 112.2 | F204 C244 P253 | F204-V248 HydrophobicContact CE1-CG1 4.15Å; F204-V248 HydrophobicContact CE2-CG1 4.43Å; F204-V248 HydrophobicContact CZ-CG1 3.82Å; C244-V248 VanDerWaalsContact O-CB 3.25Å; C244-V248 WeakPolarHBondContact O-CB 2.95Å; C244-V248 WeakPolarHBondContact O-CG2 3.04Å; C244-V248 PolarHBondContact O-N 3.06Å; V248-P253 WeakPolarHBondContact O-CD 3.3Å |
| 249 | C | 87.8 | Confident | 86.2 | Confident | 2 Ų | 2 | 46.3 Ų | 46.3 | 1% | 0.014 | 26% | 0.26 | C | S | . | . | I | π-helix | trans | -98.3 | -13 | -173.5 | -58.3 | 0 | 0 | 0 | 0 | 114.1 | I160 T163 L245 P253 | I160-C249 HydrophobicContact CD1-CB 4.21Å; I160-C249 HydrophobicContact CG1-CB 3.95Å; I160-C249 HydrophobicContact CG2-CB 4.21Å; T163-C249 WeakPolarHBondContact CG2-O 3.36Å; L245-C249 WeakPolarHBondContact O-CA 3.26Å; L245-C249 WeakPolarHBondContact O-CB 3.27Å; L245-C249 PolarHBondContact O-N 3.49Å; C249-P253 WeakPolarHBondContact O-CG 3.21Å |
| 250 | F | 85.3 | Confident | 87.1 | Confident | 25 Ų | 25 | 44.3 Ų | 44.3 | 11% | 0.11 | 25% | 0.248 | C | C | . | . | I | π-helix | trans | -125.4 | -58.9 | 178.5 | -65 | -84.7 | 0 | 0 | 0 | 113.3 | T163 I246 P253 F254 W308 | T163-F250 HydrophobicContact CG2-CD1 4.34Å; I246-F250 WeakPolarHBondContact O-CA 3.2Å; I246-F250 WeakPolarHBondContact O-CB 3.34Å; I246-F250 PolarHBondContact O-N 3.18Å; I246-F250 VanDerWaalsContact O-N 3.16Å; F250-P253 WeakPolarHBondContact O-CD 3.35Å; F250-F254 WeakPolarHBondContact O-CB 3.14Å; F250-F254 PolarHBondContact O-N 3.29Å; F250-W308 HydrophobicContact CD1-CD2 4.42Å; F250-W308 AromaticContact CD1-CE3 3.97Å; F250-W308 HydrophobicContact CD1-CE3 3.97Å; F250-W308 HydrophobicContact CD1-CZ3 4.41Å; F250-W308 AromaticContact CE1-CD2 3.89Å; F250-W308 HydrophobicContact CE1-CD2 3.89Å; F250-W308 AromaticContact CE1-CE3 3.29Å; F250-W308 HydrophobicContact CE1-CE3 3.29Å; F250-W308 AromaticContact CE1-CH2 3.97Å; F250-W308 HydrophobicContact CE1-CH2 3.97Å; F250-W308 HydrophobicContact CE1-CZ2 4.48Å; F250-W308 AromaticContact CE1-CZ3 3.34Å; F250-W308 HydrophobicContact CE1-CZ3 3.34Å; F250-W308 AromaticContact CZ-CE3 3.92Å; F250-W308 HydrophobicContact CZ-CE3 3.92Å; F250-W308 HydrophobicContact CZ-CH2 4.14Å; F250-W308 AromaticContact CZ-CZ3 3.52Å; F250-W308 HydrophobicContact CZ-CZ3 3.52Å |
| 251 | L | 89.1 | Confident | 87.4 | Confident | 71 Ų | 71 | 41.9 Ų | 41.9 | 37% | 0.372 | 23% | 0.227 | S | C | . | . | I | π-helix | trans | -67.2 | -45.6 | -174.5 | -63.1 | 179.8 | 0 | 0 | 0 | 112.8 | I246 V247 F254 S255 | I246-L251 HydrophobicContact CG2-CD1 4.2Å; I246-L251 HydrophobicContact CG2-CG 4.16Å; I246-L251 PolarHBondContact O-N 3.11Å; V247-L251 HydrophobicContact CG2-CD1 4.26Å; V247-L251 PolarHBondContact O-N 3.27Å; L251-F254 WeakPolarHBondContact O-CB 3.48Å; L251-F254 PolarHBondContact O-N 3.28Å; L251-S255 PolarHBondContact O-N 2.92Å; L251-S255 PolarHBondContact O-OG 3.09Å; L251-S255 VanDerWaalsContact O-OG 3.06Å |
| 252 | L | 91.5 | Very high | 87.8 | Confident | 90 Ų | 90 | 47 Ų | 47 | 47% | 0.471 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -63 | -50.3 | 177.6 | 175.2 | 158.3 | 0 | 0 | 0 | 111.7 | V247 F254 S255 L256 | V247-L252 WeakPolarHBondContact O-CB 3.38Å; V247-L252 PolarHBondContact O-N 3.26Å; L252-F254 VanDerWaalsContact C-N 3.27Å; L252-F254 PolarHBondContact O-N 3.47Å; L252-S255 PolarHBondContact O-N 3.36Å; L252-L256 HydrophobicContact CD2-CD1 3.61Å; L252-L256 HydrophobicContact CD2-CG 4.26Å; L252-L256 WeakPolarHBondContact O-CG 3.44Å; L252-L256 PolarHBondContact O-N 2.91Å |
| 253 | P | 91.6 | Very high | 88.4 | Confident | 2 Ų | 2 | 47.7 Ų | 47.7 | 1% | 0.013 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -53.9 | -44.5 | 172.9 | -32.9 | 40.2 | 0 | 0 | 0 | 112.2 | T163 L164 T167 V248 C249 F250 L256 M257 | T163-P253 HydrophobicContact CG2-CB 3.85Å; T163-P253 HydrophobicContact CG2-CG 4.46Å; L164-P253 HydrophobicContact CD2-CG 3.84Å; T167-P253 WeakPolarHBondContact OG1-CB 3.5Å; V248-P253 WeakPolarHBondContact O-CD 3.3Å; C249-P253 WeakPolarHBondContact O-CG 3.21Å; F250-P253 WeakPolarHBondContact O-CD 3.35Å; P253-L256 PolarHBondContact O-N 2.82Å; P253-M257 VanDerWaalsContact O-CG 3.27Å; P253-M257 WeakPolarHBondContact O-CG 3.3Å; P253-M257 PolarHBondContact O-N 2.98Å |
| 254 | F | 89 | Confident | 88.6 | Confident | 66 Ų | 66 | 45.4 Ų | 45.4 | 29% | 0.289 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -59.9 | -48.2 | 176.5 | 175.6 | -110.4 | 0 | 0 | 0 | 112.9 | F250 L251 L252 L256 M257 C258 I301 I305 | F250-F254 WeakPolarHBondContact O-CB 3.14Å; F250-F254 PolarHBondContact O-N 3.29Å; L251-F254 WeakPolarHBondContact O-CB 3.48Å; L251-F254 PolarHBondContact O-N 3.28Å; L252-F254 VanDerWaalsContact C-N 3.27Å; L252-F254 PolarHBondContact O-N 3.47Å; F254-L256 VanDerWaalsContact C-N 3.3Å; F254-L256 PolarHBondContact O-N 3.23Å; F254-M257 WeakPolarHBondContact O-CB 3.22Å; F254-M257 PolarHBondContact O-N 3.49Å; F254-C258 WeakPolarHBondContact CE2-SG 3.3Å; F254-C258 WeakPolarHBondContact CZ-SG 3.08Å; F254-C258 PolarHBondContact O-N 2.96Å; F254-I301 HydrophobicContact CE2-CG2 4.14Å; F254-I305 HydrophobicContact CD2-CG1 3.9Å; F254-I305 HydrophobicContact CE2-CD1 3.31Å; F254-I305 HydrophobicContact CE2-CG1 3.07Å; F254-I305 HydrophobicContact CZ-CD1 3.43Å; F254-I305 VanDerWaalsContact CZ-CD1 3.43Å; F254-I305 HydrophobicContact CZ-CG1 3.48Å; F254-I305 VanDerWaalsContact CZ-CG1 3.48Å |
| 255 | S | 91.1 | Very high | 88.6 | Confident | 72 Ų | 72 | 45.7 Ų | 45.7 | 50% | 0.503 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -59.4 | -40.8 | 176.1 | -61.8 | 0 | 0 | 0 | 0 | 112 | L251 L252 C258 F259 | L251-S255 PolarHBondContact O-N 2.92Å; L251-S255 PolarHBondContact O-OG 3.09Å; L251-S255 VanDerWaalsContact O-OG 3.06Å; L252-S255 PolarHBondContact O-N 3.36Å; S255-C258 PolarHBondContact O-N 3.46Å; S255-F259 WeakPolarHBondContact O-CB 3.18Å; S255-F259 PolarHBondContact O-N 3.4Å |
| 256 | L | 92.6 | Very high | 88.6 | Confident | 61 Ų | 61 | 49.7 Ų | 49.7 | 32% | 0.319 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -65 | -41.5 | 176.4 | -68.3 | 178.1 | 0 | 0 | 0 | 112.2 | T167 F171 L252 P253 F254 F259 C260 | T167-L256 HydrophobicContact CG2-CB 4.1Å; T167-L256 HydrophobicContact CG2-CD1 4.37Å; F171-L256 HydrophobicContact CE2-CB 4.25Å; F171-L256 HydrophobicContact CE2-CD1 4.08Å; F171-L256 HydrophobicContact CZ-CB 4.16Å; F171-L256 HydrophobicContact CZ-CD1 4.1Å; F171-L256 HydrophobicContact CZ-CD2 4.21Å; F171-L256 HydrophobicContact CZ-CG 4.39Å; L252-L256 HydrophobicContact CD2-CD1 3.61Å; L252-L256 HydrophobicContact CD2-CG 4.26Å; L252-L256 WeakPolarHBondContact O-CG 3.44Å; L252-L256 PolarHBondContact O-N 2.91Å; P253-L256 PolarHBondContact O-N 2.82Å; F254-L256 VanDerWaalsContact C-N 3.3Å; F254-L256 PolarHBondContact O-N 3.23Å; L256-F259 PolarHBondContact O-N 3.23Å; L256-C260 WeakPolarHBondContact O-CB 3.37Å; L256-C260 PolarHBondContact O-N 2.7Å; L256-C260 PolarHBondContact O-SG 3.06Å |
| 257 | M | 90.9 | Very high | 88.5 | Confident | 1 Ų | 1 | 51 Ų | 51 | 1% | 0.005 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -60.8 | -46.6 | 175.7 | -70.5 | -178.5 | 82.4 | 0 | 0 | 111.6 | M166 T167 S170 P253 F254 C260 H261 I301 | M166-M257 HydrophobicContact CB-CE 3.62Å; M166-M257 HydrophobicContact CB-SD 4.04Å; T167-M257 HydrophobicContact CG2-CG 4.3Å; S170-M257 VanDerWaalsContact OG-CE 3.3Å; S170-M257 WeakPolarHBondContact OG-CE 3.49Å; P253-M257 VanDerWaalsContact O-CG 3.27Å; P253-M257 WeakPolarHBondContact O-CG 3.3Å; P253-M257 PolarHBondContact O-N 2.98Å; F254-M257 WeakPolarHBondContact O-CB 3.22Å; F254-M257 PolarHBondContact O-N 3.49Å; M257-C260 PolarHBondContact O-N 2.84Å; M257-H261 PolarHBondContact O-N 3.26Å; M257-H261 PolarHBondContact O-ND1 2.97Å; M257-I301 HydrophobicContact CB-CD1 3.98Å; M257-I301 HydrophobicContact CB-CG1 4.22Å; M257-I301 HydrophobicContact CE-CD1 3.84Å; M257-I301 HydrophobicContact CE-CG1 3.25Å; M257-I301 HydrophobicContact SD-CG1 4.31Å |
| 258 | C | 89.9 | Confident | 88 | Confident | 49 Ų | 49 | 48.8 Ų | 48.8 | 33% | 0.331 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -61.1 | -46.5 | 175.9 | -76.2 | 0 | 0 | 0 | 0 | 111.9 | F254 S255 C260 H261 Y262 | F254-C258 WeakPolarHBondContact CE2-SG 3.3Å; F254-C258 WeakPolarHBondContact CZ-SG 3.08Å; F254-C258 PolarHBondContact O-N 2.96Å; S255-C258 PolarHBondContact O-N 3.46Å; C258-C260 PolarHBondContact O-N 3.02Å; C258-H261 PolarHBondContact O-N 2.7Å; C258-Y262 VanDerWaalsContact O-CB 3.28Å; C258-Y262 WeakPolarHBondContact O-CB 3.42Å; C258-Y262 PolarHBondContact O-N 2.95Å |
| 259 | F | 91.7 | Very high | 87.5 | Confident | 118 Ų | 118 | 54.1 Ų | 54.1 | 52% | 0.518 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -58.8 | -45.3 | 176.3 | 173.8 | -98.1 | 0 | 0 | 0 | 112.2 | S255 L256 N263 | S255-F259 WeakPolarHBondContact O-CB 3.18Å; S255-F259 PolarHBondContact O-N 3.4Å; L256-F259 PolarHBondContact O-N 3.23Å; F259-N263 VanDerWaalsContact CE2-ND2 3.3Å; F259-N263 WeakPolarHBondContact CE2-ND2 3.31Å; F259-N263 VanDerWaalsContact CZ-ND2 3.27Å; F259-N263 WeakPolarHBondContact CZ-ND2 3.25Å; F259-N263 PolarHBondContact O-N 3.1Å; F259-N263 PolarHBondContact O-ND2 3.3Å |
| 260 | C | 90.3 | Very high | 86.9 | Confident | 0 Ų | 0 | 57.8 Ų | 57.8 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -59.7 | -49.3 | 177.5 | -71.6 | 0 | 0 | 0 | 0 | 111.3 | F171 Y174 L256 M257 C258 N263 I264 | F171-C260 VanDerWaalsContact CD1-SG 3.59Å; F171-C260 VanDerWaalsContact CE1-SG 3.59Å; Y174-C260 HydrophobicContact CG-CB 4.43Å; L256-C260 WeakPolarHBondContact O-CB 3.37Å; L256-C260 PolarHBondContact O-N 2.7Å; L256-C260 PolarHBondContact O-SG 3.06Å; M257-C260 PolarHBondContact O-N 2.84Å; C258-C260 PolarHBondContact O-N 3.02Å; C260-N263 PolarHBondContact O-N 2.93Å; C260-I264 VanDerWaalsContact O-CG1 3.28Å; C260-I264 WeakPolarHBondContact O-CG1 3.49Å; C260-I264 PolarHBondContact O-N 3.32Å |
| 261 | H | 86.3 | Confident | 86.2 | Confident | 6 Ų | 6 | 59 Ų | 59 | 3% | 0.028 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -72.3 | -35.2 | -176.2 | -76.2 | 75.7 | 0 | 0 | 0 | 113.4 | S170 M257 C258 N263 I264 C265 V297 L298 I301 | S170-H261 PolarHBondContact OG-CE1 3.31Å; M257-H261 PolarHBondContact O-N 3.26Å; M257-H261 PolarHBondContact O-ND1 2.97Å; C258-H261 PolarHBondContact O-N 2.7Å; H261-N263 VanDerWaalsContact C-N 3.3Å; H261-N263 PolarHBondContact O-N 3.39Å; H261-I264 PolarHBondContact O-N 2.87Å; H261-C265 WeakPolarHBondContact O-CB 3.49Å; H261-C265 PolarHBondContact O-N 3.42Å; H261-C265 PolarHBondContact O-SG 3.36Å; H261-C265 VanDerWaalsContact O-SG 3.33Å; H261-V297 WeakPolarHBondContact CE1-CG1 3.35Å; H261-V297 WeakPolarHBondContact NE2-CB 3.48Å; H261-V297 WeakPolarHBondContact NE2-CG1 3.47Å; H261-L298 HydrophobicContact CB-CD1 4.18Å; H261-I301 HydrophobicContact CB-CD1 4.44Å; H261-I301 WeakPolarHBondContact CE1-CD1 3.25Å; H261-I301 WeakPolarHBondContact ND1-CD1 3.3Å |
| 262 | Y | 88.6 | Confident | 85 | Confident | 148 Ų | 148 | 61.6 Ų | 61.6 | 58% | 0.58 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -55.6 | -48.5 | 170.9 | 172.5 | -98.5 | 0 | 0 | 0 | 110.9 | C258 I264 C265 K266 | C258-Y262 VanDerWaalsContact O-CB 3.28Å; C258-Y262 WeakPolarHBondContact O-CB 3.42Å; C258-Y262 PolarHBondContact O-N 2.95Å; Y262-I264 PolarHBondContact O-N 3.5Å; Y262-C265 PolarHBondContact O-N 3.42Å; Y262-K266 HydrophobicContact CE1-CD 4.33Å; Y262-K266 WeakPolarHBondContact O-CB 3.5Å; Y262-K266 PolarHBondContact O-N 2.87Å |
| 263 | N | 87.6 | Confident | 83.4 | Confident | 29 Ų | 29 | 63.7 Ų | 63.7 | 16% | 0.155 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -68.5 | -34 | 178.6 | -73.8 | -63.7 | 0 | 0 | 0 | 113.2 | Y174 F259 C260 H261 T267 | Y174-N263 HydrophobicContact CD2-CB 4.04Å; Y174-N263 HydrophobicContact CE2-CB 3.58Å; F259-N263 VanDerWaalsContact CE2-ND2 3.3Å; F259-N263 WeakPolarHBondContact CE2-ND2 3.31Å; F259-N263 VanDerWaalsContact CZ-ND2 3.27Å; F259-N263 WeakPolarHBondContact CZ-ND2 3.25Å; F259-N263 PolarHBondContact O-N 3.1Å; F259-N263 PolarHBondContact O-ND2 3.3Å; C260-N263 PolarHBondContact O-N 2.93Å; H261-N263 VanDerWaalsContact C-N 3.3Å; H261-N263 PolarHBondContact O-N 3.39Å; N263-T267 WeakPolarHBondContact O-CB 3.44Å; N263-T267 PolarHBondContact O-N 3.37Å; N263-T267 PolarHBondContact O-OG1 3.22Å |
| 264 | I | 86.6 | Confident | 81.8 | Confident | 7 Ų | 7 | 71.7 Ų | 71.7 | 4% | 0.036 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -60.7 | -53 | 171.8 | -68.9 | 164.9 | 0 | 0 | 0 | 109.6 | R173 Y174 I177 V178 C260 H261 Y262 K266 T267 V268 A294 | R173-I264 HydrophobicContact CB-CD1 4.1Å; Y174-I264 HydrophobicContact CD2-CG1 4.42Å; I177-I264 HydrophobicContact CD1-CG2 3.99Å; I177-I264 HydrophobicContact CG2-CG2 4.24Å; V178-I264 HydrophobicContact CG2-CB 4.39Å; V178-I264 HydrophobicContact CG2-CG1 3.86Å; C260-I264 VanDerWaalsContact O-CG1 3.28Å; C260-I264 WeakPolarHBondContact O-CG1 3.49Å; C260-I264 PolarHBondContact O-N 3.32Å; H261-I264 PolarHBondContact O-N 2.87Å; Y262-I264 PolarHBondContact O-N 3.5Å; I264-K266 PolarHBondContact O-N 3.49Å; I264-T267 PolarHBondContact O-N 2.99Å; I264-V268 HydrophobicContact CG2-CG2 4.4Å; I264-V268 VanDerWaalsContact O-CG2 3.27Å; I264-V268 WeakPolarHBondContact O-CG2 3.29Å; I264-V268 PolarHBondContact O-N 3.16Å; I264-A294 HydrophobicContact CG2-CB 4.04Å |
| 265 | C | 84.4 | Confident | 79.8 | Confident | 62 Ų | 62 | 74.6 Ų | 74.6 | 42% | 0.419 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -59.3 | -44.7 | 179.2 | -70.8 | 0 | 0 | 0 | 0 | 111.8 | H261 Y262 T267 V268 R269 | H261-C265 WeakPolarHBondContact O-CB 3.49Å; H261-C265 PolarHBondContact O-N 3.42Å; H261-C265 PolarHBondContact O-SG 3.36Å; H261-C265 VanDerWaalsContact O-SG 3.33Å; Y262-C265 PolarHBondContact O-N 3.42Å; C265-T267 PolarHBondContact O-N 2.85Å; C265-V268 PolarHBondContact O-N 3.13Å; C265-R269 VanDerWaalsContact O-CG 3.31Å; C265-R269 WeakPolarHBondContact O-CG 3.28Å; C265-R269 PolarHBondContact O-N 2.93Å |
| 266 | K | 84.8 | Confident | 77.9 | Confident | 106 Ų | 106 | 80.3 Ų | 80.3 | 46% | 0.461 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -57.8 | -47.5 | 175.6 | -178.3 | 179.7 | 178.9 | 178.9 | 0 | 111.6 | Y262 I264 V268 R269 L270 | Y262-K266 HydrophobicContact CE1-CD 4.33Å; Y262-K266 WeakPolarHBondContact O-CB 3.5Å; Y262-K266 PolarHBondContact O-N 2.87Å; I264-K266 PolarHBondContact O-N 3.49Å; K266-V268 PolarHBondContact O-N 3.19Å; K266-R269 PolarHBondContact O-N 3.46Å; K266-L270 HydrophobicContact CG-CD1 3.96Å; K266-L270 WeakPolarHBondContact O-CB 3.39Å; K266-L270 VanDerWaalsContact O-CG 3.29Å; K266-L270 WeakPolarHBondContact O-CG 3.38Å; K266-L270 PolarHBondContact O-N 2.97Å |
| 267 | T | 83 | Confident | 75.8 | Confident | 41 Ų | 41 | 83.3 Ų | 83.3 | 25% | 0.252 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.5 | -42.2 | -179.3 | -56.6 | 0 | 0 | 0 | 0 | 111.5 | N263 I264 C265 L270 S271 | N263-T267 WeakPolarHBondContact O-CB 3.44Å; N263-T267 PolarHBondContact O-N 3.37Å; N263-T267 PolarHBondContact O-OG1 3.22Å; I264-T267 PolarHBondContact O-N 2.99Å; C265-T267 PolarHBondContact O-N 2.85Å; T267-L270 PolarHBondContact O-N 3.08Å; T267-S271 WeakPolarHBondContact O-CB 3.03Å; T267-S271 PolarHBondContact O-N 3.47Å; T267-S271 PolarHBondContact O-OG 3.34Å |
| 268 | V | 77.7 | Confident | 74 | Confident | 16 Ų | 16 | 89.6 Ų | 89.6 | 10% | 0.097 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -60.9 | -48.9 | 176.6 | 171.2 | 0 | 0 | 0 | 0 | 110.8 | I177 I264 C265 K266 L270 S271 E272 F287 M291 | I177-V268 HydrophobicContact CG2-CG2 4.4Å; I264-V268 HydrophobicContact CG2-CG2 4.4Å; I264-V268 VanDerWaalsContact O-CG2 3.27Å; I264-V268 WeakPolarHBondContact O-CG2 3.29Å; I264-V268 PolarHBondContact O-N 3.16Å; C265-V268 PolarHBondContact O-N 3.13Å; K266-V268 PolarHBondContact O-N 3.19Å; V268-L270 VanDerWaalsContact C-N 3.34Å; V268-L270 PolarHBondContact O-N 3.14Å; V268-S271 WeakPolarHBondContact CA-OG 3.45Å; V268-S271 PolarHBondContact O-N 2.94Å; V268-S271 VanDerWaalsContact O-N 3.11Å; V268-S271 PolarHBondContact O-OG 3.05Å; V268-E272 PolarHBondContact O-N 3.15Å; V268-F287 HydrophobicContact CG2-CZ 3.94Å; V268-M291 HydrophobicContact CG1-CE 3.55Å; V268-M291 HydrophobicContact CG1-SD 3.88Å; V268-M291 HydrophobicContact CG2-SD 4.5Å |
| 269 | R | 77.4 | Confident | 72.4 | Confident | 165 Ų | 165 | 90.3 Ų | 90.3 | 62% | 0.623 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -60.2 | -41.9 | 177.5 | -69.1 | -63.7 | -171 | -174.9 | 5.9 | 112.4 | C265 K266 S271 E272 I273 | C265-R269 VanDerWaalsContact O-CG 3.31Å; C265-R269 WeakPolarHBondContact O-CG 3.28Å; C265-R269 PolarHBondContact O-N 2.93Å; K266-R269 PolarHBondContact O-N 3.46Å; R269-S271 VanDerWaalsContact C-N 3.3Å; R269-S271 PolarHBondContact O-N 3.48Å; R269-E272 IonicContact NH1-OE2 3.73Å; R269-E272 PolarHBondContact NH1-OE2 3.33Å; R269-E272 PolarHBondContact O-N 3.46Å; R269-I273 WeakPolarHBondContact O-CD1 3.46Å; R269-I273 WeakPolarHBondContact O-CG1 3.31Å; R269-I273 PolarHBondContact O-N 3.2Å |
| 270 | L | 76.6 | Confident | 71.1 | Confident | 79 Ų | 79 | 90 Ų | 90 | 41% | 0.414 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -69.5 | -26.6 | 176.8 | -70.5 | 171.9 | 0 | 0 | 0 | 113.3 | K266 T267 V268 R274 | K266-L270 HydrophobicContact CG-CD1 3.96Å; K266-L270 WeakPolarHBondContact O-CB 3.39Å; K266-L270 VanDerWaalsContact O-CG 3.29Å; K266-L270 WeakPolarHBondContact O-CG 3.38Å; K266-L270 PolarHBondContact O-N 2.97Å; T267-L270 PolarHBondContact O-N 3.08Å; V268-L270 VanDerWaalsContact C-N 3.34Å; V268-L270 PolarHBondContact O-N 3.14Å; L270-R274 PolarHBondContact O-N 2.84Å |
| 271 | S | 68.8 | Low | 69.8 | Low | 49 Ų | 49 | 98.2 Ų | 98.2 | 34% | 0.343 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -77.7 | -31.2 | 174.9 | 69.6 | 0 | 0 | 0 | 0 | 112.8 | T267 V268 R269 I273 R274 | T267-S271 WeakPolarHBondContact O-CB 3.03Å; T267-S271 PolarHBondContact O-N 3.47Å; T267-S271 PolarHBondContact O-OG 3.34Å; V268-S271 WeakPolarHBondContact CA-OG 3.45Å; V268-S271 PolarHBondContact O-N 2.94Å; V268-S271 VanDerWaalsContact O-N 3.11Å; V268-S271 PolarHBondContact O-OG 3.05Å; R269-S271 VanDerWaalsContact C-N 3.3Å; R269-S271 PolarHBondContact O-N 3.48Å; S271-I273 VanDerWaalsContact C-N 3.35Å; S271-R274 PolarHBondContact O-N 3.27Å |
| 272 | E | 65.3 | Low | 68.7 | Low | 126 Ų | 126 | 101.1 Ų | 101.1 | 59% | 0.589 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -67.8 | -35.5 | 173.9 | -166.2 | 175.6 | -167.2 | 0 | 0 | 111.4 | V268 R269 | V268-E272 PolarHBondContact O-N 3.15Å; R269-E272 IonicContact NH1-OE2 3.73Å; R269-E272 PolarHBondContact NH1-OE2 3.33Å; R269-E272 PolarHBondContact O-N 3.46Å |
| 273 | I | 57 | Low | 67.8 | Low | 134 Ų | 134 | 98.6 Ų | 98.6 | 69% | 0.687 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -76.5 | -31.8 | 177.4 | -62.9 | 164.5 | 0 | 0 | 0 | 112.1 | R269 S271 V275 | R269-I273 WeakPolarHBondContact O-CD1 3.46Å; R269-I273 WeakPolarHBondContact O-CG1 3.31Å; R269-I273 PolarHBondContact O-N 3.2Å; S271-I273 VanDerWaalsContact C-N 3.35Å; I273-V275 VanDerWaalsContact C-N 3.35Å; I273-V275 PolarHBondContact O-N 3.37Å; I273-V275 VanDerWaalsContact O-N 3.12Å |
| 274 | R | 57.8 | Low | 66.8 | Low | 170 Ų | 170 | 100.7 Ų | 100.7 | 64% | 0.642 | 51% | 0.511 | S | S | * | . | trans | -85.4 | 76.1 | 173.7 | -89.9 | -173.3 | -73.9 | -179.9 | -5.8 | 110.5 | L270 S271 R276 | L270-R274 PolarHBondContact O-N 2.84Å; S271-R274 PolarHBondContact O-N 3.27Å; R274-R276 PolarHBondContact O-N 2.95Å | ||
| 275 | V | 48.2 | Very low | 65.8 | Low | 127 Ų | 127 | 104.7 Ų | 104.7 | 77% | 0.77 | 53% | 0.532 | S | S | * | . | trans | -64.8 | 85.7 | 166 | -166.7 | 0 | 0 | 0 | 0 | 108.6 | I273 | I273-V275 VanDerWaalsContact C-N 3.35Å; I273-V275 PolarHBondContact O-N 3.37Å; I273-V275 VanDerWaalsContact O-N 3.12Å | ||
| 276 | R | 49.8 | Very low | 65 | Low | 193 Ų | 193 | 108 Ų | 108 | 73% | 0.728 | 54% | 0.535 | S | S | * | . | trans | -91.2 | 113.7 | 164 | -80.2 | -169.1 | 173.5 | -177.6 | -2.1 | 107.7 | R274 V278 | R274-R276 PolarHBondContact O-N 2.95Å; R276-V278 PolarHBondContact O-N 3.43Å | ||
| 277 | P | 49.8 | Very low | 64.2 | Low | 123 Ų | 123 | 104.4 Ų | 104.4 | 80% | 0.799 | 52% | 0.52 | S | S | * | . | S | Bend | trans | -78.8 | 23.3 | -169.7 | 33 | -35 | 0 | 0 | 0 | 114.1 | ||
| 278 | V | 51.8 | Low | 63.5 | Low | 133 Ų | 133 | 109.9 Ų | 109.9 | 81% | 0.806 | 54% | 0.537 | S | S | * | . | trans | -143.2 | 66.4 | -174.4 | -163.6 | 0 | 0 | 0 | 0 | 110.8 | R276 | R276-V278 PolarHBondContact O-N 3.43Š| ||
| 279 | T | 57.6 | Low | 62.9 | Low | 64 Ų | 64 | 112 Ų | 112 | 39% | 0.393 | 55% | 0.553 | S | S | . | * | trans | -123.3 | 126.9 | 162.9 | 57.5 | 0 | 0 | 0 | 0 | 109.6 | Y281 Y283 | T279-Y281 PolarHBondContact O-N 3.47Å; T279-Y283 HydrophobicContact CG2-CD1 4.21Å; T279-Y283 HydrophobicContact CG2-CE1 4.37Å | ||
| 280 | T | 64.4 | Low | 62.5 | Low | 113 Ų | 113 | 106.1 Ų | 106.1 | 69% | 0.693 | 53% | 0.532 | S | S | * | . | trans | -47.8 | 130.9 | 178.7 | -47.6 | 0 | 0 | 0 | 0 | 110.2 | A282 Y283 | T280-A282 HydrophobicContact CG2-CB 4.33Å; T280-A282 PolarHBondContact O-N 3.37Å; T280-Y283 WeakPolarHBondContact O-CB 3.43Å; T280-Y283 PolarHBondContact O-N 3.05Å | ||
| 281 | Y | 63.3 | Low | 62.2 | Low | 171 Ų | 171 | 105.5 Ų | 105.5 | 67% | 0.671 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -43.8 | -33.6 | -179.1 | -177.9 | -108.3 | 0 | 0 | 0 | 114.4 | T279 Y283 L284 L285 | T279-Y281 PolarHBondContact O-N 3.47Å; Y281-Y283 PolarHBondContact O-N 3.29Å; Y281-L284 PolarHBondContact O-N 3.12Å; Y281-L285 HydrophobicContact CD1-CD1 3.64Å; Y281-L285 HydrophobicContact CD1-CG 4.3Å; Y281-L285 HydrophobicContact CE1-CD1 3.28Å; Y281-L285 HydrophobicContact CE1-CG 3.98Å; Y281-L285 HydrophobicContact CG-CD1 4.49Å; Y281-L285 PolarHBondContact O-N 3.16Å |
| 282 | A | 62.5 | Low | 62.3 | Low | 67 Ų | 67 | 109.1 Ų | 109.1 | 55% | 0.554 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -61.8 | -35.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | T280 R286 | T280-A282 HydrophobicContact CG2-CB 4.33Å; T280-A282 PolarHBondContact O-N 3.37Å; A282-R286 WeakPolarHBondContact O-CB 3.33Å; A282-R286 PolarHBondContact O-N 2.97Å |
| 283 | Y | 68.8 | Low | 62.6 | Low | 96 Ų | 96 | 105.1 Ų | 105.1 | 38% | 0.376 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -69.1 | -45.1 | 176.8 | 169.9 | -92.9 | 0 | 0 | 0 | 111.1 | Q180 T279 T280 Y281 R286 F287 | Q180-Y283 PolarHBondContact NE2-OH 3.4Å; T279-Y283 HydrophobicContact CG2-CD1 4.21Å; T279-Y283 HydrophobicContact CG2-CE1 4.37Å; T280-Y283 WeakPolarHBondContact O-CB 3.43Å; T280-Y283 PolarHBondContact O-N 3.05Å; Y281-Y283 PolarHBondContact O-N 3.29Å; Y283-R286 PolarHBondContact O-N 3.46Å; Y283-F287 WeakPolarHBondContact O-CB 3.37Å; Y283-F287 PolarHBondContact O-N 2.98Å |
| 284 | L | 67.8 | Low | 63.4 | Low | 72 Ų | 72 | 99 Ų | 99 | 38% | 0.377 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.4 | -48.7 | 177.5 | -65.8 | 178 | 0 | 0 | 0 | 111.2 | Y281 R286 F287 Y288 | Y281-L284 PolarHBondContact O-N 3.12Å; L284-R286 VanDerWaalsContact C-N 3.27Å; L284-R286 PolarHBondContact O-N 2.94Å; L284-F287 PolarHBondContact O-N 3.29Å; L284-Y288 WeakPolarHBondContact O-CD2 3.16Å; L284-Y288 PolarHBondContact O-N 3.46Å |
| 285 | L | 65.9 | Low | 64.4 | Low | 91 Ų | 91 | 93.7 Ų | 93.7 | 48% | 0.476 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -55.1 | -43 | 176.4 | -81.6 | 174.3 | 0 | 0 | 0 | 112.6 | Y281 S289 | Y281-L285 HydrophobicContact CD1-CD1 3.64Å; Y281-L285 HydrophobicContact CD1-CG 4.3Å; Y281-L285 HydrophobicContact CE1-CD1 3.28Å; Y281-L285 HydrophobicContact CE1-CG 3.98Å; Y281-L285 HydrophobicContact CG-CD1 4.49Å; Y281-L285 PolarHBondContact O-N 3.16Å; L285-S289 PolarHBondContact O-N 2.84Å; L285-S289 VanDerWaalsContact O-N 3.09Å |
| 286 | R | 66.5 | Low | 65.7 | Low | 131 Ų | 131 | 88.1 Ų | 88.1 | 49% | 0.494 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -66.6 | -46.6 | 178.1 | -172.1 | 168.9 | 177.8 | 179.7 | -17.4 | 111.4 | A282 Y283 L284 Y288 S289 E290 | A282-R286 WeakPolarHBondContact O-CB 3.33Å; A282-R286 PolarHBondContact O-N 2.97Å; Y283-R286 PolarHBondContact O-N 3.46Å; L284-R286 VanDerWaalsContact C-N 3.27Å; L284-R286 PolarHBondContact O-N 2.94Å; R286-Y288 VanDerWaalsContact C-N 3.34Å; R286-Y288 PolarHBondContact O-N 2.8Å; R286-S289 PolarHBondContact O-N 3.21Å; R286-S289 VanDerWaalsContact O-N 3.14Å; R286-S289 PolarHBondContact O-OG 3.1Å; R286-E290 HydrophobicContact CG-CG 4.47Å; R286-E290 VanDerWaalsContact O-CG 3.29Å; R286-E290 WeakPolarHBondContact O-CG 3.32Å; R286-E290 PolarHBondContact O-N 3.08Å |
| 287 | F | 68.3 | Low | 67.1 | Low | 32 Ų | 32 | 79 Ų | 79 | 14% | 0.14 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -56.9 | -45.6 | 176.8 | -174.4 | -97.4 | 0 | 0 | 0 | 112.2 | I177 V268 Y283 L284 S289 E290 M291 | I177-F287 HydrophobicContact CG2-CE2 4.04Å; V268-F287 HydrophobicContact CG2-CZ 3.94Å; Y283-F287 WeakPolarHBondContact O-CB 3.37Å; Y283-F287 PolarHBondContact O-N 2.98Å; L284-F287 PolarHBondContact O-N 3.29Å; F287-S289 PolarHBondContact O-N 3.36Å; F287-E290 PolarHBondContact O-N 3.1Å; F287-M291 HydrophobicContact CE1-SD 4.43Å; F287-M291 WeakPolarHBondContact O-CB 3.25Å; F287-M291 PolarHBondContact O-N 2.94Å |
| 288 | Y | 67.9 | Low | 68.6 | Low | 155 Ų | 155 | 76.3 Ų | 76.3 | 61% | 0.608 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -62.6 | -38.3 | 175.5 | -80.7 | -69.8 | 0 | 0 | 0 | 113 | L284 R286 M291 R292 | L284-Y288 WeakPolarHBondContact O-CD2 3.16Å; L284-Y288 PolarHBondContact O-N 3.46Å; R286-Y288 VanDerWaalsContact C-N 3.34Å; R286-Y288 PolarHBondContact O-N 2.8Å; Y288-M291 PolarHBondContact O-N 3.38Å; Y288-R292 WeakPolarHBondContact O-CB 3.06Å; Y288-R292 PolarHBondContact O-N 3.36Å |
| 289 | S | 64.8 | Low | 70.2 | Confident | 61 Ų | 61 | 72.9 Ų | 72.9 | 43% | 0.427 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -66.3 | -38.1 | 176.5 | 75.2 | 0 | 0 | 0 | 0 | 112.9 | L285 R286 F287 R292 T293 | L285-S289 PolarHBondContact O-N 2.84Å; L285-S289 VanDerWaalsContact O-N 3.09Å; R286-S289 PolarHBondContact O-N 3.21Å; R286-S289 VanDerWaalsContact O-N 3.14Å; R286-S289 PolarHBondContact O-OG 3.1Å; F287-S289 PolarHBondContact O-N 3.36Å; S289-R292 CarbonylContact O-C 3.59Å; S289-R292 PolarHBondContact O-N 2.65Å; S289-T293 PolarHBondContact O-N 2.92Å; S289-T293 PolarHBondContact O-OG1 2.73Å; S289-T293 VanDerWaalsContact O-OG1 3.07Å |
| 290 | E | 69.2 | Low | 71.4 | Confident | 42 Ų | 42 | 69.9 Ų | 69.9 | 20% | 0.196 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -70.7 | -39.9 | 176.6 | -64.1 | -68.5 | 161.9 | 0 | 0 | 110.7 | R173 I177 R286 F287 T293 A294 | R173-E290 IonicContact CZ-OE2 3.37Å; R173-E290 IonicContact NH1-OE2 2.6Å; R173-E290 PolarHBondContact NH1-OE2 2.96Å; R173-E290 IonicContact NH2-OE2 3.67Å; I177-E290 HydrophobicContact CD1-CB 4.25Å; I177-E290 HydrophobicContact CG1-CB 3.94Å; R286-E290 HydrophobicContact CG-CG 4.47Å; R286-E290 VanDerWaalsContact O-CG 3.29Å; R286-E290 WeakPolarHBondContact O-CG 3.32Å; R286-E290 PolarHBondContact O-N 3.08Å; F287-E290 PolarHBondContact O-N 3.1Å; E290-T293 CarbonylContact O-C 3.44Å; E290-T293 WeakPolarHBondContact O-CA 3.38Å; E290-T293 WeakPolarHBondContact O-CB 3.46Å; E290-T293 PolarHBondContact O-N 3.4Å; E290-A294 PolarHBondContact O-N 3.21Å |
| 291 | M | 70 | Confident | 72.2 | Confident | 65 Ų | 65 | 64.9 Ų | 64.9 | 32% | 0.32 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.5 | -43.6 | 173.5 | -173.3 | 169.7 | 177.8 | 0 | 0 | 111.4 | V268 F287 Y288 T293 A294 T295 | V268-M291 HydrophobicContact CG1-CE 3.55Å; V268-M291 HydrophobicContact CG1-SD 3.88Å; V268-M291 HydrophobicContact CG2-SD 4.5Å; F287-M291 HydrophobicContact CE1-SD 4.43Å; F287-M291 WeakPolarHBondContact O-CB 3.25Å; F287-M291 PolarHBondContact O-N 2.94Å; Y288-M291 PolarHBondContact O-N 3.38Å; M291-T293 PolarHBondContact O-N 2.93Å; M291-A294 PolarHBondContact O-N 3.48Å; M291-A294 VanDerWaalsContact O-N 3.15Å; M291-T295 PolarHBondContact O-N 2.93Å; M291-T295 PolarHBondContact O-OG1 3.43Å; M291-T295 VanDerWaalsContact O-OG1 3.1Å |
| 292 | R | 72.4 | Confident | 73.3 | Confident | 126 Ų | 126 | 60.4 Ų | 60.4 | 48% | 0.475 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -69.4 | 7.8 | 168.7 | -161.9 | -118.8 | -173.1 | 101.2 | 10.7 | 113.1 | Y288 S289 R351 P353 | Y288-R292 WeakPolarHBondContact O-CB 3.06Å; Y288-R292 PolarHBondContact O-N 3.36Å; S289-R292 CarbonylContact O-C 3.59Å; S289-R292 PolarHBondContact O-N 2.65Å; R292-R351 PolarHBondContact NE-O 3.46Å; R292-R351 PolarHBondContact NH2-O 2.72Å; R292-R351 PolarHBondContact O-NE 3.37Å; R292-R351 PolarHBondContact O-NH1 3.32Å; R292-P353 VanDerWaalsContact NH2-CD 3.28Å |
| 293 | T | 71.4 | Confident | 74.4 | Confident | 42 Ų | 42 | 61 Ų | 61 | 26% | 0.258 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -111.4 | -38 | 162.2 | -50 | 0 | 0 | 0 | 0 | 110.6 | S289 E290 M291 T295 T296 V297 | S289-T293 PolarHBondContact O-N 2.92Å; S289-T293 PolarHBondContact O-OG1 2.73Å; S289-T293 VanDerWaalsContact O-OG1 3.07Å; E290-T293 CarbonylContact O-C 3.44Å; E290-T293 WeakPolarHBondContact O-CA 3.38Å; E290-T293 WeakPolarHBondContact O-CB 3.46Å; E290-T293 PolarHBondContact O-N 3.4Å; M291-T293 PolarHBondContact O-N 2.93Å; T293-T295 PolarHBondContact O-N 2.88Å; T293-T296 VanDerWaalsContact C-OG1 3.3Å; T293-T296 WeakPolarHBondContact CA-OG1 3.17Å; T293-T296 VanDerWaalsContact O-CB 3.29Å; T293-T296 WeakPolarHBondContact O-CB 3.1Å; T293-T296 PolarHBondContact O-N 3.29Å; T293-T296 PolarHBondContact O-OG1 3.49Å; T293-V297 WeakPolarHBondContact O-CG2 3.49Å; T293-V297 PolarHBondContact O-N 2.7Å |
| 294 | A | 73.4 | Confident | 75.1 | Confident | 4 Ų | 4 | 56.9 Ų | 56.9 | 3% | 0.033 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.2 | -41.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | I177 I264 E290 M291 T296 V297 L298 | I177-A294 HydrophobicContact CD1-CB 3.54Å; I264-A294 HydrophobicContact CG2-CB 4.04Å; E290-A294 PolarHBondContact O-N 3.21Å; M291-A294 PolarHBondContact O-N 3.48Å; M291-A294 VanDerWaalsContact O-N 3.15Å; A294-T296 PolarHBondContact O-N 2.99Å; A294-V297 PolarHBondContact O-N 3.19Å; A294-L298 PolarHBondContact O-N 2.82Å |
| 295 | T | 77.9 | Confident | 75.9 | Confident | 59 Ų | 59 | 56.9 Ų | 56.9 | 36% | 0.362 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.5 | -18.8 | 175.6 | -49.2 | 0 | 0 | 0 | 0 | 112.2 | M291 T293 I299 R351 | M291-T295 PolarHBondContact O-N 2.93Å; M291-T295 PolarHBondContact O-OG1 3.43Å; M291-T295 VanDerWaalsContact O-OG1 3.1Å; T293-T295 PolarHBondContact O-N 2.88Å; T295-I299 HydrophobicContact CG2-CD1 4.45Å; T295-I299 WeakPolarHBondContact O-CD1 3.32Å; T295-I299 VanDerWaalsContact O-CG1 3.22Å; T295-I299 WeakPolarHBondContact O-CG1 3.07Å; T295-I299 PolarHBondContact O-N 3.46Å; T295-R351 VanDerWaalsContact CB-NH1 3.29Å; T295-R351 PolarHBondContact O-NH2 2.79Å |
| 296 | T | 76.7 | Confident | 76.8 | Confident | 10 Ų | 10 | 56 Ų | 56 | 6% | 0.061 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -81.5 | -47.4 | -176.4 | -13.1 | 0 | 0 | 0 | 0 | 107.1 | T293 A294 L298 I299 M300 I347 R351 | T293-T296 VanDerWaalsContact C-OG1 3.3Å; T293-T296 WeakPolarHBondContact CA-OG1 3.17Å; T293-T296 VanDerWaalsContact O-CB 3.29Å; T293-T296 WeakPolarHBondContact O-CB 3.1Å; T293-T296 PolarHBondContact O-N 3.29Å; T293-T296 PolarHBondContact O-OG1 3.49Å; A294-T296 PolarHBondContact O-N 2.99Å; T296-L298 PolarHBondContact O-N 2.85Å; T296-I299 WeakPolarHBondContact O-CB 3.43Å; T296-I299 PolarHBondContact O-N 3.28Å; T296-I299 VanDerWaalsContact O-N 3.14Å; T296-M300 HydrophobicContact CG2-SD 4.35Å; T296-M300 WeakPolarHBondContact O-CB 3.39Å; T296-M300 WeakPolarHBondContact O-CG 3.46Å; T296-M300 PolarHBondContact O-N 3.48Å; T296-I347 HydrophobicContact CG2-CG2 3.47Å; T296-I347 VanDerWaalsContact CG2-CG2 3.47Å; T296-R351 VanDerWaalsContact CA-CZ 3.43Å; T296-R351 VanDerWaalsContact CB-CZ 3.49Å; T296-R351 HydrophobicContact CG2-CB 4.43Å; T296-R351 HydrophobicContact CG2-CG 4.4Å; T296-R351 VanDerWaalsContact N-NH2 3.11Å; T296-R351 WeakPolarHBondContact OG1-CD 3.34Å; T296-R351 PolarHBondContact OG1-NE 3.31Å; T296-R351 PolarHBondContact OG1-NH1 3.11Å |
| 297 | V | 78.4 | Confident | 77.7 | Confident | 3 Ų | 3 | 50.2 Ų | 50.2 | 2% | 0.018 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -63 | -38 | 177 | -172.7 | 0 | 0 | 0 | 0 | 109.3 | I169 S170 R173 H261 T293 A294 I299 M300 I301 | I169-V297 HydrophobicContact CG2-CG1 4.17Å; I169-V297 HydrophobicContact CG2-CG2 3.51Å; S170-V297 WeakPolarHBondContact OG-CG1 3.5Å; R173-V297 HydrophobicContact CG-CG2 4.07Å; H261-V297 WeakPolarHBondContact CE1-CG1 3.35Å; H261-V297 WeakPolarHBondContact NE2-CB 3.48Å; H261-V297 WeakPolarHBondContact NE2-CG1 3.47Å; T293-V297 WeakPolarHBondContact O-CG2 3.49Å; T293-V297 PolarHBondContact O-N 2.7Å; A294-V297 PolarHBondContact O-N 3.19Å; V297-I299 PolarHBondContact O-N 3.32Å; V297-M300 CarbonylContact O-C 3.58Å; V297-M300 WeakPolarHBondContact O-CB 3.39Å; V297-M300 PolarHBondContact O-N 2.89Å; V297-I301 HydrophobicContact CG1-CD1 4.32Å; V297-I301 VanDerWaalsContact O-CG1 3.25Å; V297-I301 WeakPolarHBondContact O-CG1 3.27Å; V297-I301 PolarHBondContact O-N 3.47Å |
| 298 | L | 82.4 | Confident | 78.5 | Confident | 66 Ų | 66 | 49.8 Ų | 49.8 | 35% | 0.346 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -59.2 | -46.6 | 171.3 | -174.2 | 67.2 | 0 | 0 | 0 | 112.5 | H261 A294 T296 M300 I301 V302 | H261-L298 HydrophobicContact CB-CD1 4.18Å; A294-L298 PolarHBondContact O-N 2.82Å; T296-L298 PolarHBondContact O-N 2.85Å; L298-M300 VanDerWaalsContact C-N 3.34Å; L298-I301 WeakPolarHBondContact O-CB 3.39Å; L298-I301 PolarHBondContact O-N 2.93Å; L298-V302 PolarHBondContact O-N 3.21Å |
| 299 | I | 83.9 | Confident | 79.2 | Confident | 60 Ų | 60 | 43.8 Ų | 43.8 | 31% | 0.308 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -62.5 | -44.3 | 176 | -68.4 | 164.7 | 0 | 0 | 0 | 110.2 | T295 T296 V297 I301 V302 F303 I347 | T295-I299 HydrophobicContact CG2-CD1 4.45Å; T295-I299 WeakPolarHBondContact O-CD1 3.32Å; T295-I299 VanDerWaalsContact O-CG1 3.22Å; T295-I299 WeakPolarHBondContact O-CG1 3.07Å; T295-I299 PolarHBondContact O-N 3.46Å; T296-I299 WeakPolarHBondContact O-CB 3.43Å; T296-I299 PolarHBondContact O-N 3.28Å; T296-I299 VanDerWaalsContact O-N 3.14Å; V297-I299 PolarHBondContact O-N 3.32Å; I299-I301 VanDerWaalsContact C-N 3.26Å; I299-I301 PolarHBondContact O-N 2.94Å; I299-V302 PolarHBondContact O-N 3.11Å; I299-V302 VanDerWaalsContact O-N 3.11Å; I299-F303 HydrophobicContact CG2-CD2 3.71Å; I299-F303 HydrophobicContact CG2-CE2 3.5Å; I299-F303 VanDerWaalsContact CG2-CE2 3.5Å; I299-F303 WeakPolarHBondContact O-CD2 3.37Å; I299-F303 PolarHBondContact O-N 2.97Å; I299-F303 VanDerWaalsContact O-N 3.09Å; I299-I347 HydrophobicContact CG2-CD1 4.12Å; I299-I347 HydrophobicContact CG2-CG1 4.38Å |
| 300 | M | 82.7 | Confident | 80.1 | Confident | 2 Ų | 2 | 43 Ų | 43 | 1% | 0.01 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.5 | -35.7 | 176.4 | -66.6 | 160.8 | 67 | 0 | 0 | 111.7 | L115 M166 T296 V297 L298 F303 I304 I347 Y348 | L115-M300 HydrophobicContact CD2-CE 3.83Å; M166-M300 HydrophobicContact CE-CB 4.05Å; M166-M300 HydrophobicContact CE-CE 3.41Å; M166-M300 VanDerWaalsContact CE-CE 3.41Å; M166-M300 HydrophobicContact SD-CB 4.33Å; M166-M300 HydrophobicContact SD-CE 3.36Å; M166-M300 WeakPolarHBondContact SD-CE 3.49Å; T296-M300 HydrophobicContact CG2-SD 4.35Å; T296-M300 WeakPolarHBondContact O-CB 3.39Å; T296-M300 WeakPolarHBondContact O-CG 3.46Å; T296-M300 PolarHBondContact O-N 3.48Å; V297-M300 CarbonylContact O-C 3.58Å; V297-M300 WeakPolarHBondContact O-CB 3.39Å; V297-M300 PolarHBondContact O-N 2.89Å; L298-M300 VanDerWaalsContact C-N 3.34Å; M300-F303 PolarHBondContact O-N 3.48Å; M300-I304 WeakPolarHBondContact O-CB 3.39Å; M300-I304 PolarHBondContact O-N 3.36Å; M300-I347 HydrophobicContact CB-CD1 4.34Å; M300-I347 HydrophobicContact CG-CD1 3.53Å; M300-I347 HydrophobicContact CG-CG2 4.04Å; M300-I347 HydrophobicContact SD-CG2 4.44Å; M300-Y348 HydrophobicContact CE-CE1 4.04Å; M300-Y348 WeakPolarHBondContact CE-OH 3.43Å; M300-Y348 HydrophobicContact SD-CE1 3.82Å |
| 301 | I | 83.3 | Confident | 80.6 | Confident | 7 Ų | 7 | 42.7 Ų | 42.7 | 4% | 0.036 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -66.4 | -43.1 | 173.2 | -70.7 | 160.3 | 0 | 0 | 0 | 111.5 | F254 M257 H261 V297 L298 I299 F303 I304 I305 | F254-I301 HydrophobicContact CE2-CG2 4.14Å; M257-I301 HydrophobicContact CB-CD1 3.98Å; M257-I301 HydrophobicContact CB-CG1 4.22Å; M257-I301 HydrophobicContact CE-CD1 3.84Å; M257-I301 HydrophobicContact CE-CG1 3.25Å; M257-I301 HydrophobicContact SD-CG1 4.31Å; H261-I301 HydrophobicContact CB-CD1 4.44Å; H261-I301 WeakPolarHBondContact CE1-CD1 3.25Å; H261-I301 WeakPolarHBondContact ND1-CD1 3.3Å; V297-I301 HydrophobicContact CG1-CD1 4.32Å; V297-I301 VanDerWaalsContact O-CG1 3.25Å; V297-I301 WeakPolarHBondContact O-CG1 3.27Å; V297-I301 PolarHBondContact O-N 3.47Å; L298-I301 WeakPolarHBondContact O-CB 3.39Å; L298-I301 PolarHBondContact O-N 2.93Å; I299-I301 VanDerWaalsContact C-N 3.26Å; I299-I301 PolarHBondContact O-N 2.94Å; I301-F303 VanDerWaalsContact C-N 3.26Å; I301-F303 PolarHBondContact O-N 3.23Å; I301-I304 VanDerWaalsContact O-CG2 3.29Å; I301-I304 WeakPolarHBondContact O-CG2 3.4Å; I301-I304 PolarHBondContact O-N 2.78Å; I301-I305 HydrophobicContact CG2-CD1 4.08Å; I301-I305 HydrophobicContact CG2-CG1 4.48Å; I301-I305 VanDerWaalsContact O-CG1 3.27Å; I301-I305 WeakPolarHBondContact O-CG1 3.46Å; I301-I305 PolarHBondContact O-N 3.15Å |
| 302 | V | 86.1 | Confident | 81.1 | Confident | 78 Ų | 78 | 40.2 Ų | 40.2 | 47% | 0.473 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -59.4 | -45 | 177.7 | 174.9 | 0 | 0 | 0 | 0 | 109.9 | L298 I299 I305 C306 | L298-V302 PolarHBondContact O-N 3.21Å; I299-V302 PolarHBondContact O-N 3.11Å; I299-V302 VanDerWaalsContact O-N 3.11Å; V302-I305 PolarHBondContact O-N 3.46Å; V302-C306 PolarHBondContact O-N 3Å; V302-C306 VanDerWaalsContact O-N 3.14Å; V302-C306 PolarHBondContact O-SG 3.44Å; V302-C306 VanDerWaalsContact O-SG 3.33Å |
| 303 | F | 85.3 | Confident | 81.6 | Confident | 80 Ų | 80 | 39.4 Ų | 39.4 | 35% | 0.351 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -67 | -37.3 | 176.7 | -73.8 | -68 | 0 | 0 | 0 | 113.3 | I299 M300 I301 I305 C306 C307 I343 I347 | I299-F303 HydrophobicContact CG2-CD2 3.71Å; I299-F303 HydrophobicContact CG2-CE2 3.5Å; I299-F303 VanDerWaalsContact CG2-CE2 3.5Å; I299-F303 WeakPolarHBondContact O-CD2 3.37Å; I299-F303 PolarHBondContact O-N 2.97Å; I299-F303 VanDerWaalsContact O-N 3.09Å; M300-F303 PolarHBondContact O-N 3.48Å; I301-F303 VanDerWaalsContact C-N 3.26Å; I301-F303 PolarHBondContact O-N 3.23Å; F303-I305 VanDerWaalsContact C-N 3.29Å; F303-I305 PolarHBondContact O-N 3.04Å; F303-C306 PolarHBondContact O-N 3.19Å; F303-C307 VanDerWaalsContact O-CB 3.26Å; F303-C307 WeakPolarHBondContact O-CB 3.24Å; F303-C307 PolarHBondContact O-N 2.77Å; F303-C307 PolarHBondContact O-SG 2.95Å; F303-C307 VanDerWaalsContact O-SG 3.4Å; F303-I343 HydrophobicContact CB-CD1 4.4Å; F303-I343 HydrophobicContact CB-CG2 3.99Å; F303-I343 HydrophobicContact CD1-CD1 4.03Å; F303-I343 HydrophobicContact CD1-CG2 4.25Å; F303-I343 HydrophobicContact CD2-CG2 3.97Å; F303-I343 HydrophobicContact CG-CD1 4.42Å; F303-I343 HydrophobicContact CG-CG2 3.81Å; F303-I347 HydrophobicContact CD2-CD1 3.82Å; F303-I347 HydrophobicContact CE2-CD1 4.34Å |
| 304 | I | 83.3 | Confident | 81.8 | Confident | 9 Ų | 9 | 38.4 Ų | 38.4 | 5% | 0.046 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.6 | -38.7 | 177.2 | -148.2 | 175.2 | 0 | 0 | 0 | 111.1 | M166 M300 I301 C307 W308 | M166-I304 HydrophobicContact CB-CD1 4.45Å; M166-I304 HydrophobicContact CG-CD1 4.23Å; M300-I304 WeakPolarHBondContact O-CB 3.39Å; M300-I304 PolarHBondContact O-N 3.36Å; I301-I304 VanDerWaalsContact O-CG2 3.29Å; I301-I304 WeakPolarHBondContact O-CG2 3.4Å; I301-I304 PolarHBondContact O-N 2.78Å; I304-C307 PolarHBondContact O-N 2.72Å; I304-W308 HydrophobicContact CG1-CG 4.36Å; I304-W308 VanDerWaalsContact O-CB 3.3Å; I304-W308 WeakPolarHBondContact O-CB 3.48Å; I304-W308 PolarHBondContact O-N 2.83Å |
| 305 | I | 84.8 | Confident | 81.8 | Confident | 72 Ų | 72 | 38.4 Ų | 38.4 | 37% | 0.369 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -63.2 | -48.1 | 175.2 | -62.3 | 163.1 | 0 | 0 | 0 | 110.5 | F254 I301 V302 F303 C307 G309 | F254-I305 HydrophobicContact CD2-CG1 3.9Å; F254-I305 HydrophobicContact CE2-CD1 3.31Å; F254-I305 HydrophobicContact CE2-CG1 3.07Å; F254-I305 HydrophobicContact CZ-CD1 3.43Å; F254-I305 VanDerWaalsContact CZ-CD1 3.43Å; F254-I305 HydrophobicContact CZ-CG1 3.48Å; F254-I305 VanDerWaalsContact CZ-CG1 3.48Å; I301-I305 HydrophobicContact CG2-CD1 4.08Å; I301-I305 HydrophobicContact CG2-CG1 4.48Å; I301-I305 VanDerWaalsContact O-CG1 3.27Å; I301-I305 WeakPolarHBondContact O-CG1 3.46Å; I301-I305 PolarHBondContact O-N 3.15Å; V302-I305 PolarHBondContact O-N 3.46Å; F303-I305 VanDerWaalsContact C-N 3.29Å; F303-I305 PolarHBondContact O-N 3.04Å; I305-C307 VanDerWaalsContact C-N 3.33Å; I305-C307 PolarHBondContact O-N 2.72Å; I305-G309 WeakPolarHBondContact O-CA 3.34Å; I305-G309 PolarHBondContact O-N 3.29Å |
| 306 | C | 85.1 | Confident | 81.8 | Confident | 72 Ų | 72 | 37.9 Ų | 37.9 | 49% | 0.486 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -65.4 | -38.3 | -178.3 | -65.8 | 0 | 0 | 0 | 0 | 112 | V302 F303 P310 | V302-C306 PolarHBondContact O-N 3Å; V302-C306 VanDerWaalsContact O-N 3.14Å; V302-C306 PolarHBondContact O-SG 3.44Å; V302-C306 VanDerWaalsContact O-SG 3.33Å; F303-C306 PolarHBondContact O-N 3.19Å; C306-P310 WeakPolarHBondContact O-CD 3.16Å; C306-P310 WeakPolarHBondContact O-CG 3.31Å |
| 307 | C | 85.3 | Confident | 81.8 | Confident | 9 Ų | 9 | 40.1 Ų | 40.1 | 6% | 0.061 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -80.3 | -43.8 | -176.8 | -74.4 | 0 | 0 | 0 | 0 | 113.3 | F303 I304 I305 M336 A337 N340 I343 | F303-C307 VanDerWaalsContact O-CB 3.26Å; F303-C307 WeakPolarHBondContact O-CB 3.24Å; F303-C307 PolarHBondContact O-N 2.77Å; F303-C307 PolarHBondContact O-SG 2.95Å; F303-C307 VanDerWaalsContact O-SG 3.4Å; I304-C307 PolarHBondContact O-N 2.72Å; I305-C307 VanDerWaalsContact C-N 3.33Å; I305-C307 PolarHBondContact O-N 2.72Å; C307-M336 WeakPolarHBondContact CB-O 3.32Å; C307-M336 CarbonylContact O-C 3.38Å; C307-M336 PolarHBondContact SG-O 3.45Å; C307-M336 VanDerWaalsContact SG-O 3.37Å; C307-A337 PolarHBondContact O-N 3.21Å; C307-N340 HydrophobicContact CB-CB 3.92Å; C307-I343 VanDerWaalsContact SG-CD1 3.52Å |
| 308 | W | 83.8 | Confident | 81.5 | Confident | 24 Ų | 24 | 41.8 Ų | 41.8 | 9% | 0.091 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -98.3 | -22.9 | -175.8 | -74.2 | 90.4 | 0 | 0 | 0 | 113.9 | F250 I304 Y311 C312 A337 N340 | F250-W308 HydrophobicContact CD1-CD2 4.42Å; F250-W308 AromaticContact CD1-CE3 3.97Å; F250-W308 HydrophobicContact CD1-CE3 3.97Å; F250-W308 HydrophobicContact CD1-CZ3 4.41Å; F250-W308 AromaticContact CE1-CD2 3.89Å; F250-W308 HydrophobicContact CE1-CD2 3.89Å; F250-W308 AromaticContact CE1-CE3 3.29Å; F250-W308 HydrophobicContact CE1-CE3 3.29Å; F250-W308 AromaticContact CE1-CH2 3.97Å; F250-W308 HydrophobicContact CE1-CH2 3.97Å; F250-W308 HydrophobicContact CE1-CZ2 4.48Å; F250-W308 AromaticContact CE1-CZ3 3.34Å; F250-W308 HydrophobicContact CE1-CZ3 3.34Å; F250-W308 AromaticContact CZ-CE3 3.92Å; F250-W308 HydrophobicContact CZ-CE3 3.92Å; F250-W308 HydrophobicContact CZ-CH2 4.14Å; F250-W308 AromaticContact CZ-CZ3 3.52Å; F250-W308 HydrophobicContact CZ-CZ3 3.52Å; I304-W308 HydrophobicContact CG1-CG 4.36Å; I304-W308 VanDerWaalsContact O-CB 3.3Å; I304-W308 WeakPolarHBondContact O-CB 3.48Å; I304-W308 PolarHBondContact O-N 2.83Å; W308-Y311 HydrophobicContact CE3-CD1 4.17Å; W308-Y311 HydrophobicContact CZ3-CD1 4.26Å; W308-Y311 HydrophobicContact CZ3-CE1 4.37Å; W308-Y311 WeakPolarHBondContact O-CB 3.23Å; W308-Y311 PolarHBondContact O-N 2.93Å; W308-C312 PolarHBondContact O-N 3.07Å; W308-C312 PolarHBondContact O-SG 3.45Å; W308-A337 HydrophobicContact CD2-CB 4.38Å; W308-A337 HydrophobicContact CE3-CB 4.32Å; W308-A337 HydrophobicContact CZ3-CB 4.4Å; W308-N340 PolarHBondContact NE1-ND2 3.42Å; W308-N340 VanDerWaalsContact NE1-ND2 3.18Å |
| 309 | G | 83.1 | Confident | 80.7 | Confident | 29 Ų | 29 | 39.5 Ų | 39.5 | 30% | 0.299 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -57.7 | -51.8 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | I305 Y311 C312 L313 | I305-G309 WeakPolarHBondContact O-CA 3.34Å; I305-G309 PolarHBondContact O-N 3.29Å; G309-Y311 VanDerWaalsContact C-N 3.29Å; G309-Y311 PolarHBondContact O-N 3.5Å; G309-C312 PolarHBondContact O-N 3.44Å; G309-L313 WeakPolarHBondContact O-CB 3.49Å; G309-L313 PolarHBondContact O-N 3.11Å |
| 310 | P | 84.1 | Confident | 80.1 | Confident | 45 Ų | 45 | 42.8 Ų | 42.8 | 29% | 0.292 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -57.4 | -43.5 | 177 | -25 | 34.6 | 0 | 0 | 0 | 112 | C306 L313 M314 M336 | C306-P310 WeakPolarHBondContact O-CD 3.16Å; C306-P310 WeakPolarHBondContact O-CG 3.31Å; P310-L313 PolarHBondContact O-N 2.82Å; P310-M314 WeakPolarHBondContact O-CB 3.35Å; P310-M314 WeakPolarHBondContact O-CG 3.07Å; P310-M314 PolarHBondContact O-N 3.01Å; P310-M336 HydrophobicContact CG-CE 4.26Å; P310-M336 HydrophobicContact CG-SD 4.18Å |
| 311 | Y | 79.3 | Confident | 79.2 | Confident | 34 Ų | 34 | 44.1 Ų | 44.1 | 13% | 0.133 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -61.2 | -47 | 178.1 | -177.9 | -88.7 | 0 | 0 | 0 | 112.4 | M227 Y228 W308 G309 G315 V334 A337 | M227-Y311 HydrophobicContact CE-CE2 3.98Å; Y228-Y311 HydrophobicContact CD1-CE2 4.48Å; Y228-Y311 HydrophobicContact CE1-CD2 4.14Å; Y228-Y311 AromaticContact CE1-CE2 3.42Å; Y228-Y311 HydrophobicContact CE1-CE2 3.42Å; Y228-Y311 VanDerWaalsContact CE1-CE2 3.42Å; Y228-Y311 AromaticContact CE1-CZ 3.73Å; Y228-Y311 HydrophobicContact CE2-CE2 4.2Å; Y228-Y311 AromaticContact CZ-CD2 3.86Å; Y228-Y311 AromaticContact CZ-CE2 3.26Å; Y228-Y311 WeakPolarHBondContact OH-CD2 3.41Å; Y228-Y311 WeakPolarHBondContact OH-CE2 3.41Å; W308-Y311 HydrophobicContact CE3-CD1 4.17Å; W308-Y311 HydrophobicContact CZ3-CD1 4.26Å; W308-Y311 HydrophobicContact CZ3-CE1 4.37Å; W308-Y311 WeakPolarHBondContact O-CB 3.23Å; W308-Y311 PolarHBondContact O-N 2.93Å; G309-Y311 VanDerWaalsContact C-N 3.29Å; G309-Y311 PolarHBondContact O-N 3.5Å; Y311-G315 PolarHBondContact O-N 3.41Å; Y311-G315 VanDerWaalsContact O-N 3.09Å; Y311-V334 HydrophobicContact CE2-CG2 4.27Å; Y311-A337 HydrophobicContact CD2-CB 4.4Å; Y311-A337 HydrophobicContact CG-CB 4.48Å |
| 312 | C | 80.8 | Confident | 78.1 | Confident | 13 Ų | 13 | 50.7 Ų | 50.7 | 9% | 0.088 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -66.7 | -39.4 | 179 | -64.1 | 0 | 0 | 0 | 0 | 112.2 | I246 W308 G309 G315 L316 | I246-C312 HydrophobicContact CG2-CB 4.25Å; W308-C312 PolarHBondContact O-N 3.07Å; W308-C312 PolarHBondContact O-SG 3.45Å; G309-C312 PolarHBondContact O-N 3.44Å; C312-G315 PolarHBondContact O-N 3.31Å; C312-L316 WeakPolarHBondContact O-CB 3.14Å; C312-L316 PolarHBondContact O-N 2.94Å |
| 313 | L | 82.1 | Confident | 77.1 | Confident | 110 Ų | 110 | 54.1 Ų | 54.1 | 58% | 0.576 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -65.7 | -46.6 | 179.3 | -178.5 | 62.9 | 0 | 0 | 0 | 111.3 | G309 P310 G315 L316 V317 | G309-L313 WeakPolarHBondContact O-CB 3.49Å; G309-L313 PolarHBondContact O-N 3.11Å; P310-L313 PolarHBondContact O-N 2.82Å; L313-G315 VanDerWaalsContact C-N 3.33Å; L313-G315 PolarHBondContact O-N 3.47Å; L313-L316 PolarHBondContact O-N 3.03Å; L313-V317 HydrophobicContact CD1-CG2 4.43Å; L313-V317 WeakPolarHBondContact O-CG2 3.48Å; L313-V317 PolarHBondContact O-N 3.32Å |
| 314 | M | 77.1 | Confident | 75.9 | Confident | 21 Ų | 21 | 59.6 Ų | 59.6 | 10% | 0.103 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.1 | -45.5 | 177.2 | -66.1 | -79.7 | -78.8 | 0 | 0 | 110.7 | P310 L316 V317 T318 F325 M329 D330 | P310-M314 WeakPolarHBondContact O-CB 3.35Å; P310-M314 WeakPolarHBondContact O-CG 3.07Å; P310-M314 PolarHBondContact O-N 3.01Å; M314-L316 VanDerWaalsContact C-N 3.34Å; M314-L316 PolarHBondContact O-N 3.39Å; M314-V317 PolarHBondContact O-N 3.48Å; M314-T318 PolarHBondContact O-N 3.43Å; M314-T318 PolarHBondContact O-OG1 3.03Å; M314-T318 VanDerWaalsContact O-OG1 3.12Å; M314-F325 HydrophobicContact CB-CD2 4.48Å; M314-F325 HydrophobicContact CB-CE2 4.23Å; M314-F325 HydrophobicContact CE-CB 3.42Å; M314-F325 VanDerWaalsContact CE-CB 3.42Å; M314-F325 HydrophobicContact CE-CD1 3.47Å; M314-F325 VanDerWaalsContact CE-CD1 3.47Å; M314-F325 HydrophobicContact CE-CD2 3.49Å; M314-F325 VanDerWaalsContact CE-CD2 3.49Å; M314-F325 HydrophobicContact CE-CE1 4.03Å; M314-F325 HydrophobicContact CE-CE2 4.04Å; M314-F325 HydrophobicContact CE-CG 3.16Å; M314-F325 HydrophobicContact CE-CZ 4.27Å; M314-F325 HydrophobicContact SD-CD1 3.52Å; M314-F325 VanDerWaalsContact SD-CD1 3.52Å; M314-F325 HydrophobicContact SD-CD2 3.74Å; M314-F325 HydrophobicContact SD-CE1 3.4Å; M314-F325 WeakPolarHBondContact SD-CE1 3.44Å; M314-F325 HydrophobicContact SD-CE2 3.62Å; M314-F325 HydrophobicContact SD-CG 3.68Å; M314-F325 HydrophobicContact SD-CZ 3.44Å; M314-F325 WeakPolarHBondContact SD-CZ 3.4Å; M314-M329 HydrophobicContact CE-CB 3.67Å; M314-D330 WeakPolarHBondContact CE-OD1 3.41Å |
| 315 | G | 73.7 | Confident | 75.1 | Confident | 3 Ų | 3 | 61.5 Ų | 61.5 | 3% | 0.031 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -60.3 | -40.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | F230 Y311 C312 L313 A319 | F230-G315 WeakPolarHBondContact CE1-O 3.37Å; F230-G315 WeakPolarHBondContact CZ-O 3.48Å; Y311-G315 PolarHBondContact O-N 3.41Å; Y311-G315 VanDerWaalsContact O-N 3.09Å; C312-G315 PolarHBondContact O-N 3.31Å; L313-G315 VanDerWaalsContact C-N 3.33Å; L313-G315 PolarHBondContact O-N 3.47Å; G315-A319 VanDerWaalsContact O-CB 3.3Å; G315-A319 WeakPolarHBondContact O-CB 3.48Å; G315-A319 PolarHBondContact O-N 3.27Å |
| 316 | L | 77.1 | Confident | 74.4 | Confident | 48 Ų | 48 | 62.6 Ų | 62.6 | 25% | 0.251 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -67 | -42.9 | 177.4 | -171.8 | 65.6 | 0 | 0 | 0 | 111.9 | I246 C312 L313 M314 A319 I320 | I246-L316 HydrophobicContact CD1-CB 4.46Å; C312-L316 WeakPolarHBondContact O-CB 3.14Å; C312-L316 PolarHBondContact O-N 2.94Å; L313-L316 PolarHBondContact O-N 3.03Å; M314-L316 VanDerWaalsContact C-N 3.34Å; M314-L316 PolarHBondContact O-N 3.39Å; L316-A319 PolarHBondContact O-N 3.24Å; L316-I320 HydrophobicContact CD1-CD1 3.77Å; L316-I320 HydrophobicContact CD1-CG1 4.28Å; L316-I320 HydrophobicContact CD2-CD1 4.37Å; L316-I320 HydrophobicContact CG-CD1 3.7Å; L316-I320 HydrophobicContact CG-CG1 4.46Å; L316-I320 WeakPolarHBondContact O-CB 3.45Å; L316-I320 VanDerWaalsContact O-CG1 3.3Å; L316-I320 WeakPolarHBondContact O-CG1 3.46Å; L316-I320 PolarHBondContact O-N 3.12Å |
| 317 | V | 77 | Confident | 73.5 | Confident | 57 Ų | 57 | 63.1 Ų | 63.1 | 35% | 0.345 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -64.6 | -41.9 | 178.2 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | L313 M314 A319 I320 G321 F325 | L313-V317 HydrophobicContact CD1-CG2 4.43Å; L313-V317 WeakPolarHBondContact O-CG2 3.48Å; L313-V317 PolarHBondContact O-N 3.32Å; M314-V317 PolarHBondContact O-N 3.48Å; V317-A319 VanDerWaalsContact C-N 3.3Å; V317-A319 PolarHBondContact O-N 3.29Å; V317-I320 PolarHBondContact O-N 3.23Å; V317-G321 WeakPolarHBondContact O-CA 3.39Å; V317-G321 PolarHBondContact O-N 3.2Å; V317-G321 VanDerWaalsContact O-O 3.08Å; V317-F325 HydrophobicContact CB-CE2 3.95Å; V317-F325 HydrophobicContact CB-CZ 3.8Å; V317-F325 HydrophobicContact CG1-CE2 3.86Å; V317-F325 HydrophobicContact CG1-CZ 3.53Å; V317-F325 HydrophobicContact CG2-CZ 4.46Å |
| 318 | T | 71.2 | Confident | 72.7 | Confident | 38 Ų | 38 | 65.2 Ų | 65.2 | 23% | 0.233 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -69.2 | -27.4 | 175.6 | -57.9 | 0 | 0 | 0 | 0 | 112.8 | F230 M314 G321 F325 | F230-T318 HydrophobicContact CB-CG2 3.75Å; F230-T318 HydrophobicContact CG-CG2 4.11Å; M314-T318 PolarHBondContact O-N 3.43Å; M314-T318 PolarHBondContact O-OG1 3.03Å; M314-T318 VanDerWaalsContact O-OG1 3.12Å; T318-G321 CarbonylContact C-O 3.43Å; T318-G321 WeakPolarHBondContact CA-O 3.34Å; T318-F325 WeakPolarHBondContact OG1-CE2 3.37Å |
| 319 | A | 66.8 | Low | 72.1 | Confident | 18 Ų | 18 | 68.7 Ų | 68.7 | 15% | 0.149 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -76.1 | -37.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | F230 T239 I243 G315 L316 V317 | F230-A319 HydrophobicContact CD1-CB 4.03Å; F230-A319 HydrophobicContact CE1-CB 3.89Å; T239-A319 HydrophobicContact CG2-CB 4.14Å; T239-A319 WeakPolarHBondContact CG2-O 3.38Å; I243-A319 HydrophobicContact CD1-CB 4.16Å; I243-A319 HydrophobicContact CG1-CB 3.76Å; G315-A319 VanDerWaalsContact O-CB 3.3Å; G315-A319 WeakPolarHBondContact O-CB 3.48Å; G315-A319 PolarHBondContact O-N 3.27Å; L316-A319 PolarHBondContact O-N 3.24Å; V317-A319 VanDerWaalsContact C-N 3.3Å; V317-A319 PolarHBondContact O-N 3.29Å |
| 320 | I | 71.3 | Confident | 71.5 | Confident | 129 Ų | 129 | 69.6 Ų | 69.6 | 66% | 0.662 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -85.8 | -36.4 | -177.1 | -64 | 172.8 | 0 | 0 | 0 | 111.5 | L316 V317 | L316-I320 HydrophobicContact CD1-CD1 3.77Å; L316-I320 HydrophobicContact CD1-CG1 4.28Å; L316-I320 HydrophobicContact CD2-CD1 4.37Å; L316-I320 HydrophobicContact CG-CD1 3.7Å; L316-I320 HydrophobicContact CG-CG1 4.46Å; L316-I320 WeakPolarHBondContact O-CB 3.45Å; L316-I320 VanDerWaalsContact O-CG1 3.3Å; L316-I320 WeakPolarHBondContact O-CG1 3.46Å; L316-I320 PolarHBondContact O-N 3.12Å; V317-I320 PolarHBondContact O-N 3.23Å |
| 321 | G | 62.5 | Low | 71 | Confident | 30 Ų | 30 | 68 Ų | 68 | 31% | 0.309 | 36% | 0.356 | S | S | . | . | S | Bend | trans | -124.1 | 145.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | V317 T318 Y323 | V317-G321 WeakPolarHBondContact O-CA 3.39Å; V317-G321 PolarHBondContact O-N 3.2Å; V317-G321 VanDerWaalsContact O-O 3.08Å; T318-G321 CarbonylContact C-O 3.43Å; T318-G321 WeakPolarHBondContact CA-O 3.34Å; G321-Y323 PolarHBondContact O-N 2.91Å |
| 322 | N | 60.9 | Low | 70.9 | Confident | 145 Ų | 145 | 69 Ų | 69 | 78% | 0.775 | 37% | 0.366 | S | S | * | . | trans | -71.2 | 35.5 | 170.2 | -72.2 | -39.8 | 0 | 0 | 0 | 112.5 | ||||
| 323 | Y | 64.2 | Low | 70.8 | Confident | 150 Ų | 150 | 68.6 Ų | 68.6 | 59% | 0.588 | 36% | 0.364 | S | S | * | . | P | Polyproline II helix | trans | -82.4 | 124.4 | 177.8 | -161.6 | -96.5 | 0 | 0 | 0 | 109.5 | G321 F325 | G321-Y323 PolarHBondContact O-N 2.91Å; Y323-F325 HydrophobicContact CD1-CD1 4.02Å; Y323-F325 AromaticContact CD1-CE1 3.9Å; Y323-F325 HydrophobicContact CD1-CE1 3.9Å; Y323-F325 HydrophobicContact CD1-CG 4.4Å; Y323-F325 HydrophobicContact CD1-CZ 4.16Å; Y323-F325 HydrophobicContact CE1-CD1 4.01Å; Y323-F325 HydrophobicContact CE1-CE1 4.04Å |
| 324 | R | 61.5 | Low | 70.6 | Confident | 196 Ų | 196 | 63.4 Ų | 63.4 | 74% | 0.74 | 34% | 0.336 | S | S | * | . | P | Polyproline II helix | trans | -97.6 | 116.1 | 176.6 | -64.8 | -165.9 | -177.8 | -167.6 | 4.3 | 108.8 | ||
| 325 | F | 66.1 | Low | 70.8 | Confident | 49 Ų | 49 | 64.1 Ų | 64.1 | 22% | 0.215 | 34% | 0.338 | C | S | . | . | P | Polyproline II helix | trans | -73.9 | 156.9 | 173.5 | -67.8 | -74.6 | 0 | 0 | 0 | 111.5 | M314 V317 T318 Y323 | M314-F325 HydrophobicContact CB-CD2 4.48Å; M314-F325 HydrophobicContact CB-CE2 4.23Å; M314-F325 HydrophobicContact CE-CB 3.42Å; M314-F325 VanDerWaalsContact CE-CB 3.42Å; M314-F325 HydrophobicContact CE-CD1 3.47Å; M314-F325 VanDerWaalsContact CE-CD1 3.47Å; M314-F325 HydrophobicContact CE-CD2 3.49Å; M314-F325 VanDerWaalsContact CE-CD2 3.49Å; M314-F325 HydrophobicContact CE-CE1 4.03Å; M314-F325 HydrophobicContact CE-CE2 4.04Å; M314-F325 HydrophobicContact CE-CG 3.16Å; M314-F325 HydrophobicContact CE-CZ 4.27Å; M314-F325 HydrophobicContact SD-CD1 3.52Å; M314-F325 VanDerWaalsContact SD-CD1 3.52Å; M314-F325 HydrophobicContact SD-CD2 3.74Å; M314-F325 HydrophobicContact SD-CE1 3.4Å; M314-F325 WeakPolarHBondContact SD-CE1 3.44Å; M314-F325 HydrophobicContact SD-CE2 3.62Å; M314-F325 HydrophobicContact SD-CG 3.68Å; M314-F325 HydrophobicContact SD-CZ 3.44Å; M314-F325 WeakPolarHBondContact SD-CZ 3.4Å; V317-F325 HydrophobicContact CB-CE2 3.95Å; V317-F325 HydrophobicContact CB-CZ 3.8Å; V317-F325 HydrophobicContact CG1-CE2 3.86Å; V317-F325 HydrophobicContact CG1-CZ 3.53Å; V317-F325 HydrophobicContact CG2-CZ 4.46Å; T318-F325 WeakPolarHBondContact OG1-CE2 3.37Å; Y323-F325 HydrophobicContact CD1-CD1 4.02Å; Y323-F325 AromaticContact CD1-CE1 3.9Å; Y323-F325 HydrophobicContact CD1-CE1 3.9Å; Y323-F325 HydrophobicContact CD1-CG 4.4Å; Y323-F325 HydrophobicContact CD1-CZ 4.16Å; Y323-F325 HydrophobicContact CE1-CD1 4.01Å; Y323-F325 HydrophobicContact CE1-CE1 4.04Å |
| 326 | N | 69.1 | Low | 71.3 | Confident | 95 Ų | 95 | 67 Ų | 67 | 51% | 0.508 | 35% | 0.352 | S | S | . | . | P | Polyproline II helix | trans | -64.4 | 133 | 173.3 | -175.7 | -18 | 0 | 0 | 0 | 109 | A328 M329 D330 | N326-A328 PolarHBondContact O-N 3.4Å; N326-A328 PolarHBondContact OD1-N 3.27Å; N326-M329 HydrophobicContact CB-CG 4.33Å; N326-M329 WeakPolarHBondContact O-CB 3.46Å; N326-M329 PolarHBondContact O-N 3.37Å; N326-D330 PolarHBondContact O-N 3.17Å |
| 327 | P | 67.7 | Low | 71.6 | Confident | 83 Ų | 83 | 65 Ų | 65 | 54% | 0.539 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -48.7 | -30.6 | 177.4 | -31 | 34.5 | 0 | 0 | 0 | 115.3 | M329 D330 T331 | P327-M329 VanDerWaalsContact C-N 3.34Å; P327-M329 PolarHBondContact O-N 3.41Å; P327-D330 PolarHBondContact O-N 3.03Å; P327-T331 WeakPolarHBondContact O-CB 3.24Å; P327-T331 PolarHBondContact O-N 2.98Å; P327-T331 VanDerWaalsContact O-N 3.07Å; P327-T331 PolarHBondContact O-OG1 2.99Å |
| 328 | A | 67.9 | Low | 72 | Confident | 53 Ų | 53 | 62.9 Ų | 62.9 | 44% | 0.438 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.5 | -37 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | N326 T331 V332 | N326-A328 PolarHBondContact O-N 3.4Å; N326-A328 PolarHBondContact OD1-N 3.27Å; A328-T331 WeakPolarHBondContact O-CB 3.31Å; A328-T331 PolarHBondContact O-N 3.17Å; A328-V332 VanDerWaalsContact O-CG2 3.29Å; A328-V332 WeakPolarHBondContact O-CG2 3.47Å; A328-V332 PolarHBondContact O-N 3.14Å |
| 329 | M | 70.9 | Confident | 72.7 | Confident | 97 Ų | 97 | 62.2 Ų | 62.2 | 48% | 0.478 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -70.4 | -39.5 | 179.2 | -65.8 | -63.3 | -67.2 | 0 | 0 | 111.8 | M314 N326 P327 T331 V332 A333 | M314-M329 HydrophobicContact CE-CB 3.67Å; N326-M329 HydrophobicContact CB-CG 4.33Å; N326-M329 WeakPolarHBondContact O-CB 3.46Å; N326-M329 PolarHBondContact O-N 3.37Å; P327-M329 VanDerWaalsContact C-N 3.34Å; P327-M329 PolarHBondContact O-N 3.41Å; M329-T331 VanDerWaalsContact C-N 3.33Å; M329-V332 PolarHBondContact O-N 2.97Å; M329-A333 WeakPolarHBondContact O-CB 3.49Å; M329-A333 PolarHBondContact O-N 3.38Å |
| 330 | D | 69.9 | Low | 73.6 | Confident | 48 Ų | 48 | 61.5 Ų | 61.5 | 26% | 0.257 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.8 | -43.1 | 175 | -68.5 | -16.2 | 0 | 0 | 0 | 110.5 | M314 N326 P327 V332 A333 V334 | M314-D330 WeakPolarHBondContact CE-OD1 3.41Å; N326-D330 PolarHBondContact O-N 3.17Å; P327-D330 PolarHBondContact O-N 3.03Å; D330-V332 PolarHBondContact O-N 3.05Å; D330-A333 PolarHBondContact O-N 2.89Å; D330-V334 WeakPolarHBondContact O-CG2 3.3Å; D330-V334 PolarHBondContact O-N 3.24Å |
| 331 | T | 73.3 | Confident | 74.3 | Confident | 10 Ų | 10 | 55.7 Ų | 55.7 | 6% | 0.061 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -55.2 | -52 | 174.7 | -56.3 | 0 | 0 | 0 | 0 | 111.3 | Y224 P327 A328 M329 A333 V334 W335 | Y224-T331 HydrophobicContact CE2-CG2 3.75Å; Y224-T331 WeakPolarHBondContact CE2-OG1 3.34Å; Y224-T331 WeakPolarHBondContact OH-CG2 3.37Å; P327-T331 WeakPolarHBondContact O-CB 3.24Å; P327-T331 PolarHBondContact O-N 2.98Å; P327-T331 VanDerWaalsContact O-N 3.07Å; P327-T331 PolarHBondContact O-OG1 2.99Å; A328-T331 WeakPolarHBondContact O-CB 3.31Å; A328-T331 PolarHBondContact O-N 3.17Å; M329-T331 VanDerWaalsContact C-N 3.33Å; T331-A333 PolarHBondContact O-N 3.06Å; T331-V334 PolarHBondContact O-N 3.2Å; T331-W335 HydrophobicContact CG2-CD2 4.25Å; T331-W335 HydrophobicContact CG2-CH2 4.04Å; T331-W335 HydrophobicContact CG2-CZ2 3.43Å; T331-W335 VanDerWaalsContact CG2-CZ2 3.43Å; T331-W335 VanDerWaalsContact O-CD1 3.25Å; T331-W335 VanDerWaalsContact O-CG 3.32Å; T331-W335 PolarHBondContact O-N 3.13Å |
| 332 | V | 77.5 | Confident | 75.5 | Confident | 57 Ų | 57 | 54.4 Ų | 54.4 | 35% | 0.345 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64.7 | -40.7 | -178.8 | 171.3 | 0 | 0 | 0 | 0 | 111.3 | A328 M329 D330 W335 M336 | A328-V332 VanDerWaalsContact O-CG2 3.29Å; A328-V332 WeakPolarHBondContact O-CG2 3.47Å; A328-V332 PolarHBondContact O-N 3.14Å; M329-V332 PolarHBondContact O-N 2.97Å; D330-V332 PolarHBondContact O-N 3.05Å; V332-W335 PolarHBondContact O-N 2.96Å; V332-M336 HydrophobicContact CG1-CE 3.63Å; V332-M336 WeakPolarHBondContact O-CG 3.33Å; V332-M336 PolarHBondContact O-N 3.24Å |
| 333 | A | 78.8 | Confident | 76.8 | Confident | 4 Ų | 4 | 48.9 Ų | 48.9 | 3% | 0.033 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.8 | -41.4 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | M329 D330 T331 M336 A337 | M329-A333 WeakPolarHBondContact O-CB 3.49Å; M329-A333 PolarHBondContact O-N 3.38Å; D330-A333 PolarHBondContact O-N 2.89Å; T331-A333 PolarHBondContact O-N 3.06Å; A333-M336 PolarHBondContact O-N 2.96Å; A333-A337 PolarHBondContact O-N 3.36Å |
| 334 | V | 78.4 | Confident | 77.7 | Confident | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -63.1 | -44.4 | 174.9 | 171.8 | 0 | 0 | 0 | 0 | 111.4 | Y224 M227 Y228 Y311 D330 T331 M336 A337 W338 | Y224-V334 HydrophobicContact CD1-CB 4.26Å; Y224-V334 HydrophobicContact CD1-CG1 3.94Å; Y224-V334 HydrophobicContact CD1-CG2 4.11Å; Y224-V334 HydrophobicContact CE1-CB 4.22Å; Y224-V334 HydrophobicContact CE1-CG1 3.9Å; Y224-V334 HydrophobicContact CG-CG2 4.41Å; M227-V334 HydrophobicContact CE-CG1 4.06Å; M227-V334 HydrophobicContact CE-CG2 4.42Å; M227-V334 HydrophobicContact SD-CB 4.49Å; M227-V334 HydrophobicContact SD-CG1 3.56Å; M227-V334 VanDerWaalsContact SD-CG1 3.56Å; M227-V334 HydrophobicContact SD-CG2 4.09Å; Y228-V334 HydrophobicContact CD2-CG2 4.44Å; Y228-V334 HydrophobicContact CE2-CG2 3.28Å; Y228-V334 VanDerWaalsContact OH-CG2 3.25Å; Y228-V334 WeakPolarHBondContact OH-CG2 3.39Å; Y311-V334 HydrophobicContact CE2-CG2 4.27Å; D330-V334 WeakPolarHBondContact O-CG2 3.3Å; D330-V334 PolarHBondContact O-N 3.24Å; T331-V334 PolarHBondContact O-N 3.2Å; V334-M336 VanDerWaalsContact C-N 3.32Å; V334-M336 PolarHBondContact O-N 3.08Å; V334-A337 WeakPolarHBondContact O-CB 3.41Å; V334-A337 PolarHBondContact O-N 3.49Å; V334-A337 VanDerWaalsContact O-N 3.15Å; V334-W338 HydrophobicContact CG1-CD2 3.77Å; V334-W338 HydrophobicContact CG1-CE3 3.81Å; V334-W338 HydrophobicContact CG1-CH2 3.37Å; V334-W338 HydrophobicContact CG1-CZ2 3.36Å; V334-W338 HydrophobicContact CG1-CZ3 3.62Å; V334-W338 PolarHBondContact O-N 3.21Å |
| 335 | W | 82.1 | Confident | 78.8 | Confident | 36 Ų | 36 | 33 Ų | 33 | 14% | 0.136 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -65.1 | -39 | 179.5 | -67.8 | 5.4 | 0 | 0 | 0 | 112.1 | Q76 V79 L80 Y224 T331 V332 A337 W338 A339 | Q76-W335 VanDerWaalsContact CA-CH2 3.47Å; Q76-W335 HydrophobicContact CB-CH2 3.4Å; Q76-W335 VanDerWaalsContact CB-CH2 3.4Å; Q76-W335 HydrophobicContact CB-CZ2 3.54Å; Q76-W335 HydrophobicContact CG-CH2 3.44Å; Q76-W335 VanDerWaalsContact CG-CH2 3.44Å; Q76-W335 HydrophobicContact CG-CZ2 3.82Å; V79-W335 HydrophobicContact CB-CZ3 4.46Å; V79-W335 HydrophobicContact CG1-CE3 3.99Å; V79-W335 HydrophobicContact CG1-CZ3 4.32Å; L80-W335 HydrophobicContact CD2-CG 4.35Å; Y224-W335 AromaticContact CZ-NE1 3.83Å; Y224-W335 PolarHBondContact OH-NE1 3.14Å; T331-W335 HydrophobicContact CG2-CD2 4.25Å; T331-W335 HydrophobicContact CG2-CH2 4.04Å; T331-W335 HydrophobicContact CG2-CZ2 3.43Å; T331-W335 VanDerWaalsContact CG2-CZ2 3.43Å; T331-W335 VanDerWaalsContact O-CD1 3.25Å; T331-W335 VanDerWaalsContact O-CG 3.32Å; T331-W335 PolarHBondContact O-N 3.13Å; V332-W335 PolarHBondContact O-N 2.96Å; W335-A337 VanDerWaalsContact C-N 3.3Å; W335-A337 PolarHBondContact O-N 2.98Å; W335-W338 PolarHBondContact O-N 2.99Å; W335-A339 WeakPolarHBondContact O-CB 3.07Å; W335-A339 PolarHBondContact O-N 3.07Å |
| 336 | M | 83.8 | Confident | 79.5 | Confident | 65 Ų | 65 | 34.3 Ų | 34.3 | 32% | 0.32 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -60 | -41.9 | 172.6 | -78.1 | -154.3 | -117.1 | 0 | 0 | 111.4 | C307 P310 V332 A333 V334 W338 A339 N340 | C307-M336 WeakPolarHBondContact CB-O 3.32Å; C307-M336 CarbonylContact O-C 3.38Å; C307-M336 PolarHBondContact SG-O 3.45Å; C307-M336 VanDerWaalsContact SG-O 3.37Å; P310-M336 HydrophobicContact CG-CE 4.26Å; P310-M336 HydrophobicContact CG-SD 4.18Å; V332-M336 HydrophobicContact CG1-CE 3.63Å; V332-M336 WeakPolarHBondContact O-CG 3.33Å; V332-M336 PolarHBondContact O-N 3.24Å; A333-M336 PolarHBondContact O-N 2.96Å; V334-M336 VanDerWaalsContact C-N 3.32Å; V334-M336 PolarHBondContact O-N 3.08Å; M336-W338 PolarHBondContact O-N 3.33Å; M336-A339 PolarHBondContact O-N 3.16Å; M336-N340 PolarHBondContact O-N 3.18Å |
| 337 | A | 82.9 | Confident | 80.1 | Confident | 4 Ų | 4 | 30.5 Ų | 30.5 | 3% | 0.033 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -63 | -41.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | C307 W308 Y311 A333 V334 W335 N340 | C307-A337 PolarHBondContact O-N 3.21Å; W308-A337 HydrophobicContact CD2-CB 4.38Å; W308-A337 HydrophobicContact CE3-CB 4.32Å; W308-A337 HydrophobicContact CZ3-CB 4.4Å; Y311-A337 HydrophobicContact CD2-CB 4.4Å; Y311-A337 HydrophobicContact CG-CB 4.48Å; A333-A337 PolarHBondContact O-N 3.36Å; V334-A337 WeakPolarHBondContact O-CB 3.41Å; V334-A337 PolarHBondContact O-N 3.49Å; V334-A337 VanDerWaalsContact O-N 3.15Å; W335-A337 VanDerWaalsContact C-N 3.3Å; W335-A337 PolarHBondContact O-N 2.98Å; A337-N340 WeakPolarHBondContact O-CB 3.32Å; A337-N340 PolarHBondContact O-N 3.28Å |
| 338 | W | 85 | Confident | 80.6 | Confident | 13 Ų | 13 | 28.2 Ų | 28.2 | 5% | 0.049 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -72.1 | -31.7 | 176.5 | -67.6 | -19.4 | 0 | 0 | 0 | 113.8 | L80 I83 L127 S130 N155 Y224 M227 V334 W335 M336 N340 G341 | L80-W338 HydrophobicContact CD2-CE3 3.67Å; L80-W338 HydrophobicContact CD2-CZ3 3.68Å; I83-W338 HydrophobicContact CG2-CB 4.31Å; L127-W338 HydrophobicContact CD2-CB 3.91Å; L127-W338 HydrophobicContact CD2-CD2 3.33Å; L127-W338 HydrophobicContact CD2-CE3 3.46Å; L127-W338 VanDerWaalsContact CD2-CE3 3.46Å; L127-W338 HydrophobicContact CD2-CG 3.55Å; L127-W338 HydrophobicContact CD2-CZ3 4.18Å; S130-W338 WeakPolarHBondContact OG-CH2 3.11Å; S130-W338 WeakPolarHBondContact OG-CZ2 3.17Å; N155-W338 PolarHBondContact ND2-NE1 3.45Å; Y224-W338 HydrophobicContact CD1-CH2 4.3Å; Y224-W338 HydrophobicContact CE1-CH2 4.01Å; Y224-W338 HydrophobicContact CE1-CZ3 4.24Å; M227-W338 HydrophobicContact CE-CZ2 4.41Å; M227-W338 HydrophobicContact SD-CH2 4.41Å; M227-W338 HydrophobicContact SD-CZ2 3.45Å; M227-W338 WeakPolarHBondContact SD-CZ2 3.37Å; V334-W338 HydrophobicContact CG1-CD2 3.77Å; V334-W338 HydrophobicContact CG1-CE3 3.81Å; V334-W338 HydrophobicContact CG1-CH2 3.37Å; V334-W338 HydrophobicContact CG1-CZ2 3.36Å; V334-W338 HydrophobicContact CG1-CZ3 3.62Å; V334-W338 PolarHBondContact O-N 3.21Å; W335-W338 PolarHBondContact O-N 2.99Å; M336-W338 PolarHBondContact O-N 3.33Å; W338-N340 PolarHBondContact O-N 3.45Å; W338-G341 PolarHBondContact O-N 3.5Å; W338-G341 VanDerWaalsContact O-N 3.13Å |
| 339 | A | 86.6 | Confident | 80.7 | Confident | 25 Ų | 25 | 27.3 Ų | 27.3 | 21% | 0.207 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -59.6 | -27.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | I83 W335 M336 G341 A342 I343 | I83-A339 HydrophobicContact CD1-CB 4.41Å; W335-A339 WeakPolarHBondContact O-CB 3.07Å; W335-A339 PolarHBondContact O-N 3.07Å; M336-A339 PolarHBondContact O-N 3.16Å; A339-G341 PolarHBondContact O-N 3.37Å; A339-A342 PolarHBondContact O-N 2.9Å; A339-I343 WeakPolarHBondContact O-CG1 3.29Å; A339-I343 PolarHBondContact O-N 2.89Å; A339-I343 VanDerWaalsContact O-N 3.11Å |
| 340 | N | 86.1 | Confident | 80.6 | Confident | 3 Ų | 3 | 28.3 Ų | 28.3 | 2% | 0.016 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -50.5 | -43.3 | 173.5 | -175.9 | 64.1 | 0 | 0 | 0 | 112.6 | C307 W308 M336 A337 W338 A342 I343 | C307-N340 HydrophobicContact CB-CB 3.92Å; W308-N340 PolarHBondContact NE1-ND2 3.42Å; W308-N340 VanDerWaalsContact NE1-ND2 3.18Å; M336-N340 PolarHBondContact O-N 3.18Å; A337-N340 WeakPolarHBondContact O-CB 3.32Å; A337-N340 PolarHBondContact O-N 3.28Å; W338-N340 PolarHBondContact O-N 3.45Å; N340-A342 VanDerWaalsContact C-N 3.3Å; N340-A342 PolarHBondContact O-N 3.4Å; N340-I343 PolarHBondContact O-N 3.3Å |
| 341 | G | 85.5 | Confident | 80.3 | Confident | 6 Ų | 6 | 28 Ų | 28 | 6% | 0.062 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66.7 | -29.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | N91 W338 A339 P345 | N91-G341 PolarHBondContact ND2-O 3.36Å; W338-G341 PolarHBondContact O-N 3.5Å; W338-G341 VanDerWaalsContact O-N 3.13Å; A339-G341 PolarHBondContact O-N 3.37Å; G341-P345 WeakPolarHBondContact O-CD 3.32Å |
| 342 | A | 87.5 | Confident | 79.5 | Confident | 4 Ų | 4 | 30.7 Ų | 30.7 | 3% | 0.033 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -81 | -25.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | I83 L86 A339 N340 | I83-A342 HydrophobicContact CG2-CB 4.45Å; L86-A342 HydrophobicContact CB-CB 4.1Å; L86-A342 HydrophobicContact CD2-CB 3.84Å; L86-A342 HydrophobicContact CG-CB 3.96Å; A339-A342 PolarHBondContact O-N 2.9Å; N340-A342 VanDerWaalsContact C-N 3.3Å; N340-A342 PolarHBondContact O-N 3.4Å |
| 343 | I | 87.1 | Confident | 78.3 | Confident | 29 Ų | 29 | 30.7 Ų | 30.7 | 15% | 0.149 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -73.7 | -35.2 | -178.4 | -70.8 | 163.9 | 0 | 0 | 0 | 111.7 | F303 C307 A339 N340 L346 I347 | F303-I343 HydrophobicContact CB-CD1 4.4Å; F303-I343 HydrophobicContact CB-CG2 3.99Å; F303-I343 HydrophobicContact CD1-CD1 4.03Å; F303-I343 HydrophobicContact CD1-CG2 4.25Å; F303-I343 HydrophobicContact CD2-CG2 3.97Å; F303-I343 HydrophobicContact CG-CD1 4.42Å; F303-I343 HydrophobicContact CG-CG2 3.81Å; C307-I343 VanDerWaalsContact SG-CD1 3.52Å; A339-I343 WeakPolarHBondContact O-CG1 3.29Å; A339-I343 PolarHBondContact O-N 2.89Å; A339-I343 VanDerWaalsContact O-N 3.11Å; N340-I343 PolarHBondContact O-N 3.3Å; I343-L346 WeakPolarHBondContact O-CB 3.3Å; I343-L346 PolarHBondContact O-N 2.8Å; I343-L346 VanDerWaalsContact O-N 3.14Å; I343-I347 HydrophobicContact CG2-CD1 3.46Å; I343-I347 VanDerWaalsContact CG2-CD1 3.46Å; I343-I347 HydrophobicContact CG2-CG1 3.92Å; I343-I347 WeakPolarHBondContact O-CG1 3.43Å; I343-I347 PolarHBondContact O-N 3.29Å |
| 344 | N | 84.7 | Confident | 76.7 | Confident | 1 Ų | 1 | 35.5 Ų | 35.5 | 1% | 0.005 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -57.2 | -51.1 | -175.1 | -69.3 | -29.2 | 0 | 0 | 0 | 113.3 | D119 M166 L346 I347 Y348 | D119-N344 PolarHBondContact OD2-ND2 3.22Å; M166-N344 VanDerWaalsContact CE-OD1 3.27Å; M166-N344 WeakPolarHBondContact CE-OD1 3.23Å; N344-L346 VanDerWaalsContact C-N 3.34Å; N344-L346 PolarHBondContact O-N 2.71Å; N344-I347 PolarHBondContact O-N 3Å; N344-Y348 HydrophobicContact CB-CE2 4.29Å; N344-Y348 WeakPolarHBondContact O-CD2 2.95Å; N344-Y348 PolarHBondContact O-N 3.49Å |
| 345 | P | 83.4 | Confident | 75.3 | Confident | 11 Ų | 11 | 38.1 Ų | 38.1 | 7% | 0.071 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.8 | -37.2 | 174.5 | -24.7 | 34.8 | 0 | 0 | 0 | 114.3 | N91 V94 G341 I347 Y348 A349 | N91-P345 HydrophobicContact CB-CG 4.4Å; N91-P345 WeakPolarHBondContact OD1-CG 3.22Å; V94-P345 HydrophobicContact CG2-CB 4.43Å; G341-P345 WeakPolarHBondContact O-CD 3.32Å; P345-I347 VanDerWaalsContact C-N 3.35Å; P345-Y348 PolarHBondContact O-N 3Å; P345-A349 WeakPolarHBondContact O-CB 3.43Å; P345-A349 PolarHBondContact O-N 3.28Å |
| 346 | L | 81.1 | Confident | 73.5 | Confident | 77 Ų | 77 | 42 Ų | 42 | 40% | 0.403 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -61.1 | -45.4 | 177.4 | -76.5 | 170.8 | 0 | 0 | 0 | 110.9 | L86 I343 N344 Y348 A349 L350 | L86-L346 HydrophobicContact CD1-CD2 4.38Å; L86-L346 HydrophobicContact CD1-CG 4.38Å; L86-L346 HydrophobicContact CD2-CD1 3.68Å; L86-L346 HydrophobicContact CD2-CG 4.13Å; I343-L346 WeakPolarHBondContact O-CB 3.3Å; I343-L346 PolarHBondContact O-N 2.8Å; I343-L346 VanDerWaalsContact O-N 3.14Å; N344-L346 VanDerWaalsContact C-N 3.34Å; N344-L346 PolarHBondContact O-N 2.71Å; L346-Y348 VanDerWaalsContact C-N 3.33Å; L346-Y348 PolarHBondContact O-N 3.49Å; L346-A349 PolarHBondContact O-N 2.6Å; L346-L350 WeakPolarHBondContact O-CB 3.19Å; L346-L350 VanDerWaalsContact O-CG 3.23Å; L346-L350 WeakPolarHBondContact O-CG 3.19Å; L346-L350 PolarHBondContact O-N 3.32Å |
| 347 | I | 82.6 | Confident | 71.5 | Confident | 14 Ų | 14 | 43.3 Ų | 43.3 | 7% | 0.072 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.8 | -44.8 | 178.2 | -65.7 | 171.7 | 0 | 0 | 0 | 110.4 | T296 I299 M300 F303 I343 N344 P345 R351 | T296-I347 HydrophobicContact CG2-CG2 3.47Å; T296-I347 VanDerWaalsContact CG2-CG2 3.47Å; I299-I347 HydrophobicContact CG2-CD1 4.12Å; I299-I347 HydrophobicContact CG2-CG1 4.38Å; M300-I347 HydrophobicContact CB-CD1 4.34Å; M300-I347 HydrophobicContact CG-CD1 3.53Å; M300-I347 HydrophobicContact CG-CG2 4.04Å; M300-I347 HydrophobicContact SD-CG2 4.44Å; F303-I347 HydrophobicContact CD2-CD1 3.82Å; F303-I347 HydrophobicContact CE2-CD1 4.34Å; I343-I347 HydrophobicContact CG2-CD1 3.46Å; I343-I347 VanDerWaalsContact CG2-CD1 3.46Å; I343-I347 HydrophobicContact CG2-CG1 3.92Å; I343-I347 WeakPolarHBondContact O-CG1 3.43Å; I343-I347 PolarHBondContact O-N 3.29Å; N344-I347 PolarHBondContact O-N 3Å; P345-I347 VanDerWaalsContact C-N 3.35Å; I347-R351 WeakPolarHBondContact O-CB 2.91Å; I347-R351 PolarHBondContact O-N 3.5Å; I347-R351 VanDerWaalsContact O-N 3.13Å |
| 348 | Y | 76.6 | Confident | 69.6 | Low | 36 Ų | 36 | 48.3 Ų | 48.3 | 14% | 0.141 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 178.2 | -58.3 | -38.9 | 0 | 0 | 0 | 112.6 | V94 I112 L115 M300 N344 P345 L346 R351 N352 | V94-Y348 HydrophobicContact CG1-CD2 4.43Å; V94-Y348 HydrophobicContact CG2-CD2 3.99Å; I112-Y348 HydrophobicContact CG2-CD2 4.47Å; I112-Y348 HydrophobicContact CG2-CE1 4.4Å; I112-Y348 HydrophobicContact CG2-CE2 3.75Å; L115-Y348 WeakPolarHBondContact CD2-OH 3.4Å; M300-Y348 HydrophobicContact CE-CE1 4.04Å; M300-Y348 WeakPolarHBondContact CE-OH 3.43Å; M300-Y348 HydrophobicContact SD-CE1 3.82Å; N344-Y348 HydrophobicContact CB-CE2 4.29Å; N344-Y348 WeakPolarHBondContact O-CD2 2.95Å; N344-Y348 PolarHBondContact O-N 3.49Å; P345-Y348 PolarHBondContact O-N 3Å; L346-Y348 VanDerWaalsContact C-N 3.33Å; L346-Y348 PolarHBondContact O-N 3.49Å; Y348-R351 PolarHBondContact O-N 3.43Å; Y348-N352 WeakPolarHBondContact O-CB 3.26Å; Y348-N352 PolarHBondContact O-N 2.9Å; Y348-N352 VanDerWaalsContact O-N 3.13Å |
| 349 | A | 71.8 | Confident | 67.7 | Low | 33 Ų | 33 | 53 Ų | 53 | 27% | 0.273 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -66.7 | -43.3 | 179 | 0 | 0 | 0 | 0 | 0 | 112.4 | P345 L346 R351 I355 | P345-A349 WeakPolarHBondContact O-CB 3.43Å; P345-A349 PolarHBondContact O-N 3.28Å; L346-A349 PolarHBondContact O-N 2.6Å; A349-R351 VanDerWaalsContact C-N 3.3Å; A349-R351 PolarHBondContact O-N 2.78Å; A349-I355 HydrophobicContact CB-CG2 4.44Å |
| 350 | L | 68.2 | Low | 65.8 | Low | 118 Ų | 118 | 53.3 Ų | 53.3 | 62% | 0.618 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -66.4 | -33.8 | 179.1 | -71.5 | 172.2 | 0 | 0 | 0 | 112.2 | L346 | L346-L350 WeakPolarHBondContact O-CB 3.19Å; L346-L350 VanDerWaalsContact O-CG 3.23Å; L346-L350 WeakPolarHBondContact O-CG 3.19Å; L346-L350 PolarHBondContact O-N 3.32Å |
| 351 | R | 64.1 | Low | 63.9 | Low | 43 Ų | 43 | 58.6 Ų | 58.6 | 16% | 0.162 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -87.8 | -21.9 | -175.5 | -164.4 | 171.2 | 176.6 | 126.7 | 145.9 | 114.4 | R292 T295 T296 I347 Y348 A349 P353 | R292-R351 PolarHBondContact NE-O 3.46Å; R292-R351 PolarHBondContact NH2-O 2.72Å; R292-R351 PolarHBondContact O-NE 3.37Å; R292-R351 PolarHBondContact O-NH1 3.32Å; T295-R351 VanDerWaalsContact CB-NH1 3.29Å; T295-R351 PolarHBondContact O-NH2 2.79Å; T296-R351 VanDerWaalsContact CA-CZ 3.43Å; T296-R351 VanDerWaalsContact CB-CZ 3.49Å; T296-R351 HydrophobicContact CG2-CB 4.43Å; T296-R351 HydrophobicContact CG2-CG 4.4Å; T296-R351 VanDerWaalsContact N-NH2 3.11Å; T296-R351 WeakPolarHBondContact OG1-CD 3.34Å; T296-R351 PolarHBondContact OG1-NE 3.31Å; T296-R351 PolarHBondContact OG1-NH1 3.11Å; I347-R351 WeakPolarHBondContact O-CB 2.91Å; I347-R351 PolarHBondContact O-N 3.5Å; I347-R351 VanDerWaalsContact O-N 3.13Å; Y348-R351 PolarHBondContact O-N 3.43Å; A349-R351 VanDerWaalsContact C-N 3.3Å; A349-R351 PolarHBondContact O-N 2.78Å; R351-P353 WeakPolarHBondContact O-CD 2.96Å |
| 352 | N | 56.1 | Low | 62.1 | Low | 65 Ų | 65 | 62.5 Ų | 62.5 | 35% | 0.348 | 33% | 0.329 | S | S | . | . | trans | -88.1 | 105.9 | 178.1 | -152.8 | -29.3 | 0 | 0 | 0 | 109.7 | Y348 N354 I355 R356 | Y348-N352 WeakPolarHBondContact O-CB 3.26Å; Y348-N352 PolarHBondContact O-N 2.9Å; Y348-N352 VanDerWaalsContact O-N 3.13Å; N352-N354 PolarHBondContact O-N 3.4Å; N352-I355 HydrophobicContact CB-CB 4.05Å; N352-I355 HydrophobicContact CB-CD1 3.82Å; N352-I355 HydrophobicContact CB-CG1 3.9Å; N352-I355 PolarHBondContact O-N 2.81Å; N352-R356 PolarHBondContact O-N 2.84Å | ||
| 353 | P | 51.7 | Low | 60.3 | Low | 57 Ų | 57 | 72 Ų | 72 | 37% | 0.37 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -68.2 | -23.4 | -172.4 | 28.2 | -26.1 | 0 | 0 | 0 | 110.9 | R292 R351 M357 | R292-P353 VanDerWaalsContact NH2-CD 3.28Å; R351-P353 WeakPolarHBondContact O-CD 2.96Å; P353-M357 WeakPolarHBondContact O-CB 3.43Å; P353-M357 PolarHBondContact O-N 3.07Å |
| 354 | N | 45.8 | Very low | 58.4 | Low | 106 Ų | 106 | 77.1 Ų | 77.1 | 57% | 0.567 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -71.2 | -34.1 | 172.8 | -69.7 | -49.5 | 0 | 0 | 0 | 112.6 | N352 L358 | N352-N354 PolarHBondContact O-N 3.4Å; N354-L358 WeakPolarHBondContact O-CD1 3.24Å; N354-L358 VanDerWaalsContact O-CG 3.28Å; N354-L358 WeakPolarHBondContact O-CG 3.43Å; N354-L358 PolarHBondContact O-N 2.81Å |
| 355 | I | 47.9 | Very low | 56.6 | Low | 55 Ų | 55 | 82.2 Ų | 82.2 | 28% | 0.282 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -79.9 | -41.4 | 177.3 | -61 | 178.2 | 0 | 0 | 0 | 110 | A349 N352 M357 L358 L359 | A349-I355 HydrophobicContact CB-CG2 4.44Å; N352-I355 HydrophobicContact CB-CB 4.05Å; N352-I355 HydrophobicContact CB-CD1 3.82Å; N352-I355 HydrophobicContact CB-CG1 3.9Å; N352-I355 PolarHBondContact O-N 2.81Å; I355-M357 PolarHBondContact O-N 3.1Å; I355-L358 PolarHBondContact O-N 2.94Å; I355-L359 HydrophobicContact CG2-CD1 3.52Å; I355-L359 VanDerWaalsContact O-CD1 3.27Å; I355-L359 WeakPolarHBondContact O-CD1 3.11Å; I355-L359 PolarHBondContact O-N 2.95Å |
| 356 | R | 45.5 | Very low | 55 | Low | 117 Ų | 117 | 83.7 Ų | 83.7 | 44% | 0.442 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -58.7 | -35.5 | 170.2 | -153.3 | 178 | -175.2 | -141.3 | 0.8 | 111.6 | N352 G360 | N352-R356 PolarHBondContact O-N 2.84Å; R356-G360 WeakPolarHBondContact O-CA 3.34Å; R356-G360 PolarHBondContact O-N 2.82Å |
| 357 | M | 42.2 | Very low | 53.3 | Low | 93 Ų | 93 | 88.2 Ų | 88.2 | 46% | 0.458 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -73.6 | -28.9 | 172 | -169.6 | -176.7 | -63.4 | 0 | 0 | 113.1 | P353 I355 R361 | P353-M357 WeakPolarHBondContact O-CB 3.43Å; P353-M357 PolarHBondContact O-N 3.07Å; I355-M357 PolarHBondContact O-N 3.1Å; M357-R361 HydrophobicContact CG-CG 4.41Å; M357-R361 WeakPolarHBondContact O-CA 3.47Å; M357-R361 WeakPolarHBondContact O-CB 3.35Å; M357-R361 WeakPolarHBondContact O-CG 3.3Å; M357-R361 PolarHBondContact O-N 2.87Å |
| 358 | L | 42 | Very low | 51.7 | Low | 108 Ų | 108 | 96.3 Ų | 96.3 | 57% | 0.565 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -75.5 | -42.9 | 173.7 | -79.1 | 159.5 | 0 | 0 | 0 | 112.2 | N354 I355 G360 R361 S362 | N354-L358 WeakPolarHBondContact O-CD1 3.24Å; N354-L358 VanDerWaalsContact O-CG 3.28Å; N354-L358 WeakPolarHBondContact O-CG 3.43Å; N354-L358 PolarHBondContact O-N 2.81Å; I355-L358 PolarHBondContact O-N 2.94Å; L358-G360 VanDerWaalsContact C-N 3.33Å; L358-R361 PolarHBondContact O-N 3.31Å; L358-S362 PolarHBondContact O-N 3.29Å |
| 359 | L | 45.8 | Very low | 50.5 | Low | 113 Ų | 113 | 99 Ų | 99 | 59% | 0.592 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63.5 | -41.1 | 169.9 | -84.4 | 99.6 | 0 | 0 | 0 | 110.9 | I355 S362 | I355-L359 HydrophobicContact CG2-CD1 3.52Å; I355-L359 VanDerWaalsContact O-CD1 3.27Å; I355-L359 WeakPolarHBondContact O-CD1 3.11Å; I355-L359 PolarHBondContact O-N 2.95Å; L359-S362 PolarHBondContact O-OG 2.76Å |
| 360 | G | 47.1 | Very low | 49.6 | Very low | 31 Ų | 31 | 107.3 Ų | 107.3 | 32% | 0.32 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.5 | -38 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | R356 L358 R363 Q364 | R356-G360 WeakPolarHBondContact O-CA 3.34Å; R356-G360 PolarHBondContact O-N 2.82Å; L358-G360 VanDerWaalsContact C-N 3.33Å; G360-R363 PolarHBondContact O-N 3.02Å; G360-Q364 WeakPolarHBondContact O-CB 3.33Å; G360-Q364 PolarHBondContact O-N 3.41Å |
| 361 | R | 45.6 | Very low | 48.8 | Very low | 114 Ų | 114 | 107.1 Ų | 107.1 | 43% | 0.43 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -67.6 | -39.4 | 176.9 | -93.6 | -175.5 | 174.5 | 133.6 | -1.3 | 111.8 | M357 L358 R363 Q364 E365 | M357-R361 HydrophobicContact CG-CG 4.41Å; M357-R361 WeakPolarHBondContact O-CA 3.47Å; M357-R361 WeakPolarHBondContact O-CB 3.35Å; M357-R361 WeakPolarHBondContact O-CG 3.3Å; M357-R361 PolarHBondContact O-N 2.87Å; L358-R361 PolarHBondContact O-N 3.31Å; R361-R363 PolarHBondContact O-N 3.36Å; R361-Q364 CarbonylContact O-C 3.54Å; R361-Q364 PolarHBondContact O-N 2.97Å; R361-E365 VanDerWaalsContact O-CB 3.31Å; R361-E365 WeakPolarHBondContact O-CB 3.34Å; R361-E365 PolarHBondContact O-N 3.41Å |
| 362 | S | 47.3 | Very low | 48.4 | Very low | 87 Ų | 87 | 109.1 Ų | 109.1 | 61% | 0.608 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -54.1 | -34.4 | 174.9 | 77.2 | 0 | 0 | 0 | 0 | 112 | L358 L359 | L358-S362 PolarHBondContact O-N 3.29Å; L359-S362 PolarHBondContact O-OG 2.76Å |
| 363 | R | 49.2 | Very low | 48.4 | Very low | 203 Ų | 203 | 109 Ų | 109 | 77% | 0.766 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -84.1 | -32.4 | 178 | -158.8 | 172.9 | 165.2 | 179.2 | -4.2 | 113.2 | G360 R361 Y367 | G360-R363 PolarHBondContact O-N 3.02Å; R361-R363 PolarHBondContact O-N 3.36Å; R363-Y367 PolarHBondContact O-N 2.91Å |
| 364 | Q | 47.9 | Very low | 48.6 | Very low | 138 Ų | 138 | 109 Ų | 109 | 65% | 0.645 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -82.1 | -36.4 | 178.1 | -110.9 | 173.4 | -10 | 0 | 0 | 113.9 | G360 R361 Y367 R368 | G360-Q364 WeakPolarHBondContact O-CB 3.33Å; G360-Q364 PolarHBondContact O-N 3.41Å; R361-Q364 CarbonylContact O-C 3.54Å; R361-Q364 PolarHBondContact O-N 2.97Å; Q364-Y367 PolarHBondContact O-N 3.08Å; Q364-R368 VanDerWaalsContact O-CB 3.25Å; Q364-R368 WeakPolarHBondContact O-CB 3.48Å; Q364-R368 PolarHBondContact O-N 3.06Å |
| 365 | E | 46.5 | Very low | 48.9 | Very low | 108 Ų | 108 | 111.6 Ų | 111.6 | 51% | 0.505 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.2 | -42.4 | 172 | -94.7 | 146.3 | -175.9 | 0 | 0 | 109.9 | R361 Y367 R368 T369 | R361-E365 VanDerWaalsContact O-CB 3.31Å; R361-E365 WeakPolarHBondContact O-CB 3.34Å; R361-E365 PolarHBondContact O-N 3.41Å; E365-Y367 VanDerWaalsContact C-N 3.28Å; E365-Y367 PolarHBondContact O-N 2.82Å; E365-R368 PolarHBondContact O-N 3.5Å; E365-R368 VanDerWaalsContact O-N 3.1Å; E365-T369 PolarHBondContact O-N 3.31Å; E365-T369 PolarHBondContact O-OG1 3.38Å |
| 366 | G | 49.5 | Very low | 49.1 | Very low | 41 Ų | 41 | 113.7 Ų | 113.7 | 42% | 0.423 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -59.7 | -33 | 172.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | R370 | G366-R370 WeakPolarHBondContact O-CB 3.38Å |
| 367 | Y | 46.7 | Very low | 49.5 | Very low | 173 Ų | 173 | 111.7 Ų | 111.7 | 68% | 0.678 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -77.4 | -36.1 | 172.5 | -102.9 | -90 | 0 | 0 | 0 | 112.7 | R363 Q364 E365 N371 | R363-Y367 PolarHBondContact O-N 2.91Å; Q364-Y367 PolarHBondContact O-N 3.08Å; E365-Y367 VanDerWaalsContact C-N 3.28Å; E365-Y367 PolarHBondContact O-N 2.82Å; Y367-N371 PolarHBondContact O-N 2.91Å |
| 368 | R | 47.9 | Very low | 50.1 | Low | 184 Ų | 184 | 109.8 Ų | 109.8 | 69% | 0.694 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -78.4 | -37.6 | -175.6 | -160.6 | 176.4 | 177.2 | 164.9 | -0.2 | 112.3 | Q364 E365 R370 I372 | Q364-R368 VanDerWaalsContact O-CB 3.25Å; Q364-R368 WeakPolarHBondContact O-CB 3.48Å; Q364-R368 PolarHBondContact O-N 3.06Å; E365-R368 PolarHBondContact O-N 3.5Å; E365-R368 VanDerWaalsContact O-N 3.1Å; R368-R370 VanDerWaalsContact C-N 3.35Å; R368-I372 HydrophobicContact CG-CD1 3.94Å; R368-I372 WeakPolarHBondContact O-CB 3.15Å; R368-I372 WeakPolarHBondContact O-CD1 3.24Å; R368-I372 WeakPolarHBondContact O-CG1 3.32Å; R368-I372 PolarHBondContact O-N 3.02Å |
| 369 | T | 52.4 | Low | 50.7 | Low | 92 Ų | 92 | 109.8 Ų | 109.8 | 56% | 0.564 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67.5 | -35.2 | 172.2 | 35.8 | 0 | 0 | 0 | 0 | 111.9 | E365 I372 A373 | E365-T369 PolarHBondContact O-N 3.31Å; E365-T369 PolarHBondContact O-OG1 3.38Å; T369-I372 PolarHBondContact O-N 2.97Å; T369-A373 VanDerWaalsContact O-CB 3.27Å; T369-A373 WeakPolarHBondContact O-CB 3.24Å; T369-A373 PolarHBondContact O-N 2.91Å |
| 370 | R | 51.5 | Low | 51 | Low | 207 Ų | 207 | 107.9 Ų | 107.9 | 78% | 0.781 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67.3 | -39.5 | 177.6 | -152.7 | 170.2 | 177 | 167.1 | -1.6 | 112.2 | G366 R368 A374 | G366-R370 WeakPolarHBondContact O-CB 3.38Å; R368-R370 VanDerWaalsContact C-N 3.35Å; R370-A374 WeakPolarHBondContact O-CB 3.41Å; R370-A374 PolarHBondContact O-N 3.48Å |
| 371 | N | 53.3 | Low | 51.3 | Low | 114 Ų | 114 | 115.1 Ų | 115.1 | 61% | 0.61 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -73.7 | -37 | 174.9 | -79.8 | -8.6 | 0 | 0 | 0 | 113.4 | Y367 A374 Y375 | Y367-N371 PolarHBondContact O-N 2.91Å; N371-A374 PolarHBondContact O-N 2.88Å; N371-Y375 WeakPolarHBondContact O-CB 3.17Å; N371-Y375 PolarHBondContact O-N 3.09Å |
| 372 | I | 54.7 | Low | 51.7 | Low | 85 Ų | 85 | 114.9 Ų | 114.9 | 44% | 0.436 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.7 | -40.1 | 176.9 | -69.1 | 166.9 | 0 | 0 | 0 | 110.8 | R368 T369 A374 Y375 L376 | R368-I372 HydrophobicContact CG-CD1 3.94Å; R368-I372 WeakPolarHBondContact O-CB 3.15Å; R368-I372 WeakPolarHBondContact O-CD1 3.24Å; R368-I372 WeakPolarHBondContact O-CG1 3.32Å; R368-I372 PolarHBondContact O-N 3.02Å; T369-I372 PolarHBondContact O-N 2.97Å; I372-A374 PolarHBondContact O-N 3.22Å; I372-Y375 PolarHBondContact O-N 3.36Å; I372-L376 HydrophobicContact CG2-CD1 3.66Å; I372-L376 HydrophobicContact CG2-CG 4.15Å; I372-L376 WeakPolarHBondContact O-CB 3.29Å; I372-L376 VanDerWaalsContact O-CG 3.3Å; I372-L376 WeakPolarHBondContact O-CG 3.36Å; I372-L376 PolarHBondContact O-N 3.17Å |
| 373 | A | 55.2 | Low | 52 | Low | 62 Ų | 62 | 119.6 Ų | 119.6 | 51% | 0.512 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -63 | -40.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | T369 S377 | T369-A373 VanDerWaalsContact O-CB 3.27Å; T369-A373 WeakPolarHBondContact O-CB 3.24Å; T369-A373 PolarHBondContact O-N 2.91Å; A373-S377 WeakPolarHBondContact O-CB 3.43Å; A373-S377 PolarHBondContact O-N 3.02Å; A373-S377 VanDerWaalsContact O-N 3.08Å; A373-S377 PolarHBondContact O-OG 3.36Å |
| 374 | A | 56.2 | Low | 52.2 | Low | 57 Ų | 57 | 115.8 Ų | 115.8 | 47% | 0.471 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -68.2 | -34.2 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | R370 N371 I372 S377 S378 | R370-A374 WeakPolarHBondContact O-CB 3.41Å; R370-A374 PolarHBondContact O-N 3.48Å; N371-A374 PolarHBondContact O-N 2.88Å; I372-A374 PolarHBondContact O-N 3.22Å; A374-S377 PolarHBondContact O-OG 3.13Å; A374-S378 PolarHBondContact O-N 2.71Å |
| 375 | Y | 52.6 | Low | 52.7 | Low | 161 Ų | 161 | 113.4 Ų | 113.4 | 63% | 0.631 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -73.4 | -43.7 | 176.8 | -161.7 | -94.7 | 0 | 0 | 0 | 111.8 | N371 I372 S377 S378 Q379 | N371-Y375 WeakPolarHBondContact O-CB 3.17Å; N371-Y375 PolarHBondContact O-N 3.09Å; I372-Y375 PolarHBondContact O-N 3.36Å; Y375-S377 PolarHBondContact O-N 3.45Å; Y375-S378 PolarHBondContact O-N 3.05Å; Y375-S378 PolarHBondContact O-OG 3.3Å; Y375-Q379 PolarHBondContact O-N 2.95Å |
| 376 | L | 52.4 | Low | 52.9 | Low | 99 Ų | 99 | 117.5 Ų | 117.5 | 52% | 0.518 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -66.2 | -36.3 | 178.6 | -72.4 | 172.3 | 0 | 0 | 0 | 112.5 | I372 S378 Q379 S380 | I372-L376 HydrophobicContact CG2-CD1 3.66Å; I372-L376 HydrophobicContact CG2-CG 4.15Å; I372-L376 WeakPolarHBondContact O-CB 3.29Å; I372-L376 VanDerWaalsContact O-CG 3.3Å; I372-L376 WeakPolarHBondContact O-CG 3.36Å; I372-L376 PolarHBondContact O-N 3.17Å; L376-S378 VanDerWaalsContact C-N 3.34Å; L376-Q379 PolarHBondContact O-N 3.05Å; L376-S380 WeakPolarHBondContact O-CB 3.07Å; L376-S380 PolarHBondContact O-N 2.73Å |
| 377 | S | 53.8 | Low | 53.2 | Low | 76 Ų | 76 | 119.6 Ų | 119.6 | 53% | 0.531 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.1 | -38.3 | 173.8 | 64.9 | 0 | 0 | 0 | 0 | 111.9 | A373 A374 Y375 R381 | A373-S377 WeakPolarHBondContact O-CB 3.43Å; A373-S377 PolarHBondContact O-N 3.02Å; A373-S377 VanDerWaalsContact O-N 3.08Å; A373-S377 PolarHBondContact O-OG 3.36Å; A374-S377 PolarHBondContact O-OG 3.13Å; Y375-S377 PolarHBondContact O-N 3.45Å; S377-R381 PolarHBondContact O-N 3.44Å |
| 378 | S | 55.1 | Low | 53.5 | Low | 52 Ų | 52 | 116.1 Ų | 116.1 | 36% | 0.364 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -67.7 | -36.2 | 174.5 | 80.7 | 0 | 0 | 0 | 0 | 113.1 | A374 Y375 L376 N382 | A374-S378 PolarHBondContact O-N 2.71Å; Y375-S378 PolarHBondContact O-N 3.05Å; Y375-S378 PolarHBondContact O-OG 3.3Å; L376-S378 VanDerWaalsContact C-N 3.34Å; S378-N382 PolarHBondContact O-N 2.84Å; S378-N382 VanDerWaalsContact O-N 3.13Å |
| 379 | Q | 53.5 | Low | 53.8 | Low | 108 Ų | 108 | 113.2 Ų | 113.2 | 51% | 0.505 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -75 | -37.1 | -179.4 | -166.2 | 173.8 | 19.1 | 0 | 0 | 111.8 | Y375 L376 N382 R383 | Y375-Q379 PolarHBondContact O-N 2.95Å; L376-Q379 PolarHBondContact O-N 3.05Å; Q379-N382 PolarHBondContact O-N 2.9Å; Q379-R383 WeakPolarHBondContact O-CB 3.16Å; Q379-R383 PolarHBondContact O-N 3.17Å |
| 380 | S | 52.5 | Low | 53.9 | Low | 73 Ų | 73 | 112.2 Ų | 112.2 | 51% | 0.51 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -59.7 | -46.9 | 171.6 | -167.7 | 0 | 0 | 0 | 0 | 110.8 | L376 N382 R383 E384 | L376-S380 WeakPolarHBondContact O-CB 3.07Å; L376-S380 PolarHBondContact O-N 2.73Å; S380-N382 VanDerWaalsContact C-N 3.34Å; S380-N382 PolarHBondContact O-N 2.94Å; S380-R383 PolarHBondContact O-N 3.32Å; S380-R383 VanDerWaalsContact O-N 3.14Å; S380-E384 PolarHBondContact O-N 3.49Å |
| 381 | R | 53.5 | Low | 54 | Low | 184 Ų | 184 | 106.7 Ų | 106.7 | 69% | 0.694 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -60.3 | -41.7 | 178.7 | -160.5 | 171.9 | 85.2 | 179.3 | 7.3 | 112.4 | S377 V385 | S377-R381 PolarHBondContact O-N 3.44Å; R381-V385 VanDerWaalsContact O-CG2 3.31Å; R381-V385 WeakPolarHBondContact O-CG2 3.28Å; R381-V385 PolarHBondContact O-N 3.36Å |
| 382 | N | 54.7 | Low | 54 | Low | 109 Ų | 109 | 111 Ų | 111 | 58% | 0.583 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -70.9 | -31.8 | 177 | -79.9 | -22.3 | 0 | 0 | 0 | 113.2 | S378 Q379 S380 R386 | S378-N382 PolarHBondContact O-N 2.84Å; S378-N382 VanDerWaalsContact O-N 3.13Å; Q379-N382 PolarHBondContact O-N 2.9Å; S380-N382 VanDerWaalsContact C-N 3.34Å; S380-N382 PolarHBondContact O-N 2.94Å; N382-R386 WeakPolarHBondContact O-CB 3.1Å; N382-R386 PolarHBondContact O-N 3.12Å |
| 383 | R | 52.3 | Low | 53.9 | Low | 186 Ų | 186 | 111.1 Ų | 111.1 | 70% | 0.702 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -71.5 | -36.9 | 177.5 | -163.6 | 176.7 | -176.4 | -177.7 | 0 | 111.5 | Q379 S380 R386 L387 | Q379-R383 WeakPolarHBondContact O-CB 3.16Å; Q379-R383 PolarHBondContact O-N 3.17Å; S380-R383 PolarHBondContact O-N 3.32Å; S380-R383 VanDerWaalsContact O-N 3.14Å; R383-R386 PolarHBondContact O-N 3.25Å; R383-L387 HydrophobicContact CG-CD1 4.2Å; R383-L387 WeakPolarHBondContact O-CB 3.35Å; R383-L387 PolarHBondContact O-N 3.3Å |
| 384 | E | 54.8 | Low | 53.6 | Low | 122 Ų | 122 | 114.1 Ų | 114.1 | 57% | 0.57 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67.1 | -43.8 | 176.1 | -142.4 | 165.9 | -163.8 | 0 | 0 | 111.5 | S380 R386 L387 N388 | S380-E384 PolarHBondContact O-N 3.49Å; E384-R386 VanDerWaalsContact C-N 3.32Å; E384-R386 PolarHBondContact O-N 3.32Å; E384-L387 PolarHBondContact O-N 2.79Å; E384-N388 VanDerWaalsContact O-CG 3.27Å; E384-N388 PolarHBondContact O-N 3.2Å |
| 385 | V | 57.6 | Low | 53.2 | Low | 88 Ų | 88 | 116.8 Ų | 116.8 | 53% | 0.533 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61 | -41.2 | 172.8 | 172.8 | 0 | 0 | 0 | 0 | 111.4 | R381 Q389 | R381-V385 VanDerWaalsContact O-CG2 3.31Å; R381-V385 WeakPolarHBondContact O-CG2 3.28Å; R381-V385 PolarHBondContact O-N 3.36Å; V385-Q389 PolarHBondContact O-N 3.18Å; V385-Q389 VanDerWaalsContact O-N 3.17Å |
| 386 | R | 51.4 | Low | 53.1 | Low | 195 Ų | 195 | 113.6 Ų | 113.6 | 74% | 0.736 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -71.9 | -36.7 | -179.1 | -164.2 | 179.8 | -97.7 | -169.9 | -6.5 | 112.3 | N382 R383 E384 Q389 T390 | N382-R386 WeakPolarHBondContact O-CB 3.1Å; N382-R386 PolarHBondContact O-N 3.12Å; R383-R386 PolarHBondContact O-N 3.25Å; E384-R386 VanDerWaalsContact C-N 3.32Å; E384-R386 PolarHBondContact O-N 3.32Å; R386-Q389 PolarHBondContact O-N 2.85Å; R386-T390 PolarHBondContact O-N 3.47Å; R386-T390 PolarHBondContact O-OG1 3.48Å |
| 387 | L | 54.3 | Low | 52.6 | Low | 85 Ų | 85 | 117.4 Ų | 117.4 | 45% | 0.445 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -65.4 | -45.1 | 174.6 | -89.3 | 157.4 | 0 | 0 | 0 | 111.8 | R383 E384 Q389 T390 E391 | R383-L387 HydrophobicContact CG-CD1 4.2Å; R383-L387 WeakPolarHBondContact O-CB 3.35Å; R383-L387 PolarHBondContact O-N 3.3Å; E384-L387 PolarHBondContact O-N 2.79Å; L387-Q389 PolarHBondContact O-N 3.2Å; L387-T390 WeakPolarHBondContact CA-OG1 3.48Å; L387-T390 PolarHBondContact O-N 3.05Å; L387-T390 PolarHBondContact O-OG1 2.81Å; L387-E391 PolarHBondContact O-N 2.86Å |
| 388 | N | 54.3 | Low | 52.2 | Low | 100 Ų | 100 | 119.6 Ų | 119.6 | 54% | 0.535 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.9 | -32 | 175.9 | -69.7 | -5.7 | 0 | 0 | 0 | 112.2 | E384 R392 | E384-N388 VanDerWaalsContact O-CG 3.27Å; E384-N388 PolarHBondContact O-N 3.2Å; N388-R392 PolarHBondContact O-N 2.81Å |
| 389 | Q | 54 | Low | 51.9 | Low | 123 Ų | 123 | 122.2 Ų | 122.2 | 58% | 0.575 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -75.9 | -33.3 | 174.4 | -165.6 | 162.9 | 6.1 | 0 | 0 | 112.7 | V385 R386 L387 I393 | V385-Q389 PolarHBondContact O-N 3.18Å; V385-Q389 VanDerWaalsContact O-N 3.17Å; R386-Q389 PolarHBondContact O-N 2.85Å; L387-Q389 PolarHBondContact O-N 3.2Å; Q389-I393 HydrophobicContact CG-CD1 4.32Å; Q389-I393 WeakPolarHBondContact O-CD1 3.47Å; Q389-I393 VanDerWaalsContact O-CG1 3.24Å; Q389-I393 WeakPolarHBondContact O-CG1 3.36Å; Q389-I393 PolarHBondContact O-N 3.09Å |
| 390 | T | 53.8 | Low | 51.6 | Low | 71 Ų | 71 | 127.6 Ų | 127.6 | 44% | 0.436 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -75.3 | -30.9 | 176.8 | 3.6 | 0 | 0 | 0 | 0 | 112.4 | R386 L387 I393 R394 | R386-T390 PolarHBondContact O-N 3.47Å; R386-T390 PolarHBondContact O-OG1 3.48Å; L387-T390 WeakPolarHBondContact CA-OG1 3.48Å; L387-T390 PolarHBondContact O-N 3.05Å; L387-T390 PolarHBondContact O-OG1 2.81Å; T390-I393 PolarHBondContact O-N 3.45Å; T390-R394 WeakPolarHBondContact O-CB 3.28Å; T390-R394 PolarHBondContact O-N 3.42Å |
| 391 | E | 54.4 | Low | 51.2 | Low | 90 Ų | 90 | 128.6 Ų | 128.6 | 42% | 0.421 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -67.4 | -44.8 | 171.7 | -79.8 | -176.7 | 161.5 | 0 | 0 | 111.9 | L387 I393 R394 D395 | L387-E391 PolarHBondContact O-N 2.86Å; E391-I393 PolarHBondContact O-N 3.46Å; E391-R394 PolarHBondContact O-N 3.09Å; E391-R394 VanDerWaalsContact O-N 3.12Å; E391-R394 IonicContact OE1-NH1 3.9Å; E391-R394 IonicContact OE1-NH2 3.41Å; E391-D395 PolarHBondContact O-N 2.86Å |
| 392 | R | 52.5 | Low | 50.4 | Low | 205 Ų | 205 | 123.4 Ų | 123.4 | 77% | 0.774 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -56.8 | -36.4 | 171.8 | -86.1 | -171.5 | -176.6 | -176.8 | 1.7 | 113.7 | N388 | N388-R392 PolarHBondContact O-N 2.81Å |
| 393 | I | 53.9 | Low | 50 | Low | 87 Ų | 87 | 124 Ų | 124 | 45% | 0.446 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -76.9 | -36.7 | 178.8 | -65.4 | 165.9 | 0 | 0 | 0 | 110.7 | Q389 T390 E391 C396 Y397 | Q389-I393 HydrophobicContact CG-CD1 4.32Å; Q389-I393 WeakPolarHBondContact O-CD1 3.47Å; Q389-I393 VanDerWaalsContact O-CG1 3.24Å; Q389-I393 WeakPolarHBondContact O-CG1 3.36Å; Q389-I393 PolarHBondContact O-N 3.09Å; T390-I393 PolarHBondContact O-N 3.45Å; E391-I393 PolarHBondContact O-N 3.46Å; I393-C396 WeakPolarHBondContact O-CB 3.46Å; I393-C396 PolarHBondContact O-N 3.39Å; I393-Y397 HydrophobicContact CG2-CD2 3.91Å; I393-Y397 HydrophobicContact CG2-CE2 3.95Å; I393-Y397 WeakPolarHBondContact O-CD2 3.27Å; I393-Y397 PolarHBondContact O-N 3.39Å |
| 394 | R | 48.1 | Very low | 49.1 | Very low | 125 Ų | 125 | 123 Ų | 123 | 47% | 0.472 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -63.8 | -40.1 | 178 | -163.3 | -170.2 | -45.4 | 145.3 | 10 | 111.9 | T390 E391 C396 Y397 V398 | T390-R394 WeakPolarHBondContact O-CB 3.28Å; T390-R394 PolarHBondContact O-N 3.42Å; E391-R394 PolarHBondContact O-N 3.09Å; E391-R394 VanDerWaalsContact O-N 3.12Å; E391-R394 IonicContact OE1-NH1 3.9Å; E391-R394 IonicContact OE1-NH2 3.41Å; R394-C396 VanDerWaalsContact C-N 3.27Å; R394-C396 PolarHBondContact O-N 3.44Å; R394-Y397 PolarHBondContact O-N 3.3Å; R394-Y397 VanDerWaalsContact O-N 3.1Å; R394-V398 WeakPolarHBondContact O-CG2 3.43Å; R394-V398 PolarHBondContact O-N 3.41Å; R394-V398 VanDerWaalsContact O-N 3.08Å |
| 395 | D | 48.8 | Very low | 47.9 | Very low | 113 Ų | 113 | 124.3 Ų | 124.3 | 60% | 0.604 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -64.8 | -31.5 | 176.6 | -68.8 | -17.4 | 0 | 0 | 0 | 112.3 | E391 S399 | E391-D395 PolarHBondContact O-N 2.86Å; D395-S399 PolarHBondContact O-OG 2.82Å |
| 396 | C | 48.7 | Very low | 46.7 | Very low | 94 Ų | 94 | 125.7 Ų | 125.7 | 64% | 0.635 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -71.3 | -26.9 | 172.9 | -78.9 | 0 | 0 | 0 | 0 | 113.8 | I393 R394 | I393-C396 WeakPolarHBondContact O-CB 3.46Å; I393-C396 PolarHBondContact O-N 3.39Å; R394-C396 VanDerWaalsContact C-N 3.27Å; R394-C396 PolarHBondContact O-N 3.44Å |
| 397 | Y | 41.8 | Very low | 45.9 | Very low | 180 Ų | 180 | 127.6 Ų | 127.6 | 71% | 0.706 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -91.7 | -33 | -176.7 | -90.5 | -84.3 | 0 | 0 | 0 | 113.8 | I393 R394 S399 R400 | I393-Y397 HydrophobicContact CG2-CD2 3.91Å; I393-Y397 HydrophobicContact CG2-CE2 3.95Å; I393-Y397 WeakPolarHBondContact O-CD2 3.27Å; I393-Y397 PolarHBondContact O-N 3.39Å; R394-Y397 PolarHBondContact O-N 3.3Å; R394-Y397 VanDerWaalsContact O-N 3.1Å; Y397-S399 PolarHBondContact O-N 2.84Å; Y397-R400 PolarHBondContact O-N 2.76Å; Y397-R400 VanDerWaalsContact O-N 3.1Å |
| 398 | V | 47.2 | Very low | 44.6 | Very low | 122 Ų | 122 | 132 Ų | 132 | 74% | 0.739 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -64.7 | -21.5 | 177 | 174.3 | 0 | 0 | 0 | 0 | 111.9 | R394 R400 | R394-V398 WeakPolarHBondContact O-CG2 3.43Å; R394-V398 PolarHBondContact O-N 3.41Å; R394-V398 VanDerWaalsContact O-N 3.08Å; V398-R400 VanDerWaalsContact C-N 3.29Å; V398-R400 PolarHBondContact O-N 3.46Å |
| 399 | S | 46.9 | Very low | 43.3 | Very low | 107 Ų | 107 | 132.3 Ų | 132.3 | 75% | 0.748 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.8 | -1.6 | 175.1 | -59.2 | 0 | 0 | 0 | 0 | 114.8 | D395 Y397 | D395-S399 PolarHBondContact O-OG 2.82Å; Y397-S399 PolarHBondContact O-N 2.84Å |
| 400 | R | 48.2 | Very low | 41.9 | Very low | 220 Ų | 220 | 131.8 Ų | 131.8 | 83% | 0.83 | 71% | 0.714 | S | S | * | * | S | Bend | trans | -131.1 | -3.6 | -164.2 | -136.7 | 175.4 | -172.6 | 164.7 | 3.2 | 120.8 | Y397 V398 | Y397-R400 PolarHBondContact O-N 2.76Å; Y397-R400 VanDerWaalsContact O-N 3.1Å; V398-R400 VanDerWaalsContact C-N 3.29Å; V398-R400 PolarHBondContact O-N 3.46Å |
| 401 | A | 43.1 | Very low | 40.5 | Very low | 95 Ų | 95 | 133.8 Ų | 133.8 | 79% | 0.785 | 73% | 0.731 | S | S | * | * | trans | -157.6 | 121.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 402 | G | 37.8 | Very low | 39.2 | Very low | 74 Ų | 74 | 135 Ų | 135 | 76% | 0.763 | 75% | 0.749 | S | S | * | * | trans | -78.4 | -176.9 | 166.7 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 403 | P | 45.2 | Very low | 38.4 | Very low | 123 Ų | 123 | 131.6 Ų | 131.6 | 80% | 0.799 | 75% | 0.754 | S | S | * | * | trans | -99 | 141.1 | -153.2 | 35.4 | -30.8 | 0 | 0 | 0 | 113.9 | ||||
| 404 | N | 33.4 | Very low | 36.9 | Very low | 164 Ų | 164 | 131.2 Ų | 131.2 | 88% | 0.877 | 77% | 0.772 | S | S | * | * | trans | -161.3 | 138.7 | 141.3 | -100.5 | -20.9 | 0 | 0 | 0 | 114.8 | ||||
| 405 | N | 30.9 | Very low | 35.9 | Very low | 150 Ų | 150 | 135.2 Ų | 135.2 | 80% | 0.802 | 79% | 0.792 | S | S | * | * | trans | -37.2 | 156.4 | 169.8 | -75.4 | -30.2 | 0 | 0 | 0 | 115.9 | ||||
| 406 | S | 32.1 | Very low | 34.8 | Very low | 117 Ų | 117 | 137 Ų | 137 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | 178.6 | 163.6 | 57.5 | 36.9 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 407 | R | 33.4 | Very low | 33.6 | Very low | 235 Ų | 235 | 136.1 Ų | 136.1 | 89% | 0.887 | 81% | 0.814 | S | S | * | * | trans | -67.1 | 155.6 | -179.6 | -62.5 | 170.4 | 175.7 | -177.8 | -2.3 | 114.2 | ||||
| 408 | L | 28.4 | Very low | 32.8 | Very low | 178 Ų | 178 | 136.5 Ų | 136.5 | 93% | 0.932 | 83% | 0.825 | S | S | * | * | trans | -167.2 | 144.1 | 131.1 | -114.2 | 130.6 | 0 | 0 | 0 | 112.9 | ||||
| 409 | S | 25.8 | Very low | 32.1 | Very low | 106 Ų | 106 | 135.2 Ų | 135.2 | 74% | 0.741 | 83% | 0.827 | S | S | * | * | trans | -100.8 | 150.1 | 175.7 | -61.3 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 410 | S | 24.6 | Very low | 31.2 | Very low | 111 Ų | 111 | 137 Ų | 137 | 78% | 0.776 | 83% | 0.834 | S | S | * | * | 151 | 150.9 | 121.3 | 70 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 411 | S | 25 | Very low | 30.4 | Very low | 113 Ų | 113 | 131.9 Ų | 131.9 | 79% | 0.79 | 84% | 0.839 | S | S | * | * | trans | 80.2 | 123.3 | 155.4 | 72.5 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 412 | S | 27.6 | Very low | 29.8 | Very low | 116 Ų | 116 | 130.7 Ų | 130.7 | 81% | 0.811 | 84% | 0.835 | S | S | * | * | trans | -84 | 161.7 | 159.1 | -61 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 413 | P | 34.5 | Very low | 29.4 | Very low | 133 Ų | 133 | 130 Ų | 130 | 86% | 0.864 | 83% | 0.829 | S | S | * | * | -149.5 | 166.7 | 101.1 | 35.9 | -18.5 | 0 | 0 | 0 | 114.8 | |||||
| 414 | G | 23.8 | Very low | 28.9 | Very low | 80 Ų | 80 | 133 Ų | 133 | 83% | 0.825 | 83% | 0.832 | S | S | * | * | trans | 129.9 | 117.3 | 151 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 415 | K | 26.7 | Very low | 28.9 | Very low | 208 Ų | 208 | 131.5 Ų | 131.5 | 90% | 0.904 | 83% | 0.828 | S | S | * | * | trans | -63.5 | 140.2 | 175.6 | -69.7 | 167.5 | 170.4 | 173.2 | 0 | 113.2 | ||||
| 416 | T | 24.7 | Very low | 29 | Very low | 151 Ų | 151 | 127.5 Ų | 127.5 | 93% | 0.926 | 82% | 0.816 | S | S | * | * | trans | -168.9 | 132.1 | 137 | 26.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 417 | G | 24.1 | Very low | 29.1 | Very low | 75 Ų | 75 | 129.7 Ų | 129.7 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | trans | 112 | 110.1 | 146.7 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 418 | M | 25.7 | Very low | 29.1 | Very low | 188 Ų | 188 | 130 Ų | 130 | 93% | 0.926 | 82% | 0.817 | S | S | * | * | trans | 78.7 | 113.8 | 138.7 | -126.7 | 84.9 | 171.2 | 0 | 0 | 120.3 | ||||
| 419 | A | 31.1 | Very low | 29.2 | Very low | 95 Ų | 95 | 125.5 Ų | 125.5 | 79% | 0.785 | 81% | 0.805 | S | S | * | * | trans | -51.1 | 131.3 | 168.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 420 | T | 30 | Very low | 29.5 | Very low | 145 Ų | 145 | 126.2 Ų | 126.2 | 89% | 0.89 | 81% | 0.809 | S | S | * | * | trans | -163.7 | 76.4 | 152.3 | 34.2 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 421 | A | 31.4 | Very low | 30.1 | Very low | 113 Ų | 113 | 129.9 Ų | 129.9 | 93% | 0.934 | 81% | 0.811 | S | S | * | * | trans | -127.4 | 41.4 | 171 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 422 | G | 29.2 | Very low | 30.5 | Very low | 70 Ų | 70 | 130.8 Ų | 130.8 | 72% | 0.722 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -130.5 | 3.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 423 | G | 30.2 | Very low | 30.7 | Very low | 60 Ų | 60 | 131.6 Ų | 131.6 | 62% | 0.619 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -91 | -22.1 | -169.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 424 | E | 33.6 | Very low | 30.8 | Very low | 184 Ų | 184 | 129.5 Ų | 129.5 | 86% | 0.86 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -93.6 | -16.3 | -168.6 | -88.9 | -176.8 | 140.5 | 0 | 0 | 115.3 | ||
| 425 | V | 34.8 | Very low | 31.4 | Very low | 134 Ų | 134 | 131.5 Ų | 131.5 | 81% | 0.812 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -89.7 | -16.3 | -179.6 | -167.8 | 0 | 0 | 0 | 0 | 112.3 | ||
| 426 | A | 32.8 | Very low | 31.7 | Very low | 65 Ų | 65 | 130.9 Ų | 130.9 | 54% | 0.537 | 80% | 0.797 | S | S | . | * | G | 310 helix | trans | -79.3 | -15.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | W428 | A426-W428 PolarHBondContact O-N 2.82Š|
| 427 | M | 32.9 | Very low | 32.1 | Very low | 163 Ų | 163 | 133.4 Ų | 133.4 | 80% | 0.803 | 80% | 0.795 | S | S | * | * | G | 310 helix | trans | -81 | -10.7 | -176 | -86.4 | -102.1 | -81.7 | 0 | 0 | 114.6 | ||
| 428 | W | 34.1 | Very low | 32.5 | Very low | 242 Ų | 242 | 136.1 Ų | 136.1 | 92% | 0.917 | 80% | 0.801 | S | S | * | * | G | 310 helix | trans | -93.8 | -10.8 | 177.3 | -105 | 80.3 | 0 | 0 | 0 | 114.7 | A426 | A426-W428 PolarHBondContact O-N 2.82Š|
| 429 | A | 30 | Very low | 32.8 | Very low | 83 Ų | 83 | 138.1 Ų | 138.1 | 69% | 0.686 | 80% | 0.798 | S | S | * | * | S | Bend | trans | -89.2 | -14.1 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | K431 | A429-K431 VanDerWaalsContact C-N 3.27Å; A429-K431 PolarHBondContact O-N 3.23Å; A429-K431 VanDerWaalsContact O-N 3.11Å |
| 430 | C | 33 | Very low | 32.9 | Very low | 122 Ų | 122 | 141.8 Ų | 141.8 | 82% | 0.824 | 80% | 0.804 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.3 | 31.6 | -175.3 | -79.8 | 0 | 0 | 0 | 0 | 115.2 | ||
| 431 | K | 36.7 | Very low | 33.1 | Very low | 187 Ų | 187 | 139.4 Ų | 139.4 | 81% | 0.813 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.6 | 14 | -176.1 | -110.7 | -179 | -175.2 | 175.5 | 0 | 117.8 | A429 | A429-K431 VanDerWaalsContact C-N 3.27Å; A429-K431 PolarHBondContact O-N 3.23Å; A429-K431 VanDerWaalsContact O-N 3.11Å |
| 432 | N | 32.9 | Very low | 33 | Very low | 133 Ų | 133 | 145.8 Ų | 145.8 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | trans | -144.4 | 119.2 | 170.3 | -80.4 | -57.8 | 0 | 0 | 0 | 112 | A434 | N432-A434 PolarHBondContact O-N 2.93Š| ||
| 433 | P | 33.3 | Very low | 32.9 | Very low | 132 Ų | 132 | 151 Ų | 151 | 86% | 0.857 | 80% | 0.804 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.3 | 25.9 | -179 | 32.8 | -33.4 | 0 | 0 | 0 | 114 | ||
| 434 | A | 35.7 | Very low | 32.9 | Very low | 89 Ų | 89 | 156 Ų | 156 | 74% | 0.736 | 82% | 0.817 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | 3.9 | -175.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | N432 | N432-A434 PolarHBondContact O-N 2.93Š|
| 435 | V | 36.8 | Very low | 32.9 | Very low | 123 Ų | 123 | 153.6 Ų | 153.6 | 75% | 0.745 | 82% | 0.815 | S | S | * | * | trans | -114.7 | 18.2 | -171.2 | -159.3 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 436 | F | 32.2 | Very low | 32.7 | Very low | 195 Ų | 195 | 153.3 Ų | 153.3 | 86% | 0.855 | 81% | 0.814 | S | S | * | * | S | Bend | trans | -96 | 6.6 | -176.8 | -109.4 | -78.6 | 0 | 0 | 0 | 116 | ||
| 437 | F | 32.7 | Very low | 33.1 | Very low | 203 Ų | 203 | 156.3 Ų | 156.3 | 89% | 0.89 | 83% | 0.828 | S | S | * | * | S | Bend | trans | -117.6 | 19.5 | -175.7 | -91.5 | -75.9 | 0 | 0 | 0 | 115.9 | ||
| 438 | C | 32.8 | Very low | 33.1 | Very low | 132 Ų | 132 | 156.6 Ų | 156.6 | 89% | 0.892 | 83% | 0.832 | S | S | * | * | S | Bend | trans | -138.1 | 55.5 | 173.3 | -76.6 | 0 | 0 | 0 | 0 | 112.1 | ||
| 439 | R | 33.5 | Very low | 33.3 | Very low | 231 Ų | 231 | 149.9 Ų | 149.9 | 87% | 0.872 | 82% | 0.819 | S | S | * | * | trans | -144.5 | 70 | 164.5 | -168.8 | 178.3 | 160.8 | 133.3 | -3.3 | 109.7 | ||||
| 440 | D | 33 | Very low | 33.3 | Very low | 171 Ų | 171 | 157.3 Ų | 157.3 | 91% | 0.914 | 85% | 0.847 | S | S | * | * | trans | -158.1 | 77.1 | 154.3 | -86.2 | -30.4 | 0 | 0 | 0 | 108.4 | ||||
| 441 | A | 33.7 | Very low | 33.4 | Very low | 95 Ų | 95 | 159.1 Ų | 159.1 | 79% | 0.785 | 85% | 0.849 | S | S | * | * | trans | -161.4 | 79.2 | 160.8 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 442 | R | 28.1 | Very low | 33.2 | Very low | 248 Ų | 248 | 157.6 Ų | 157.6 | 94% | 0.936 | 85% | 0.85 | S | S | * | * | trans | -108.6 | 117.7 | 159.7 | -99.1 | -169.5 | 176.5 | -166.7 | -2.2 | 107.8 | ||||
| 443 | H | 28.8 | Very low | 33.2 | Very low | 179 Ų | 179 | 158.9 Ų | 158.9 | 83% | 0.829 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 132.7 | 169.3 | -83 | -90.7 | 0 | 0 | 0 | 110.7 | T445 | H443-T445 PolarHBondContact O-N 2.98Š|
| 444 | D | 28.7 | Very low | 33.2 | Very low | 165 Ų | 165 | 160.5 Ų | 160.5 | 88% | 0.882 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 121.1 | 159.6 | -75.5 | -39.1 | 0 | 0 | 0 | 109 | ||
| 445 | T | 34 | Very low | 33 | Very low | 133 Ų | 133 | 165 Ų | 165 | 82% | 0.816 | 87% | 0.866 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 121.4 | 170.5 | 39.7 | 0 | 0 | 0 | 0 | 109.9 | H443 | H443-T445 PolarHBondContact O-N 2.98Š|
| 446 | T | 31.4 | Very low | 32.8 | Very low | 128 Ų | 128 | 167.8 Ų | 167.8 | 79% | 0.785 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 146.1 | 161.5 | 42.7 | 0 | 0 | 0 | 0 | 112.1 | ||
| 447 | P | 41.7 | Very low | 32.8 | Very low | 128 Ų | 128 | 165.9 Ų | 165.9 | 83% | 0.831 | 88% | 0.875 | S | S | * | * | P | Polyproline II helix | trans | -82.8 | 144.8 | 173.4 | 33.9 | -30.4 | 0 | 0 | 0 | 111.2 | ||
| 448 | L | 32.7 | Very low | 32.8 | Very low | 169 Ų | 169 | 163 Ų | 163 | 89% | 0.885 | 87% | 0.874 | S | S | * | * | P | Polyproline II helix | trans | -96.1 | 157.6 | 164.8 | -100.4 | 132.9 | 0 | 0 | 0 | 109.9 | ||
| 449 | P | 37.7 | Very low | 32.8 | Very low | 102 Ų | 102 | 165.6 Ų | 165.6 | 66% | 0.662 | 87% | 0.873 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 145.7 | -163.6 | 36.4 | -31.1 | 0 | 0 | 0 | 112.8 | ||
| 450 | N | 30.8 | Very low | 32.8 | Very low | 238 Ų | 238 | 159.6 Ų | 159.6 | 100% | 1.273 | 87% | 0.873 | S | S | * | * | -176.3 | 0 | 129 | -94.1 | -10 | 0 | 0 | 0 | 109.6 |
Retrieved 450 of 450 residues in 451.1 ms
(Link to these results)