| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.6 | Very low | 41.3 | Very low | 195 Ų | 195 | 93.3 Ų | 93.3 | 96% | 0.961 | 53% | 0.531 | S | S | * | . | 0 | -56.5 | 0 | -153.6 | 173.2 | -79.2 | 0 | 0 | 112.7 | S3 V4 L5 | M1-S3 PolarHBondContact O-N 3.28Å; M1-V4 PolarHBondContact O-N 2.96Å; M1-L5 WeakPolarHBondContact O-CB 3.44Å; M1-L5 PolarHBondContact O-N 3.11Å | |||
| 2 | K | 27.9 | Very low | 42.1 | Very low | 167 Ų | 167 | 90.2 Ų | 90.2 | 73% | 0.726 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.1 | -40.5 | 178.7 | -165.6 | 175.1 | 179.8 | -179.8 | 0 | 115.1 | L5 D6 | K2-L5 PolarHBondContact O-N 2.97Å; K2-D6 WeakPolarHBondContact O-CB 3.33Å; K2-D6 VanDerWaalsContact O-CG 3.26Å; K2-D6 PolarHBondContact O-N 3.18Å |
| 3 | S | 30.2 | Very low | 42.5 | Very low | 93 Ų | 93 | 92.2 Ų | 92.2 | 65% | 0.65 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -70.7 | -36.1 | 177.9 | 66.8 | 0 | 0 | 0 | 0 | 113.2 | M1 G7 | M1-S3 PolarHBondContact O-N 3.28Å; S3-G7 PolarHBondContact O-N 3.42Å |
| 4 | V | 45 | Very low | 43 | Very low | 99 Ų | 99 | 97.3 Ų | 97.3 | 60% | 0.6 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -67.9 | -42.5 | 175.9 | -179.6 | 0 | 0 | 0 | 0 | 110 | M1 G7 V8 | M1-V4 PolarHBondContact O-N 2.96Å; V4-G7 PolarHBondContact O-N 3.16Å; V4-V8 WeakPolarHBondContact O-CG2 3.37Å; V4-V8 PolarHBondContact O-N 3.3Å |
| 5 | L | 40.9 | Very low | 43.3 | Very low | 92 Ų | 92 | 96.9 Ų | 96.9 | 48% | 0.482 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -66.8 | -38.7 | 177.1 | -139.6 | 79.2 | 0 | 0 | 0 | 112.4 | M1 K2 A9 L348 | M1-L5 WeakPolarHBondContact O-CB 3.44Å; M1-L5 PolarHBondContact O-N 3.11Å; K2-L5 PolarHBondContact O-N 2.97Å; L5-A9 WeakPolarHBondContact O-CB 3.42Å; L5-A9 PolarHBondContact O-N 2.93Å; L5-A9 VanDerWaalsContact O-N 3.13Å; L5-L348 HydrophobicContact CD2-CD1 3.87Å; L5-L348 HydrophobicContact CG-CD1 4.47Å |
| 6 | D | 42.3 | Very low | 43.5 | Very low | 67 Ų | 67 | 96.7 Ų | 96.7 | 36% | 0.358 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -68.2 | -35.6 | 175.1 | -76.8 | -24.9 | 0 | 0 | 0 | 111.8 | K2 D10 K344 | K2-D6 WeakPolarHBondContact O-CB 3.33Å; K2-D6 VanDerWaalsContact O-CG 3.26Å; K2-D6 PolarHBondContact O-N 3.18Å; D6-D10 WeakPolarHBondContact O-CB 3.5Å; D6-D10 PolarHBondContact O-N 2.98Å; D6-K344 IonicContact OD1-NZ 2.66Å; D6-K344 PolarHBondContact OD1-NZ 3.47Å |
| 7 | G | 42.1 | Very low | 43.7 | Very low | 34 Ų | 34 | 93.9 Ų | 93.9 | 35% | 0.351 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -69.1 | -43.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | S3 V4 D10 T11 | S3-G7 PolarHBondContact O-N 3.42Å; V4-G7 PolarHBondContact O-N 3.16Å; G7-D10 PolarHBondContact O-N 3.37Å; G7-T11 WeakPolarHBondContact O-CB 3.31Å; G7-T11 PolarHBondContact O-N 3.42Å; G7-T11 VanDerWaalsContact O-N 3.08Å; G7-T11 PolarHBondContact O-OG1 3.27Å |
| 8 | V | 49.9 | Very low | 44 | Very low | 84 Ų | 84 | 92.4 Ų | 92.4 | 51% | 0.509 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.7 | -43.4 | 175.8 | 174.6 | 0 | 0 | 0 | 0 | 110.3 | V4 T11 T12 | V4-V8 WeakPolarHBondContact O-CG2 3.37Å; V4-V8 PolarHBondContact O-N 3.3Å; V8-T11 PolarHBondContact O-N 3.29Å; V8-T12 PolarHBondContact O-N 2.86Å; V8-T12 PolarHBondContact O-OG1 3.31Å |
| 9 | A | 39 | Very low | 43.7 | Very low | 32 Ų | 32 | 90 Ų | 90 | 26% | 0.264 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65 | -40.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | L5 F13 | L5-A9 WeakPolarHBondContact O-CB 3.42Å; L5-A9 PolarHBondContact O-N 2.93Å; L5-A9 VanDerWaalsContact O-N 3.13Å; A9-F13 VanDerWaalsContact O-CB 3.28Å; A9-F13 WeakPolarHBondContact O-CB 3.31Å; A9-F13 PolarHBondContact O-N 3.32Å; A9-F13 VanDerWaalsContact O-N 3.09Å |
| 10 | D | 51.2 | Low | 43.4 | Very low | 75 Ų | 75 | 91.2 Ų | 91.2 | 40% | 0.401 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68.6 | -39.1 | 177.8 | -160.9 | 57.2 | 0 | 0 | 0 | 111.5 | D6 G7 F13 R14 | D6-D10 WeakPolarHBondContact O-CB 3.5Å; D6-D10 PolarHBondContact O-N 2.98Å; G7-D10 PolarHBondContact O-N 3.37Å; D10-F13 PolarHBondContact O-N 3.44Å; D10-R14 WeakPolarHBondContact O-CG 3.48Å; D10-R14 PolarHBondContact O-N 2.9Å; D10-R14 IonicContact OD2-CZ 2.78Å; D10-R14 IonicContact OD2-NE 3.91Å; D10-R14 PolarHBondContact OD2-NE 3.25Å; D10-R14 IonicContact OD2-NH2 3.39Å; D10-R14 PolarHBondContact OD2-NH2 2.89Å |
| 11 | T | 47.4 | Very low | 43.2 | Very low | 88 Ų | 88 | 94.3 Ų | 94.3 | 54% | 0.54 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -66.5 | -48.3 | 179.5 | -48.1 | 0 | 0 | 0 | 0 | 111 | G7 V8 F13 R14 T15 | G7-T11 WeakPolarHBondContact O-CB 3.31Å; G7-T11 PolarHBondContact O-N 3.42Å; G7-T11 VanDerWaalsContact O-N 3.08Å; G7-T11 PolarHBondContact O-OG1 3.27Å; V8-T11 PolarHBondContact O-N 3.29Å; T11-F13 VanDerWaalsContact C-N 3.29Å; T11-F13 PolarHBondContact O-N 3.04Å; T11-R14 PolarHBondContact O-N 2.91Å; T11-T15 PolarHBondContact O-N 2.93Å; T11-T15 VanDerWaalsContact O-N 3.17Å; T11-T15 PolarHBondContact O-OG1 3.47Å; T11-T15 VanDerWaalsContact O-OG1 3.1Å |
| 12 | T | 50.5 | Low | 42.9 | Very low | 56 Ų | 56 | 95.3 Ų | 95.3 | 34% | 0.344 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.7 | -36.7 | 175.8 | -53.6 | 0 | 0 | 0 | 0 | 112 | V8 I16 | V8-T12 PolarHBondContact O-N 2.86Å; V8-T12 PolarHBondContact O-OG1 3.31Å; T12-I16 HydrophobicContact CG2-CD1 3.91Å; T12-I16 WeakPolarHBondContact O-CG1 3.48Å; T12-I16 PolarHBondContact O-N 3.24Å |
| 13 | F | 47.6 | Very low | 43.4 | Very low | 116 Ų | 116 | 94.6 Ų | 94.6 | 51% | 0.509 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.4 | -40.9 | 177.9 | -173.2 | -99 | 0 | 0 | 0 | 112.7 | A9 D10 T11 T17 | A9-F13 VanDerWaalsContact O-CB 3.28Å; A9-F13 WeakPolarHBondContact O-CB 3.31Å; A9-F13 PolarHBondContact O-N 3.32Å; A9-F13 VanDerWaalsContact O-N 3.09Å; D10-F13 PolarHBondContact O-N 3.44Å; T11-F13 VanDerWaalsContact C-N 3.29Å; T11-F13 PolarHBondContact O-N 3.04Å; F13-T17 HydrophobicContact CE1-CG2 4.12Å; F13-T17 HydrophobicContact CZ-CG2 4.14Å; F13-T17 PolarHBondContact O-N 3Å; F13-T17 VanDerWaalsContact O-N 3.1Å; F13-T17 PolarHBondContact O-OG1 3.37Å |
| 14 | R | 48.9 | Very low | 43.4 | Very low | 164 Ų | 164 | 93.3 Ų | 93.3 | 62% | 0.619 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.5 | -40.8 | 176.2 | -72.7 | -175.1 | -159.4 | -168 | 7 | 112.7 | D10 T11 I16 T17 S18 | D10-R14 WeakPolarHBondContact O-CG 3.48Å; D10-R14 PolarHBondContact O-N 2.9Å; D10-R14 IonicContact OD2-CZ 2.78Å; D10-R14 IonicContact OD2-NE 3.91Å; D10-R14 PolarHBondContact OD2-NE 3.25Å; D10-R14 IonicContact OD2-NH2 3.39Å; D10-R14 PolarHBondContact OD2-NH2 2.89Å; T11-R14 PolarHBondContact O-N 2.91Å; R14-I16 PolarHBondContact O-N 3.48Å; R14-T17 WeakPolarHBondContact CA-OG1 3.28Å; R14-T17 PolarHBondContact O-N 3.41Å; R14-T17 PolarHBondContact O-OG1 2.93Å; R14-T17 VanDerWaalsContact O-OG1 3.09Å; R14-S18 PolarHBondContact O-N 3.02Å; R14-S18 PolarHBondContact O-OG 3.15Å |
| 15 | T | 48 | Very low | 43 | Very low | 92 Ų | 92 | 93.3 Ų | 93.3 | 56% | 0.564 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.5 | -37 | 179.4 | -52.2 | 0 | 0 | 0 | 0 | 112.4 | T11 S18 G19 | T11-T15 PolarHBondContact O-N 2.93Å; T11-T15 VanDerWaalsContact O-N 3.17Å; T11-T15 PolarHBondContact O-OG1 3.47Å; T11-T15 VanDerWaalsContact O-OG1 3.1Å; T15-S18 PolarHBondContact O-OG 3.44Å; T15-G19 PolarHBondContact O-N 3.1Å |
| 16 | I | 47.3 | Very low | 42.6 | Very low | 93 Ų | 93 | 96.9 Ų | 96.9 | 48% | 0.477 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -72.8 | -37 | 177.4 | -66.5 | 169.6 | 0 | 0 | 0 | 111.2 | T12 R14 L20 | T12-I16 HydrophobicContact CG2-CD1 3.91Å; T12-I16 WeakPolarHBondContact O-CG1 3.48Å; T12-I16 PolarHBondContact O-N 3.24Å; R14-I16 PolarHBondContact O-N 3.48Å; I16-L20 HydrophobicContact CG2-CD1 4.13Å; I16-L20 PolarHBondContact O-N 3.27Å |
| 17 | T | 46.2 | Very low | 42.1 | Very low | 50 Ų | 50 | 101 Ų | 101 | 31% | 0.307 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -72.2 | -36.6 | 179.5 | 36.2 | 0 | 0 | 0 | 0 | 112.9 | F13 R14 | F13-T17 HydrophobicContact CE1-CG2 4.12Å; F13-T17 HydrophobicContact CZ-CG2 4.14Å; F13-T17 PolarHBondContact O-N 3Å; F13-T17 VanDerWaalsContact O-N 3.1Å; F13-T17 PolarHBondContact O-OG1 3.37Å; R14-T17 WeakPolarHBondContact CA-OG1 3.28Å; R14-T17 PolarHBondContact O-N 3.41Å; R14-T17 PolarHBondContact O-OG1 2.93Å; R14-T17 VanDerWaalsContact O-OG1 3.09Å |
| 18 | S | 48.8 | Very low | 41.5 | Very low | 66 Ų | 66 | 104.2 Ų | 104.2 | 46% | 0.462 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -70.7 | -37.5 | 175 | 60.2 | 0 | 0 | 0 | 0 | 112.9 | R14 T15 L20 | R14-S18 PolarHBondContact O-N 3.02Å; R14-S18 PolarHBondContact O-OG 3.15Å; T15-S18 PolarHBondContact O-OG 3.44Å; S18-L20 VanDerWaalsContact C-N 3.31Å; S18-L20 PolarHBondContact O-N 3.22Å |
| 19 | G | 37.8 | Very low | 40.4 | Very low | 47 Ų | 47 | 107.6 Ų | 107.6 | 49% | 0.485 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -66.8 | -26.4 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | T15 | T15-G19 PolarHBondContact O-N 3.1Å |
| 20 | L | 39.2 | Very low | 39.9 | Very low | 113 Ų | 113 | 116.5 Ų | 116.5 | 59% | 0.592 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -91.2 | -18.1 | -179 | -86.4 | 159.8 | 0 | 0 | 0 | 114.3 | I16 S18 Y22 | I16-L20 HydrophobicContact CG2-CD1 4.13Å; I16-L20 PolarHBondContact O-N 3.27Å; S18-L20 VanDerWaalsContact C-N 3.31Å; S18-L20 PolarHBondContact O-N 3.22Å; L20-Y22 VanDerWaalsContact C-N 3.26Å; L20-Y22 PolarHBondContact O-N 3.42Å |
| 21 | Q | 37.5 | Very low | 38.7 | Very low | 158 Ų | 158 | 120.7 Ų | 120.7 | 74% | 0.738 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -69.2 | -24.1 | 173.8 | -85.4 | 177.5 | -41 | 0 | 0 | 112.8 | ||
| 22 | Y | 33.5 | Very low | 37.7 | Very low | 216 Ų | 216 | 123 Ų | 123 | 85% | 0.847 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | -12.5 | -180 | -108.8 | -89.2 | 0 | 0 | 0 | 114.7 | L20 | L20-Y22 VanDerWaalsContact C-N 3.26Å; L20-Y22 PolarHBondContact O-N 3.42Å |
| 23 | L | 37.9 | Very low | 36.6 | Very low | 152 Ų | 152 | 125.5 Ų | 125.5 | 80% | 0.796 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.2 | 2.4 | 180 | -72.7 | 168.1 | 0 | 0 | 0 | 113.6 | ||
| 24 | G | 31.3 | Very low | 35.5 | Very low | 65 Ų | 65 | 125.9 Ų | 125.9 | 67% | 0.67 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -104.2 | 8 | -173.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 25 | S | 35.5 | Very low | 34.5 | Very low | 99 Ų | 99 | 125 Ų | 125 | 69% | 0.692 | 70% | 0.696 | S | S | * | * | trans | -120.6 | 80.6 | -177.9 | -175.4 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 26 | N | 31.8 | Very low | 33.4 | Very low | 167 Ų | 167 | 127.6 Ų | 127.6 | 89% | 0.893 | 71% | 0.706 | S | S | * | * | trans | -153.1 | 81.7 | 157.1 | -89.8 | -22.9 | 0 | 0 | 0 | 107.2 | ||||
| 27 | D | 32.8 | Very low | 32.4 | Very low | 154 Ų | 154 | 127.3 Ų | 127.3 | 82% | 0.824 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 119.9 | 170.1 | -76.8 | -38.4 | 0 | 0 | 0 | 109.1 | ||
| 28 | A | 30 | Very low | 31.3 | Very low | 101 Ų | 101 | 131.9 Ų | 131.9 | 84% | 0.835 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 116.9 | 169 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||
| 29 | I | 26.7 | Very low | 30.2 | Very low | 156 Ų | 156 | 138.1 Ų | 138.1 | 80% | 0.8 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -98.7 | 120.2 | 168.9 | -66.8 | 172.8 | 0 | 0 | 0 | 107.4 | ||
| 30 | Y | 27.3 | Very low | 29.6 | Very low | 219 Ų | 219 | 141.5 Ų | 141.5 | 86% | 0.859 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 128.8 | 165.1 | -118.6 | -90.7 | 0 | 0 | 0 | 107.7 | ||
| 31 | D | 27.1 | Very low | 28.9 | Very low | 162 Ų | 162 | 146 Ų | 146 | 87% | 0.866 | 79% | 0.786 | S | S | * | * | trans | -146.3 | 138.3 | 152.9 | -127.4 | -10.6 | 0 | 0 | 0 | 109.3 | ||||
| 32 | D | 26.7 | Very low | 28.2 | Very low | 136 Ų | 136 | 142.4 Ų | 142.4 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | -109.3 | 164.1 | -172.6 | -163.9 | 5.7 | 0 | 0 | 0 | 110.7 | ||||
| 33 | T | 25.8 | Very low | 27.6 | Very low | 110 Ų | 110 | 136 Ų | 136 | 68% | 0.675 | 79% | 0.791 | S | S | * | * | trans | 100.3 | 98.3 | 162.8 | 66.9 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 34 | T | 25.9 | Very low | 26.9 | Very low | 123 Ų | 123 | 137 Ų | 137 | 76% | 0.755 | 80% | 0.796 | S | S | * | * | 67.8 | 132.7 | 125.9 | 58.4 | 0 | 0 | 0 | 0 | 122.9 | |||||
| 35 | I | 27.8 | Very low | 26.5 | Very low | 145 Ų | 145 | 139 Ų | 139 | 74% | 0.744 | 80% | 0.8 | S | S | * | * | trans | 130.6 | 119.1 | 136.8 | -62.1 | -176.6 | 0 | 0 | 0 | 115.5 | ||||
| 36 | N | 25 | Very low | 25.9 | Very low | 148 Ų | 148 | 139.8 Ų | 139.8 | 79% | 0.791 | 80% | 0.8 | S | S | * | * | trans | 69.8 | 114.2 | 151.5 | -65.5 | -13.3 | 0 | 0 | 0 | 124.7 | ||||
| 37 | A | 25.6 | Very low | 25.6 | Very low | 86 Ų | 86 | 140.1 Ų | 140.1 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | 44.8 | 138.2 | 119.1 | 0 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 38 | D | 24.2 | Very low | 25.3 | Very low | 146 Ų | 146 | 142 Ų | 142 | 78% | 0.781 | 80% | 0.797 | S | S | * | * | trans | 65.8 | 115.9 | 157.1 | -68.9 | -19.3 | 0 | 0 | 0 | 120.1 | ||||
| 39 | F | 23.9 | Very low | 25.1 | Very low | 197 Ų | 197 | 142.6 Ų | 142.6 | 86% | 0.864 | 79% | 0.792 | S | S | * | * | 170.6 | 136.3 | 102.8 | -117 | -93 | 0 | 0 | 0 | 112.1 | |||||
| 40 | T | 25.6 | Very low | 25 | Very low | 118 Ų | 118 | 142.7 Ų | 142.7 | 72% | 0.724 | 79% | 0.794 | S | S | * | * | trans | -73.4 | 162.7 | 170.3 | 44.3 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 41 | K | 24.4 | Very low | 24.9 | Very low | 209 Ų | 209 | 137.4 Ų | 137.4 | 91% | 0.909 | 79% | 0.789 | S | S | * | * | trans | 85.1 | 114.9 | 152.9 | -93.4 | 178 | 174.3 | 174.9 | 0 | 119.1 | ||||
| 42 | G | 22.5 | Very low | 24.7 | Very low | 82 Ų | 82 | 133 Ų | 133 | 85% | 0.845 | 77% | 0.774 | S | S | * | * | 83.7 | 134.6 | 117.6 | 0 | 0 | 0 | 0 | 0 | 117.5 | |||||
| 43 | G | 22.8 | Very low | 24.6 | Very low | 82 Ų | 82 | 135.1 Ų | 135.1 | 85% | 0.845 | 78% | 0.778 | S | S | * | * | trans | 156.7 | 85.7 | 164 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 44 | L | 23.1 | Very low | 24.5 | Very low | 173 Ų | 173 | 136.5 Ų | 136.5 | 91% | 0.906 | 78% | 0.78 | S | S | * | * | trans | -69.9 | 149.7 | 165.2 | -157.9 | 85.7 | 0 | 0 | 0 | 110.8 | ||||
| 45 | S | 21.8 | Very low | 24.3 | Very low | 107 Ų | 107 | 134.8 Ų | 134.8 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | trans | 151.3 | 140.3 | 145.8 | 59.1 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 46 | V | 23.9 | Very low | 24.1 | Very low | 114 Ų | 114 | 134.4 Ų | 134.4 | 69% | 0.691 | 77% | 0.773 | S | S | * | * | -171.1 | 113.6 | 60.7 | 161.1 | 0 | 0 | 0 | 0 | 104.4 | |||||
| 47 | Q | 24.2 | Very low | 24 | Very low | 174 Ų | 174 | 131.9 Ų | 131.9 | 81% | 0.813 | 77% | 0.767 | S | S | * | * | 93.5 | 111.2 | 93.6 | -157.8 | 159.1 | -6.6 | 0 | 0 | 114.3 | |||||
| 48 | K | 26.2 | Very low | 23.9 | Very low | 194 Ų | 194 | 137.3 Ų | 137.3 | 84% | 0.843 | 77% | 0.774 | S | S | * | * | trans | -73.9 | 162.3 | 154.3 | -101.8 | 178.8 | 175.8 | 176 | 0 | 109.6 | ||||
| 49 | P | 27.2 | Very low | 24.6 | Very low | 114 Ų | 114 | 135.3 Ų | 135.3 | 74% | 0.74 | 77% | 0.769 | S | S | * | * | -131.7 | 132.9 | 116.8 | 11.5 | 10.1 | 0 | 0 | 0 | 111.4 | |||||
| 50 | L | 23.6 | Very low | 24.5 | Very low | 158 Ų | 158 | 133.1 Ų | 133.1 | 83% | 0.827 | 77% | 0.767 | S | S | * | * | 89.4 | 117.4 | 86.5 | -147.9 | 90.2 | 0 | 0 | 0 | 109.2 | |||||
| 51 | S | 25.1 | Very low | 24.4 | Very low | 108 Ų | 108 | 137.2 Ų | 137.2 | 76% | 0.755 | 77% | 0.774 | S | S | * | * | -149.7 | 126.7 | 62.5 | 39.8 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 52 | A | 24.4 | Very low | 24.5 | Very low | 68 Ų | 68 | 133.7 Ų | 133.7 | 56% | 0.562 | 77% | 0.77 | S | S | * | * | 66.7 | 118.9 | 76.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 53 | F | 23.4 | Very low | 25.3 | Very low | 182 Ų | 182 | 135.7 Ų | 135.7 | 80% | 0.798 | 77% | 0.768 | S | S | * | * | -167.6 | 144.2 | 59.1 | -104.9 | -86.3 | 0 | 0 | 0 | 113.7 | |||||
| 54 | L | 23.7 | Very low | 25.3 | Very low | 138 Ų | 138 | 135 Ų | 135 | 72% | 0.723 | 76% | 0.76 | S | S | * | * | trans | 55.5 | 116.6 | 149.5 | -70.7 | 156.1 | 0 | 0 | 0 | 120.9 | ||||
| 55 | S | 22.3 | Very low | 25.4 | Very low | 87 Ų | 87 | 134.3 Ų | 134.3 | 61% | 0.608 | 76% | 0.758 | S | S | * | * | 69.7 | 144.8 | 69.4 | 107.2 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 56 | N | 22.7 | Very low | 25.7 | Very low | 138 Ų | 138 | 138.2 Ų | 138.2 | 74% | 0.738 | 76% | 0.764 | S | S | * | * | cis | -170.2 | 139.9 | 9.8 | -104.4 | -13.7 | 0 | 0 | 0 | 105.2 | ||||
| 57 | S | 23.3 | Very low | 25.9 | Very low | 95 Ų | 95 | 141.6 Ų | 141.6 | 66% | 0.664 | 77% | 0.773 | S | S | * | * | 65.8 | 114.7 | 107.5 | -51 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 58 | F | 22.7 | Very low | 25.9 | Very low | 200 Ų | 200 | 141.2 Ų | 141.2 | 88% | 0.877 | 78% | 0.775 | S | S | * | * | trans | 68.4 | 168.6 | 144.9 | -76.7 | -74.3 | 0 | 0 | 0 | 121.3 | ||||
| 59 | P | 39 | Very low | 26.1 | Very low | 103 Ų | 103 | 139.5 Ų | 139.5 | 67% | 0.669 | 77% | 0.774 | S | S | * | * | -125 | -171.9 | -91.3 | 35.7 | -12.6 | 0 | 0 | 0 | 114.6 | |||||
| 60 | D | 22.9 | Very low | 26 | Very low | 152 Ų | 152 | 141.9 Ų | 141.9 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | trans | 87.4 | 135.1 | 159 | -78.9 | -24.1 | 0 | 0 | 0 | 123.5 | ||||
| 61 | K | 23.5 | Very low | 26.2 | Very low | 204 Ų | 204 | 144 Ų | 144 | 89% | 0.887 | 78% | 0.782 | S | S | * | * | trans | 89.1 | 110.9 | 152.6 | -78.1 | 178.1 | 177.9 | 178.5 | 0 | 122.6 | ||||
| 62 | V | 26.9 | Very low | 26.2 | Very low | 134 Ų | 134 | 142.1 Ų | 142.1 | 81% | 0.812 | 78% | 0.78 | S | S | * | * | trans | -48.5 | 165.9 | 152 | 171.9 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 63 | P | 37.7 | Very low | 26.5 | Very low | 125 Ų | 125 | 146.7 Ų | 146.7 | 81% | 0.812 | 79% | 0.793 | S | S | * | * | cis | -129.2 | 174.2 | 2.1 | 19.9 | 4.6 | 0 | 0 | 0 | 116 | ||||
| 64 | G | 24.6 | Very low | 26.8 | Very low | 66 Ų | 66 | 143.4 Ų | 143.4 | 68% | 0.68 | 79% | 0.79 | S | S | * | * | trans | 154.7 | 89.7 | 153.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 65 | D | 25.4 | Very low | 26.9 | Very low | 160 Ų | 160 | 146 Ų | 146 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | trans | 53.4 | 138.8 | 143.6 | -51.3 | -27.7 | 0 | 0 | 0 | 124.3 | ||||
| 66 | E | 27.5 | Very low | 27.1 | Very low | 188 Ų | 188 | 151.2 Ų | 151.2 | 88% | 0.879 | 81% | 0.808 | S | S | * | * | trans | 100.3 | 131.2 | 154.8 | -59.1 | -161.5 | 150.7 | 0 | 0 | 121.4 | ||||
| 67 | E | 27.1 | Very low | 27.3 | Very low | 186 Ų | 186 | 149.9 Ų | 149.9 | 87% | 0.869 | 81% | 0.807 | S | S | * | * | trans | -47.2 | 136.8 | -165.9 | -65.3 | 172.5 | 133.3 | 0 | 0 | 117.5 | ||||
| 68 | L | 25.6 | Very low | 27.7 | Very low | 166 Ų | 166 | 150.9 Ų | 150.9 | 87% | 0.869 | 81% | 0.809 | S | S | * | * | trans | -141 | 119.7 | 154.6 | -153.8 | 89.3 | 0 | 0 | 0 | 111.8 | L70 | L68-L70 PolarHBondContact O-N 3.4Š| ||
| 69 | I | 29.6 | Very low | 27.9 | Very low | 158 Ų | 158 | 148.6 Ų | 148.6 | 81% | 0.81 | 81% | 0.806 | S | S | * | * | trans | -63.2 | 118.2 | 169.8 | -65.4 | -179.8 | 0 | 0 | 0 | 109.4 | ||||
| 70 | L | 25.8 | Very low | 27.8 | Very low | 164 Ų | 164 | 147.7 Ų | 147.7 | 86% | 0.859 | 81% | 0.807 | S | S | * | * | trans | -148.1 | 120.7 | 154.5 | -151.8 | 72.1 | 0 | 0 | 0 | 112.1 | L68 | L68-L70 PolarHBondContact O-N 3.4Š| ||
| 71 | K | 26.9 | Very low | 28.5 | Very low | 201 Ų | 201 | 146.8 Ų | 146.8 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -55 | 129.2 | 179.2 | -75.3 | 174.4 | 171.2 | 177.5 | 0 | 111.7 | ||
| 72 | G | 26.2 | Very low | 28.9 | Very low | 70 Ų | 70 | 145 Ų | 145 | 72% | 0.722 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 152.1 | 172 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 73 | I | 29.1 | Very low | 29 | Very low | 163 Ų | 163 | 146.2 Ų | 146.2 | 84% | 0.836 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 146 | 156.9 | -58.3 | 160 | 0 | 0 | 0 | 108.1 | ||
| 74 | P | 30.2 | Very low | 28.6 | Very low | 114 Ų | 114 | 151 Ų | 151 | 74% | 0.74 | 82% | 0.817 | S | S | * | * | -137.8 | 133.7 | 117.4 | 19.8 | 1 | 0 | 0 | 0 | 111.4 | |||||
| 75 | F | 26.1 | Very low | 29.1 | Very low | 192 Ų | 192 | 150.9 Ų | 150.9 | 84% | 0.842 | 82% | 0.817 | S | S | * | * | 61.1 | 104.7 | 85.9 | -127.4 | -90.1 | 0 | 0 | 0 | 113 | |||||
| 76 | F | 26 | Very low | 29.3 | Very low | 196 Ų | 196 | 150.8 Ų | 150.8 | 86% | 0.86 | 82% | 0.816 | S | S | * | * | trans | -66.9 | 148.9 | 166.8 | -90 | -90.3 | 0 | 0 | 0 | 111 | ||||
| 77 | P | 28.4 | Very low | 29.3 | Very low | 111 Ų | 111 | 153.8 Ų | 153.8 | 72% | 0.721 | 82% | 0.819 | S | S | * | * | -133.1 | 128 | 121.2 | 28.6 | -12.8 | 0 | 0 | 0 | 113.9 | |||||
| 78 | T | 29.9 | Very low | 29.4 | Very low | 115 Ų | 115 | 150.4 Ų | 150.4 | 71% | 0.706 | 82% | 0.816 | S | S | * | * | trans | 24 | 126.3 | 137.7 | 55 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 79 | N | 27.6 | Very low | 29.6 | Very low | 153 Ų | 153 | 145.9 Ų | 145.9 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | trans | 68.4 | 105.2 | 154.4 | -64.6 | -8 | 0 | 0 | 0 | 116.9 | ||||
| 80 | A | 36.6 | Very low | 29.5 | Very low | 84 Ų | 84 | 148.8 Ų | 148.8 | 69% | 0.694 | 82% | 0.817 | S | S | * | * | 86.1 | 135 | 69.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | |||||
| 81 | T | 37.7 | Very low | 29.8 | Very low | 133 Ų | 133 | 144.5 Ų | 144.5 | 82% | 0.816 | 81% | 0.812 | S | S | * | * | trans | 66.4 | 91 | 176.6 | 56.3 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 82 | D | 31.3 | Very low | 29.8 | Very low | 167 Ų | 167 | 142.7 Ų | 142.7 | 89% | 0.893 | 81% | 0.812 | S | S | * | * | trans | 171.4 | 8.9 | 141 | -92.5 | -10.8 | 0 | 0 | 0 | 115.9 | ||||
| 83 | L | 28.9 | Very low | 30.3 | Very low | 159 Ų | 159 | 149 Ų | 149 | 83% | 0.832 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -109.5 | 37 | -172.7 | -144.2 | 87 | 0 | 0 | 0 | 116.5 | ||
| 84 | F | 30.6 | Very low | 30.6 | Very low | 224 Ų | 224 | 143.9 Ų | 143.9 | 98% | 0.982 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -145.3 | 57.2 | 163.1 | -83.7 | -75.9 | 0 | 0 | 0 | 111 | ||
| 85 | G | 34.1 | Very low | 31 | Very low | 65 Ų | 65 | 145.6 Ų | 145.6 | 67% | 0.67 | 82% | 0.819 | S | S | * | * | trans | -128.3 | 128 | 167.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 86 | N | 30.4 | Very low | 31.5 | Very low | 158 Ų | 158 | 139.4 Ų | 139.4 | 85% | 0.845 | 81% | 0.809 | S | S | * | * | trans | 78.4 | 88.8 | 174.2 | -72 | -12 | 0 | 0 | 0 | 118.5 | ||||
| 87 | R | 26.4 | Very low | 32.6 | Very low | 251 Ų | 251 | 134.5 Ų | 134.5 | 95% | 0.947 | 79% | 0.791 | S | S | * | * | trans | -129.3 | 77.6 | 137 | -146.3 | 176.7 | -161.2 | -170.7 | 4.2 | 109.6 | G89 | R87-G89 PolarHBondContact O-N 2.93Å; R87-G89 VanDerWaalsContact O-N 3.12Å | ||
| 88 | S | 31.3 | Very low | 33.4 | Very low | 114 Ų | 114 | 137.5 Ų | 137.5 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | trans | -74 | 94.3 | 168.3 | 54.2 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 89 | G | 28.1 | Very low | 34.8 | Very low | 71 Ų | 71 | 135.8 Ų | 135.8 | 73% | 0.732 | 79% | 0.787 | S | S | * | * | trans | -86 | 134.9 | 163.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | R87 | R87-G89 PolarHBondContact O-N 2.93Å; R87-G89 VanDerWaalsContact O-N 3.12Å | ||
| 90 | F | 28.3 | Very low | 35.9 | Very low | 219 Ų | 219 | 130.2 Ų | 130.2 | 96% | 0.961 | 77% | 0.765 | S | S | * | * | trans | -43.4 | 131.6 | 177.9 | -128.3 | -112.5 | 0 | 0 | 0 | 115.6 | ||||
| 91 | G | 31.9 | Very low | 36.6 | Very low | 75 Ų | 75 | 133.6 Ų | 133.6 | 77% | 0.773 | 77% | 0.767 | S | S | * | * | trans | 37.1 | 108.8 | 147.1 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 92 | D | 27.3 | Very low | 37.1 | Very low | 163 Ų | 163 | 135 Ų | 135 | 87% | 0.872 | 77% | 0.769 | S | S | * | * | -148.8 | 124.1 | 128.2 | -152.9 | 8.9 | 0 | 0 | 0 | 109.1 | G94 | D92-G94 PolarHBondContact O-N 3.48Š| |||
| 93 | E | 36.5 | Very low | 37.9 | Very low | 203 Ų | 203 | 134.4 Ų | 134.4 | 95% | 0.949 | 76% | 0.759 | S | S | * | * | trans | -74.8 | 76.1 | 173.1 | -81.2 | -173.9 | 143 | 0 | 0 | 109 | ||||
| 94 | G | 34.6 | Very low | 39.4 | Very low | 54 Ų | 54 | 130.9 Ų | 130.9 | 56% | 0.557 | 74% | 0.739 | S | S | * | * | trans | -108.4 | 135.5 | 155.9 | 0 | 0 | 0 | 0 | 0 | 107.6 | D92 G96 | D92-G94 PolarHBondContact O-N 3.48Å; G94-G96 PolarHBondContact O-N 3.07Å | ||
| 95 | T | 40.1 | Very low | 41.3 | Very low | 151 Ų | 151 | 122.5 Ų | 122.5 | 93% | 0.926 | 71% | 0.705 | S | S | * | * | trans | -60.5 | 82.1 | 164.9 | 45.9 | 0 | 0 | 0 | 0 | 108.8 | I97 | T95-I97 PolarHBondContact O-N 3.04Š| ||
| 96 | G | 35.7 | Very low | 43.4 | Very low | 61 Ų | 61 | 120.4 Ų | 120.4 | 63% | 0.629 | 68% | 0.678 | S | S | * | * | trans | -71.7 | 116.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | G94 Q98 | G94-G96 PolarHBondContact O-N 3.07Å; G96-Q98 PolarHBondContact O-N 3.36Å | ||
| 97 | I | 49.4 | Very low | 45.8 | Very low | 94 Ų | 94 | 116 Ų | 116 | 48% | 0.482 | 65% | 0.652 | S | S | . | * | trans | -60.1 | 102.5 | 169.1 | -60.5 | 166.7 | 0 | 0 | 0 | 106.5 | T95 C99 E107 | T95-I97 PolarHBondContact O-N 3.04Å; I97-C99 PolarHBondContact O-N 2.66Å; I97-E107 HydrophobicContact CD1-CB 4.22Å; I97-E107 VanDerWaalsContact CD1-OE2 3.25Å; I97-E107 WeakPolarHBondContact CD1-OE2 3.42Å | ||
| 98 | Q | 44.7 | Very low | 48.5 | Very low | 173 Ų | 173 | 104.9 Ų | 104.9 | 81% | 0.808 | 61% | 0.613 | S | S | * | * | trans | -82.4 | 93.7 | 173.8 | -79 | -174.2 | -10 | 0 | 0 | 108.5 | G96 G100 | G96-Q98 PolarHBondContact O-N 3.36Å; Q98-G100 PolarHBondContact O-N 2.89Å | ||
| 99 | C | 58.5 | Low | 51 | Low | 80 Ų | 80 | 100.5 Ų | 100.5 | 54% | 0.541 | 58% | 0.579 | S | S | . | * | trans | -70.8 | 83.7 | 166.6 | -57.5 | 0 | 0 | 0 | 0 | 108.6 | I97 C108 | I97-C99 PolarHBondContact O-N 2.66Å; C99-C108 WeakPolarHBondContact CA-SG 3.26Å; C99-C108 HydrophobicContact CB-CB 3.82Å; C99-C108 WeakPolarHBondContact CB-SG 3.44Å; C99-C108 VanDerWaalsContact SG-CA 3.56Å; C99-C108 WeakPolarHBondContact SG-CB 3.36Å; C99-C108 CovalentContact SG-SG 2.03Å; C99-C108 PolarHBondContact SG-SG 3.46Å | ||
| 100 | G | 51.1 | Low | 53.7 | Low | 35 Ų | 35 | 98.1 Ų | 98.1 | 36% | 0.361 | 55% | 0.549 | S | S | . | . | B | Isolated β-bridge | trans | -127.1 | 162.8 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q98 N102 F103 | Q98-G100 PolarHBondContact O-N 2.89Å; G100-N102 PolarHBondContact O-N 3.35Å; G100-F103 PolarHBondContact O-N 2.9Å; G100-F103 VanDerWaalsContact O-N 3.1Å |
| 101 | E | 52.5 | Low | 56.5 | Low | 155 Ų | 155 | 89.9 Ų | 89.9 | 72% | 0.724 | 52% | 0.515 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.7 | -11.2 | -168.9 | -66 | -175.8 | 154.5 | 0 | 0 | 116 | K371 | E101-K371 IonicContact OE1-NZ 3.05Å; E101-K371 PolarHBondContact OE1-NZ 3.35Å |
| 102 | N | 47.1 | Very low | 59.3 | Low | 164 Ų | 164 | 86.8 Ų | 86.8 | 88% | 0.877 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.8 | -2.4 | -175.8 | -63.1 | -49.3 | 0 | 0 | 0 | 115 | G100 | G100-N102 PolarHBondContact O-N 3.35Š|
| 103 | F | 48.4 | Very low | 62.3 | Low | 153 Ų | 153 | 82 Ų | 82 | 67% | 0.671 | 46% | 0.457 | S | S | * | . | B | Isolated β-bridge | trans | -145.1 | 94.6 | 178.1 | -156.8 | -95.7 | 0 | 0 | 0 | 111.2 | G100 D105 | G100-F103 PolarHBondContact O-N 2.9Å; G100-F103 VanDerWaalsContact O-N 3.1Å; F103-D105 PolarHBondContact O-N 3.19Å |
| 104 | M | 60.5 | Low | 65 | Low | 86 Ų | 86 | 77.3 Ų | 77.3 | 42% | 0.424 | 44% | 0.444 | S | S | . | . | trans | -85.1 | 92.5 | 177 | -66.8 | -64.6 | -175 | 0 | 0 | 109.7 | F109 | M104-F109 HydrophobicContact SD-CE2 4.4Å; M104-F109 HydrophobicContact SD-CZ 4.33Å | ||
| 105 | D | 71.3 | Confident | 67.8 | Low | 47 Ų | 47 | 78.9 Ų | 78.9 | 25% | 0.251 | 45% | 0.447 | S | S | . | . | trans | -78.4 | 138.4 | 165 | -153.7 | -15.4 | 0 | 0 | 0 | 109.4 | F103 E107 C108 K184 | F103-D105 PolarHBondContact O-N 3.19Å; D105-E107 PolarHBondContact O-N 2.71Å; D105-E107 VanDerWaalsContact O-N 3.1Å; D105-C108 WeakPolarHBondContact O-CB 3.3Å; D105-C108 PolarHBondContact O-N 2.98Å; D105-K184 IonicContact OD2-NZ 2.69Å | ||
| 106 | M | 78.3 | Confident | 70.4 | Confident | 21 Ų | 21 | 74.2 Ų | 74.2 | 10% | 0.103 | 41% | 0.414 | C | S | . | . | G | 310 helix | trans | -59.8 | -24.4 | -178.2 | -75.9 | -74.3 | -169.7 | 0 | 0 | 112.2 | C108 F109 F178 F190 P270 L271 | M106-C108 PolarHBondContact O-N 3.46Å; M106-F109 PolarHBondContact O-N 3.44Å; M106-F178 HydrophobicContact SD-CE2 4.12Å; M106-F190 HydrophobicContact CE-CB 3.88Å; M106-F190 HydrophobicContact CE-CD1 3.81Å; M106-F190 HydrophobicContact CE-CD2 3.88Å; M106-F190 HydrophobicContact CE-CE1 4.36Å; M106-F190 HydrophobicContact CE-CE2 4.4Å; M106-F190 HydrophobicContact CE-CG 3.55Å; M106-F190 HydrophobicContact SD-CD2 4.35Å; M106-F190 HydrophobicContact SD-CE2 4.47Å; M106-P270 HydrophobicContact CE-CB 3.7Å; M106-P270 HydrophobicContact CE-CG 4.45Å; M106-P270 HydrophobicContact SD-CB 3.31Å; M106-P270 WeakPolarHBondContact SD-CB 3.45Å; M106-P270 HydrophobicContact SD-CG 3.55Å; M106-P270 VanDerWaalsContact SD-CG 3.55Å; M106-L271 HydrophobicContact CE-CD1 3.41Å; M106-L271 VanDerWaalsContact CE-CD1 3.41Å; M106-L271 HydrophobicContact CE-CG 4.2Å |
| 107 | E | 80.7 | Confident | 73.2 | Confident | 67 Ų | 67 | 73 Ų | 73 | 31% | 0.313 | 39% | 0.392 | S | S | . | . | G | 310 helix | trans | -63.4 | -26.7 | 177.4 | -69.4 | -178.3 | 154.5 | 0 | 0 | 113.2 | I97 D105 F109 M110 K184 | I97-E107 HydrophobicContact CD1-CB 4.22Å; I97-E107 VanDerWaalsContact CD1-OE2 3.25Å; I97-E107 WeakPolarHBondContact CD1-OE2 3.42Å; D105-E107 PolarHBondContact O-N 2.71Å; D105-E107 VanDerWaalsContact O-N 3.1Å; E107-F109 PolarHBondContact O-N 2.82Å; E107-F109 VanDerWaalsContact O-N 3.08Å; E107-M110 PolarHBondContact O-N 3.27Å; E107-K184 WeakPolarHBondContact OE1-CE 3.45Å; E107-K184 IonicContact OE1-NZ 3.52Å; E107-K184 PolarHBondContact OE1-NZ 3.42Å; E107-K184 IonicContact OE2-NZ 2.88Å; E107-K184 PolarHBondContact OE2-NZ 3.34Å |
| 108 | C | 82.4 | Confident | 75.4 | Confident | 17 Ų | 17 | 74 Ų | 74 | 12% | 0.115 | 40% | 0.398 | C | S | . | . | G | 310 helix | trans | -64.4 | -14.8 | 178.1 | -65.2 | 0 | 0 | 0 | 0 | 113.8 | C99 D105 M106 | C99-C108 WeakPolarHBondContact CA-SG 3.26Å; C99-C108 HydrophobicContact CB-CB 3.82Å; C99-C108 WeakPolarHBondContact CB-SG 3.44Å; C99-C108 VanDerWaalsContact SG-CA 3.56Å; C99-C108 WeakPolarHBondContact SG-CB 3.36Å; C99-C108 CovalentContact SG-SG 2.03Å; C99-C108 PolarHBondContact SG-SG 3.46Å; D105-C108 WeakPolarHBondContact O-CB 3.3Å; D105-C108 PolarHBondContact O-N 2.98Å; M106-C108 PolarHBondContact O-N 3.46Å |
| 109 | F | 83.1 | Confident | 77.8 | Confident | 21 Ų | 21 | 67.7 Ų | 67.7 | 9% | 0.092 | 38% | 0.375 | C | S | . | . | G | 310 helix | trans | -101.4 | -7.4 | 179.2 | -60.9 | -100.2 | 0 | 0 | 0 | 111.8 | M104 M106 E107 I111 F178 D267 P270 | M104-F109 HydrophobicContact SD-CE2 4.4Å; M104-F109 HydrophobicContact SD-CZ 4.33Å; M106-F109 PolarHBondContact O-N 3.44Å; E107-F109 PolarHBondContact O-N 2.82Å; E107-F109 VanDerWaalsContact O-N 3.08Å; F109-I111 PolarHBondContact O-N 3.17Å; F109-F178 HydrophobicContact CB-CE1 4.14Å; F109-F178 HydrophobicContact CB-CZ 3.77Å; F109-D267 WeakPolarHBondContact CD1-O 3.21Å; F109-D267 WeakPolarHBondContact CE1-O 3.38Å; F109-P270 HydrophobicContact CB-CG 4.27Å; F109-P270 HydrophobicContact CD1-CG 3.77Å; F109-P270 HydrophobicContact CD2-CB 4.37Å; F109-P270 HydrophobicContact CD2-CG 3.7Å; F109-P270 HydrophobicContact CE1-CG 3.93Å; F109-P270 HydrophobicContact CE2-CB 4.12Å; F109-P270 HydrophobicContact CE2-CG 3.88Å; F109-P270 HydrophobicContact CG-CG 3.65Å; F109-P270 HydrophobicContact CZ-CB 4.21Å; F109-P270 HydrophobicContact CZ-CG 4Å |
| 110 | M | 85.1 | Confident | 79.4 | Confident | 22 Ų | 22 | 63.9 Ų | 63.9 | 11% | 0.108 | 35% | 0.35 | C | S | . | . | trans | -93 | 65.3 | -179.1 | -61.7 | 176.5 | 178.7 | 0 | 0 | 110.8 | E107 F178 H182 | E107-M110 PolarHBondContact O-N 3.27Å; M110-F178 HydrophobicContact CE-CD2 3.84Å; M110-F178 HydrophobicContact CE-CE2 3.81Å; M110-F178 HydrophobicContact CE-CG 4.38Å; M110-F178 HydrophobicContact CE-CZ 4.31Å; M110-F178 HydrophobicContact CG-CE1 4.27Å; M110-F178 HydrophobicContact CG-CZ 4.28Å; M110-H182 HydrophobicContact CE-CB 4.48Å; M110-H182 HydrophobicContact SD-CB 3.71Å; M110-H182 VanDerWaalsContact SD-CD2 3.53Å | ||
| 111 | I | 87.5 | Confident | 81.5 | Confident | 45 Ų | 45 | 62.9 Ų | 62.9 | 23% | 0.231 | 34% | 0.338 | C | S | . | . | trans | -94.6 | -3.2 | -170.4 | 61.3 | 162 | 0 | 0 | 0 | 115 | F109 D374 K377 T378 | F109-I111 PolarHBondContact O-N 3.17Å; I111-D374 HydrophobicContact CD1-CB 3.99Å; I111-D374 WeakPolarHBondContact CD1-O 3.26Å; I111-K377 HydrophobicContact CD1-CB 3.36Å; I111-K377 HydrophobicContact CD1-CD 4.24Å; I111-K377 HydrophobicContact CD1-CG 4.44Å; I111-K377 HydrophobicContact CG1-CB 4.43Å; I111-T378 WeakPolarHBondContact CD1-OG1 3.27Å | ||
| 112 | L | 90 | Very high | 83.6 | Confident | 10 Ų | 10 | 59.2 Ų | 59.2 | 5% | 0.052 | 33% | 0.326 | C | S | . | . | trans | -70.9 | 138.1 | -174 | -71.3 | 96.9 | 0 | 0 | 0 | 111.7 | Q116 Q117 V120 H179 A381 | L112-Q116 HydrophobicContact CB-CB 4.29Å; L112-Q116 HydrophobicContact CD2-CB 4.04Å; L112-Q117 HydrophobicContact CB-CG 3.71Å; L112-Q117 PolarHBondContact O-NE2 3.29Å; L112-V120 HydrophobicContact CD2-CG2 3.96Å; L112-H179 HydrophobicContact CD1-CB 4.18Å; L112-H179 WeakPolarHBondContact CD1-CD2 3.35Å; L112-A381 HydrophobicContact CD1-CB 4.22Å; L112-A381 HydrophobicContact CD2-CB 4.22Å | ||
| 113 | T | 92 | Very high | 85.9 | Confident | 62 Ų | 62 | 55 Ų | 55 | 38% | 0.38 | 30% | 0.302 | S | S | . | . | trans | -71.8 | 157.9 | 171.4 | 61.9 | 0 | 0 | 0 | 0 | 111.7 | S115 Q116 Q117 | T113-S115 VanDerWaalsContact C-N 3.25Å; T113-S115 PolarHBondContact O-N 3.32Å; T113-S115 VanDerWaalsContact O-N 3.14Å; T113-S115 PolarHBondContact OG1-OG 2.97Å; T113-Q116 WeakPolarHBondContact O-CB 3.49Å; T113-Q116 PolarHBondContact O-N 3.49Å; T113-Q116 WeakPolarHBondContact OG1-CG 3.48Å; T113-Q116 PolarHBondContact OG1-OE1 3.02Å; T113-Q117 WeakPolarHBondContact O-CG 3.4Å; T113-Q117 PolarHBondContact O-N 2.95Å | ||
| 114 | P | 92.6 | Very high | 88.1 | Confident | 105 Ų | 105 | 47.8 Ų | 47.8 | 68% | 0.682 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -56.4 | -34.6 | -177.9 | -27.9 | 35.2 | 0 | 0 | 0 | 114.7 | L118 | P114-L118 PolarHBondContact O-N 3.31Å |
| 115 | S | 93.5 | Very high | 89.8 | Confident | 87 Ų | 87 | 48 Ų | 48 | 61% | 0.608 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -69.6 | -39.7 | 176.2 | 56.3 | 0 | 0 | 0 | 0 | 112 | T113 A119 | T113-S115 VanDerWaalsContact C-N 3.25Å; T113-S115 PolarHBondContact O-N 3.32Å; T113-S115 VanDerWaalsContact O-N 3.14Å; T113-S115 PolarHBondContact OG1-OG 2.97Å; S115-A119 WeakPolarHBondContact O-CB 3.41Å; S115-A119 PolarHBondContact O-N 2.97Å |
| 116 | Q | 94.3 | Very high | 90.9 | Very high | 53 Ų | 53 | 49.6 Ų | 49.6 | 25% | 0.248 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -69.5 | -40.8 | 175.3 | -66.7 | 164.4 | -27.1 | 0 | 0 | 111.3 | L112 T113 L118 A119 V120 F382 | L112-Q116 HydrophobicContact CB-CB 4.29Å; L112-Q116 HydrophobicContact CD2-CB 4.04Å; T113-Q116 WeakPolarHBondContact O-CB 3.49Å; T113-Q116 PolarHBondContact O-N 3.49Å; T113-Q116 WeakPolarHBondContact OG1-CG 3.48Å; T113-Q116 PolarHBondContact OG1-OE1 3.02Å; Q116-L118 VanDerWaalsContact C-N 3.35Å; Q116-L118 PolarHBondContact O-N 3.45Å; Q116-A119 PolarHBondContact O-N 3.34Å; Q116-V120 WeakPolarHBondContact O-CG2 3.32Å; Q116-V120 PolarHBondContact O-N 3.15Å; Q116-F382 HydrophobicContact CB-CE2 4.39Å; Q116-F382 HydrophobicContact CB-CZ 4.05Å; Q116-F382 HydrophobicContact CG-CE2 4.29Å; Q116-F382 HydrophobicContact CG-CZ 4.14Å |
| 117 | Q | 94.3 | Very high | 91.7 | Very high | 35 Ų | 35 | 50.4 Ų | 50.4 | 16% | 0.164 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -56.9 | -48.2 | 174 | -68.7 | 174.6 | 11.2 | 0 | 0 | 111.1 | L112 T113 A119 V120 A121 H182 | L112-Q117 HydrophobicContact CB-CG 3.71Å; L112-Q117 PolarHBondContact O-NE2 3.29Å; T113-Q117 WeakPolarHBondContact O-CG 3.4Å; T113-Q117 PolarHBondContact O-N 2.95Å; Q117-A119 VanDerWaalsContact C-N 3.35Å; Q117-A119 PolarHBondContact O-N 3.3Å; Q117-V120 PolarHBondContact O-N 3.31Å; Q117-A121 WeakPolarHBondContact O-CB 3.21Å; Q117-A121 PolarHBondContact O-N 3.14Å; Q117-H182 PolarHBondContact NE2-CE1 3.21Å; Q117-H182 PolarHBondContact NE2-NE2 3.43Å |
| 118 | L | 94.8 | Very high | 92.4 | Very high | 116 Ų | 116 | 47.3 Ų | 47.3 | 61% | 0.607 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -59.9 | -44.8 | 175.5 | 179.5 | 63 | 0 | 0 | 0 | 111.6 | P114 Q116 A121 V122 | P114-L118 PolarHBondContact O-N 3.31Å; Q116-L118 VanDerWaalsContact C-N 3.35Å; Q116-L118 PolarHBondContact O-N 3.45Å; L118-A121 PolarHBondContact O-N 2.87Å; L118-V122 HydrophobicContact CD1-CG2 4.17Å; L118-V122 WeakPolarHBondContact O-CG2 3.41Å; L118-V122 PolarHBondContact O-N 2.91Å |
| 119 | A | 95.2 | Very high | 93 | Very high | 40 Ų | 40 | 50.4 Ų | 50.4 | 33% | 0.331 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -60.6 | -49.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S115 Q116 Q117 A121 V122 M123 F382 | S115-A119 WeakPolarHBondContact O-CB 3.41Å; S115-A119 PolarHBondContact O-N 2.97Å; Q116-A119 PolarHBondContact O-N 3.34Å; Q117-A119 VanDerWaalsContact C-N 3.35Å; Q117-A119 PolarHBondContact O-N 3.3Å; A119-A121 VanDerWaalsContact C-N 3.32Å; A119-A121 PolarHBondContact O-N 3.03Å; A119-V122 PolarHBondContact O-N 2.95Å; A119-M123 HydrophobicContact CB-CE 4.43Å; A119-M123 WeakPolarHBondContact O-CB 3.37Å; A119-M123 WeakPolarHBondContact O-CE 3.38Å; A119-M123 VanDerWaalsContact O-CG 3.32Å; A119-M123 WeakPolarHBondContact O-CG 3.41Å; A119-M123 PolarHBondContact O-N 3.29Å; A119-F382 HydrophobicContact CB-CE1 4.5Å |
| 120 | V | 93.7 | Very high | 93.6 | Very high | 1 Ų | 1 | 54 Ų | 54 | 1% | 0.006 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -69 | -33.3 | 179.8 | -170.9 | 0 | 0 | 0 | 0 | 111.4 | L112 Q116 Q117 M123 S124 F175 F382 M385 | L112-V120 HydrophobicContact CD2-CG2 3.96Å; Q116-V120 WeakPolarHBondContact O-CG2 3.32Å; Q116-V120 PolarHBondContact O-N 3.15Å; Q117-V120 PolarHBondContact O-N 3.31Å; V120-M123 HydrophobicContact CG2-CE 4.24Å; V120-M123 PolarHBondContact O-N 2.84Å; V120-S124 VanDerWaalsContact O-CB 3.26Å; V120-S124 WeakPolarHBondContact O-CB 3.45Å; V120-S124 PolarHBondContact O-N 2.92Å; V120-S124 PolarHBondContact O-OG 2.92Å; V120-F175 HydrophobicContact CB-CE1 4.13Å; V120-F175 HydrophobicContact CG1-CD1 3.95Å; V120-F175 HydrophobicContact CG1-CE1 3.09Å; V120-F175 HydrophobicContact CG1-CZ 3.57Å; V120-F382 HydrophobicContact CG2-CD1 3.84Å; V120-F382 HydrophobicContact CG2-CE1 3.41Å; V120-F382 VanDerWaalsContact CG2-CE1 3.41Å; V120-F382 HydrophobicContact CG2-CE2 4.4Å; V120-F382 HydrophobicContact CG2-CG 4.5Å; V120-F382 HydrophobicContact CG2-CZ 3.72Å; V120-M385 HydrophobicContact CG1-CG 4.27Å; V120-M385 HydrophobicContact CG1-SD 3.89Å |
| 121 | A | 95.4 | Very high | 94.1 | Very high | 13 Ų | 13 | 53 Ų | 53 | 11% | 0.107 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.6 | -49.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112 | Q117 L118 A119 S124 L125 L176 V180 | Q117-A121 WeakPolarHBondContact O-CB 3.21Å; Q117-A121 PolarHBondContact O-N 3.14Å; L118-A121 PolarHBondContact O-N 2.87Å; A119-A121 VanDerWaalsContact C-N 3.32Å; A119-A121 PolarHBondContact O-N 3.03Å; A121-S124 PolarHBondContact O-N 3.35Å; A121-S124 PolarHBondContact O-OG 3.25Å; A121-S124 VanDerWaalsContact O-OG 3.09Å; A121-L125 WeakPolarHBondContact O-CB 3.42Å; A121-L125 WeakPolarHBondContact O-CG 3.43Å; A121-L125 PolarHBondContact O-N 3.45Å; A121-L176 HydrophobicContact CB-CD2 3.84Å; A121-V180 HydrophobicContact CB-CG2 3.98Å |
| 122 | V | 96.1 | Very high | 94.5 | Very high | 79 Ų | 79 | 52.6 Ų | 52.6 | 48% | 0.479 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.9 | -45.9 | 177.8 | 172.3 | 0 | 0 | 0 | 0 | 110.6 | L118 A119 T126 | L118-V122 HydrophobicContact CD1-CG2 4.17Å; L118-V122 WeakPolarHBondContact O-CG2 3.41Å; L118-V122 PolarHBondContact O-N 2.91Å; A119-V122 PolarHBondContact O-N 2.95Å; V122-T126 HydrophobicContact CG1-CG2 4.33Å; V122-T126 WeakPolarHBondContact O-CB 3.5Å; V122-T126 VanDerWaalsContact O-CG2 3.25Å; V122-T126 WeakPolarHBondContact O-CG2 3.22Å; V122-T126 PolarHBondContact O-N 3.18Å; V122-T126 PolarHBondContact O-OG1 3.19Å |
| 123 | M | 94.5 | Very high | 94.8 | Very high | 76 Ų | 76 | 57.1 Ų | 57.1 | 37% | 0.374 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.4 | -43.9 | 179.3 | -73.2 | -172.3 | -64.5 | 0 | 0 | 112.5 | A119 V120 T126 L127 F382 M385 | A119-M123 HydrophobicContact CB-CE 4.43Å; A119-M123 WeakPolarHBondContact O-CB 3.37Å; A119-M123 WeakPolarHBondContact O-CE 3.38Å; A119-M123 VanDerWaalsContact O-CG 3.32Å; A119-M123 WeakPolarHBondContact O-CG 3.41Å; A119-M123 PolarHBondContact O-N 3.29Å; V120-M123 HydrophobicContact CG2-CE 4.24Å; V120-M123 PolarHBondContact O-N 2.84Å; M123-T126 PolarHBondContact O-OG1 3.09Å; M123-L127 WeakPolarHBondContact O-CB 3.43Å; M123-L127 PolarHBondContact O-N 3.13Å; M123-F382 HydrophobicContact CE-CD1 3.62Å; M123-F382 HydrophobicContact CE-CE1 3.55Å; M123-M385 HydrophobicContact CB-CE 4.45Å |
| 124 | S | 94.6 | Very high | 94.9 | Very high | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -69.9 | -40.8 | -178.9 | 57.8 | 0 | 0 | 0 | 0 | 113 | V120 A121 G128 L176 M385 | V120-S124 VanDerWaalsContact O-CB 3.26Å; V120-S124 WeakPolarHBondContact O-CB 3.45Å; V120-S124 PolarHBondContact O-N 2.92Å; V120-S124 PolarHBondContact O-OG 2.92Å; A121-S124 PolarHBondContact O-N 3.35Å; A121-S124 PolarHBondContact O-OG 3.25Å; A121-S124 VanDerWaalsContact O-OG 3.09Å; S124-G128 VanDerWaalsContact O-CA 3.27Å; S124-G128 WeakPolarHBondContact O-CA 3.09Å; S124-G128 PolarHBondContact O-N 3.45Å; S124-L176 WeakPolarHBondContact OG-CD2 3.21Å; S124-M385 VanDerWaalsContact CB-CE 3.47Å |
| 125 | L | 95.9 | Very high | 95 | Very high | 90 Ų | 90 | 50.9 Ų | 50.9 | 47% | 0.471 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -66.6 | -45.4 | 175.7 | -72 | 171.7 | 0 | 0 | 0 | 111.7 | A121 T129 V172 L176 | A121-L125 WeakPolarHBondContact O-CB 3.42Å; A121-L125 WeakPolarHBondContact O-CG 3.43Å; A121-L125 PolarHBondContact O-N 3.45Å; L125-T129 VanDerWaalsContact O-CB 3.31Å; L125-T129 WeakPolarHBondContact O-CB 3.42Å; L125-T129 WeakPolarHBondContact O-CG2 3.42Å; L125-T129 PolarHBondContact O-N 3.24Å; L125-T129 PolarHBondContact O-OG1 3.46Å; L125-V172 HydrophobicContact CD2-CG1 4.27Å; L125-L176 HydrophobicContact CD1-CD1 4.45Å; L125-L176 HydrophobicContact CD2-CD1 3.52Å; L125-L176 HydrophobicContact CG-CD1 3.81Å |
| 126 | T | 95 | Very high | 95.1 | Very high | 82 Ų | 82 | 50.6 Ų | 50.6 | 50% | 0.503 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -68.9 | -50.3 | -179 | 53.1 | 0 | 0 | 0 | 0 | 112 | V122 M123 T129 F130 | V122-T126 HydrophobicContact CG1-CG2 4.33Å; V122-T126 WeakPolarHBondContact O-CB 3.5Å; V122-T126 VanDerWaalsContact O-CG2 3.25Å; V122-T126 WeakPolarHBondContact O-CG2 3.22Å; V122-T126 PolarHBondContact O-N 3.18Å; V122-T126 PolarHBondContact O-OG1 3.19Å; M123-T126 PolarHBondContact O-OG1 3.09Å; T126-T129 PolarHBondContact O-OG1 3.34Å; T126-T129 VanDerWaalsContact O-OG1 3.04Å; T126-F130 WeakPolarHBondContact O-CB 3.16Å; T126-F130 PolarHBondContact O-N 3.37Å |
| 127 | L | 94.7 | Very high | 95 | Very high | 37 Ų | 37 | 52 Ų | 52 | 19% | 0.194 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -65.9 | -43.3 | 179.3 | -171.3 | 61.6 | 0 | 0 | 0 | 110.5 | M123 F130 T131 L388 L389 T392 | M123-L127 WeakPolarHBondContact O-CB 3.43Å; M123-L127 PolarHBondContact O-N 3.13Å; L127-F130 PolarHBondContact O-N 3.35Å; L127-T131 PolarHBondContact O-N 3.4Å; L127-T131 PolarHBondContact O-OG1 3.03Å; L127-L388 HydrophobicContact CB-CD2 3.94Å; L127-L388 HydrophobicContact CB-CG 4.44Å; L127-L388 HydrophobicContact CD2-CB 3.97Å; L127-L388 HydrophobicContact CD2-CD2 3.96Å; L127-L388 HydrophobicContact CD2-CG 3.87Å; L127-L388 HydrophobicContact CG-CD2 3.93Å; L127-L388 HydrophobicContact CG-CG 3.88Å; L127-L389 HydrophobicContact CD1-CD1 4.14Å; L127-L389 HydrophobicContact CD2-CB 4.15Å; L127-T392 HydrophobicContact CD1-CG2 3.98Å; L127-T392 VanDerWaalsContact CD1-OG1 3.31Å; L127-T392 WeakPolarHBondContact CD1-OG1 3.18Å |
| 128 | G | 95.4 | Very high | 94.9 | Very high | 3 Ų | 3 | 50.7 Ų | 50.7 | 3% | 0.031 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.4 | -47.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | S124 F130 T131 V132 | S124-G128 VanDerWaalsContact O-CA 3.27Å; S124-G128 WeakPolarHBondContact O-CA 3.09Å; S124-G128 PolarHBondContact O-N 3.45Å; G128-F130 VanDerWaalsContact C-N 3.27Å; G128-F130 PolarHBondContact O-N 3.43Å; G128-T131 PolarHBondContact O-N 3.27Å; G128-V132 WeakPolarHBondContact O-CG2 3.28Å; G128-V132 PolarHBondContact O-N 2.76Å |
| 129 | T | 95.2 | Very high | 94.9 | Very high | 82 Ų | 82 | 47 Ų | 47 | 50% | 0.503 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.1 | -41.6 | 175.5 | 50.2 | 0 | 0 | 0 | 0 | 111.2 | L125 T126 V132 L133 | L125-T129 VanDerWaalsContact O-CB 3.31Å; L125-T129 WeakPolarHBondContact O-CB 3.42Å; L125-T129 WeakPolarHBondContact O-CG2 3.42Å; L125-T129 PolarHBondContact O-N 3.24Å; L125-T129 PolarHBondContact O-OG1 3.46Å; T126-T129 PolarHBondContact O-OG1 3.34Å; T126-T129 VanDerWaalsContact O-OG1 3.04Å; T129-V132 PolarHBondContact O-N 3Å; T129-L133 WeakPolarHBondContact O-CB 3.44Å; T129-L133 VanDerWaalsContact O-CG 3.24Å; T129-L133 WeakPolarHBondContact O-CG 3.41Å; T129-L133 PolarHBondContact O-N 2.92Å |
| 130 | F | 95.6 | Very high | 94.7 | Very high | 96 Ų | 96 | 48.2 Ų | 48.2 | 42% | 0.421 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -64.1 | -45.7 | 175.9 | -170.8 | -104 | 0 | 0 | 0 | 112 | T126 L127 G128 V132 L133 E134 T392 | T126-F130 WeakPolarHBondContact O-CB 3.16Å; T126-F130 PolarHBondContact O-N 3.37Å; L127-F130 PolarHBondContact O-N 3.35Å; G128-F130 VanDerWaalsContact C-N 3.27Å; G128-F130 PolarHBondContact O-N 3.43Å; F130-V132 VanDerWaalsContact C-N 3.32Å; F130-V132 PolarHBondContact O-N 3.36Å; F130-L133 PolarHBondContact O-N 3.43Å; F130-E134 HydrophobicContact CD1-CG 4.31Å; F130-E134 HydrophobicContact CE1-CG 3.99Å; F130-E134 WeakPolarHBondContact CE1-OE1 3.37Å; F130-E134 WeakPolarHBondContact CE1-OE2 3.5Å; F130-E134 HydrophobicContact CE2-CG 4.25Å; F130-E134 HydrophobicContact CZ-CG 3.95Å; F130-E134 WeakPolarHBondContact CZ-OE1 3.4Å; F130-E134 WeakPolarHBondContact O-CG 3.49Å; F130-E134 PolarHBondContact O-N 3.21Å; F130-T392 HydrophobicContact CD1-CG2 3.44Å; F130-T392 VanDerWaalsContact CD1-CG2 3.44Å; F130-T392 HydrophobicContact CE1-CG2 3.62Å |
| 131 | T | 95.8 | Very high | 94.6 | Very high | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -56.2 | -45.6 | 175.4 | -48.6 | 0 | 0 | 0 | 0 | 111.8 | L127 G128 N135 L388 T392 | L127-T131 PolarHBondContact O-N 3.4Å; L127-T131 PolarHBondContact O-OG1 3.03Å; G128-T131 PolarHBondContact O-N 3.27Å; T131-N135 WeakPolarHBondContact CG2-ND2 3.29Å; T131-N135 WeakPolarHBondContact O-CB 3.48Å; T131-N135 PolarHBondContact O-N 2.93Å; T131-N135 PolarHBondContact O-ND2 2.98Å; T131-L388 HydrophobicContact CG2-CD1 4.36Å; T131-T392 PolarHBondContact OG1-OG1 3.23Å |
| 132 | V | 96.3 | Very high | 94.4 | Very high | 38 Ų | 38 | 48.3 Ų | 48.3 | 23% | 0.23 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.2 | -47.4 | -179.7 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | G128 T129 F130 L136 S168 V169 | G128-V132 WeakPolarHBondContact O-CG2 3.28Å; G128-V132 PolarHBondContact O-N 2.76Å; T129-V132 PolarHBondContact O-N 3Å; F130-V132 VanDerWaalsContact C-N 3.32Å; F130-V132 PolarHBondContact O-N 3.36Å; V132-L136 WeakPolarHBondContact O-CB 3.31Å; V132-L136 PolarHBondContact O-N 3.39Å; V132-S168 WeakPolarHBondContact CG2-OG 3.39Å; V132-V169 HydrophobicContact CG2-CG2 3.65Å |
| 133 | L | 95.2 | Very high | 94.1 | Very high | 104 Ų | 104 | 49.4 Ų | 49.4 | 55% | 0.545 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.4 | -47.2 | -179.6 | -71.1 | 172 | 0 | 0 | 0 | 111.7 | T129 F130 L136 I137 | T129-L133 WeakPolarHBondContact O-CB 3.44Å; T129-L133 VanDerWaalsContact O-CG 3.24Å; T129-L133 WeakPolarHBondContact O-CG 3.41Å; T129-L133 PolarHBondContact O-N 2.92Å; F130-L133 PolarHBondContact O-N 3.43Å; L133-L136 PolarHBondContact O-N 2.94Å; L133-I137 WeakPolarHBondContact O-CD1 3.38Å; L133-I137 VanDerWaalsContact O-CG1 3.25Å; L133-I137 WeakPolarHBondContact O-CG1 3.29Å; L133-I137 PolarHBondContact O-N 2.93Å |
| 134 | E | 94.3 | Very high | 93.8 | Very high | 34 Ų | 34 | 50.8 Ų | 50.8 | 16% | 0.159 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -65.7 | -45.3 | -179.2 | -69.6 | -169.7 | 132.9 | 0 | 0 | 112.5 | F130 L136 I137 V138 P395 | F130-E134 HydrophobicContact CD1-CG 4.31Å; F130-E134 HydrophobicContact CE1-CG 3.99Å; F130-E134 WeakPolarHBondContact CE1-OE1 3.37Å; F130-E134 WeakPolarHBondContact CE1-OE2 3.5Å; F130-E134 HydrophobicContact CE2-CG 4.25Å; F130-E134 HydrophobicContact CZ-CG 3.95Å; F130-E134 WeakPolarHBondContact CZ-OE1 3.4Å; F130-E134 WeakPolarHBondContact O-CG 3.49Å; F130-E134 PolarHBondContact O-N 3.21Å; E134-L136 VanDerWaalsContact C-N 3.34Å; E134-L136 PolarHBondContact O-N 3.39Å; E134-I137 PolarHBondContact O-N 3.46Å; E134-V138 WeakPolarHBondContact O-CG2 3.29Å; E134-V138 PolarHBondContact O-N 2.89Å; E134-P395 HydrophobicContact CB-CB 4Å; E134-P395 HydrophobicContact CB-CG 4.01Å |
| 135 | N | 95.3 | Very high | 93.5 | Very high | 3 Ų | 3 | 52 Ų | 52 | 2% | 0.016 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -68.9 | -33.4 | 179 | -77.7 | -73.4 | 0 | 0 | 0 | 112.3 | T131 V138 L139 A161 L165 S391 P395 | T131-N135 WeakPolarHBondContact CG2-ND2 3.29Å; T131-N135 WeakPolarHBondContact O-CB 3.48Å; T131-N135 PolarHBondContact O-N 2.93Å; T131-N135 PolarHBondContact O-ND2 2.98Å; N135-V138 PolarHBondContact O-N 3.5Å; N135-L139 WeakPolarHBondContact O-CB 3.37Å; N135-L139 PolarHBondContact O-N 3.2Å; N135-A161 HydrophobicContact CB-CB 4.47Å; N135-A161 WeakPolarHBondContact OD1-CA 3.34Å; N135-L165 HydrophobicContact CB-CB 4.34Å; N135-S391 PolarHBondContact ND2-O 3.47Å; N135-P395 WeakPolarHBondContact OD1-CG 3.3Å |
| 136 | L | 94.9 | Very high | 93 | Very high | 80 Ų | 80 | 56.8 Ų | 56.8 | 42% | 0.419 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -63.9 | -44.1 | 172.2 | -175.1 | 63.9 | 0 | 0 | 0 | 111.2 | V132 L133 E134 V138 L139 C140 L165 | V132-L136 WeakPolarHBondContact O-CB 3.31Å; V132-L136 PolarHBondContact O-N 3.39Å; L133-L136 PolarHBondContact O-N 2.94Å; E134-L136 VanDerWaalsContact C-N 3.34Å; E134-L136 PolarHBondContact O-N 3.39Å; L136-V138 PolarHBondContact O-N 2.76Å; L136-L139 PolarHBondContact O-N 3.45Å; L136-C140 WeakPolarHBondContact O-CB 3.13Å; L136-C140 PolarHBondContact O-N 3.49Å; L136-C140 PolarHBondContact O-SG 3.46Å; L136-L165 HydrophobicContact CB-CD1 4.18Å; L136-L165 HydrophobicContact CD1-CD1 4.2Å |
| 137 | I | 92.6 | Very high | 92.5 | Very high | 83 Ų | 83 | 57.8 Ų | 57.8 | 43% | 0.426 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -59.1 | -47.2 | 175 | -71.5 | 164.9 | 0 | 0 | 0 | 110.7 | L133 E134 L139 C140 V141 F409 | L133-I137 WeakPolarHBondContact O-CD1 3.38Å; L133-I137 VanDerWaalsContact O-CG1 3.25Å; L133-I137 WeakPolarHBondContact O-CG1 3.29Å; L133-I137 PolarHBondContact O-N 2.93Å; E134-I137 PolarHBondContact O-N 3.46Å; I137-L139 VanDerWaalsContact C-N 3.31Å; I137-L139 PolarHBondContact O-N 2.86Å; I137-C140 PolarHBondContact O-N 3.06Å; I137-V141 HydrophobicContact CG2-CG2 4.42Å; I137-V141 WeakPolarHBondContact O-CG2 3.43Å; I137-V141 PolarHBondContact O-N 3.2Å; I137-F409 HydrophobicContact CG2-CD2 3.87Å; I137-F409 HydrophobicContact CG2-CE2 3.63Å |
| 138 | V | 93.1 | Very high | 92.1 | Very high | 8 Ų | 8 | 56.2 Ų | 56.2 | 5% | 0.048 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -57.1 | -47.4 | 177.4 | 171.6 | 0 | 0 | 0 | 0 | 110.7 | E134 N135 L136 V141 I142 I157 A161 P395 M405 | E134-V138 WeakPolarHBondContact O-CG2 3.29Å; E134-V138 PolarHBondContact O-N 2.89Å; N135-V138 PolarHBondContact O-N 3.5Å; L136-V138 PolarHBondContact O-N 2.76Å; V138-V141 PolarHBondContact O-N 2.91Å; V138-I142 HydrophobicContact CG1-CD1 3.79Å; V138-I142 VanDerWaalsContact O-CG1 3.29Å; V138-I142 WeakPolarHBondContact O-CG1 3.35Å; V138-I142 PolarHBondContact O-N 3.33Å; V138-I157 HydrophobicContact CG1-CG2 4.22Å; V138-A161 HydrophobicContact CB-CB 4.41Å; V138-A161 HydrophobicContact CG1-CB 4.03Å; V138-P395 HydrophobicContact CG2-CB 3.77Å; V138-P395 HydrophobicContact CG2-CG 4.17Å; V138-M405 HydrophobicContact CG2-CE 3.86Å |
| 139 | L | 93.6 | Very high | 91.7 | Very high | 38 Ų | 38 | 61.1 Ų | 61.1 | 20% | 0.199 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.1 | -46.4 | 180 | -171.6 | 61.8 | 0 | 0 | 0 | 111.5 | N135 L136 I137 V141 I142 L143 V162 | N135-L139 WeakPolarHBondContact O-CB 3.37Å; N135-L139 PolarHBondContact O-N 3.2Å; L136-L139 PolarHBondContact O-N 3.45Å; I137-L139 VanDerWaalsContact C-N 3.31Å; I137-L139 PolarHBondContact O-N 2.86Å; L139-V141 PolarHBondContact O-N 3.5Å; L139-I142 PolarHBondContact O-N 2.94Å; L139-L143 HydrophobicContact CD1-CD1 4.23Å; L139-L143 HydrophobicContact CD1-CG 4.31Å; L139-L143 HydrophobicContact CG-CD1 3.93Å; L139-L143 HydrophobicContact CG-CG 4.38Å; L139-L143 WeakPolarHBondContact O-CB 3.29Å; L139-L143 VanDerWaalsContact O-CG 3.26Å; L139-L143 WeakPolarHBondContact O-CG 3.41Å; L139-L143 PolarHBondContact O-N 3.3Å; L139-V162 HydrophobicContact CD1-CG2 3.99Å; L139-V162 HydrophobicContact CD2-CG2 4.05Å |
| 140 | C | 92.1 | Very high | 91.3 | Very high | 65 Ų | 65 | 60.8 Ų | 60.8 | 44% | 0.439 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -56.8 | -48.2 | 176.6 | -73.5 | 0 | 0 | 0 | 0 | 112.2 | L136 I137 I142 L143 Q144 | L136-C140 WeakPolarHBondContact O-CB 3.13Å; L136-C140 PolarHBondContact O-N 3.49Å; L136-C140 PolarHBondContact O-SG 3.46Å; I137-C140 PolarHBondContact O-N 3.06Å; C140-I142 VanDerWaalsContact C-N 3.34Å; C140-I142 PolarHBondContact O-N 3.2Å; C140-L143 PolarHBondContact O-N 3.35Å; C140-Q144 VanDerWaalsContact O-CB 3.31Å; C140-Q144 WeakPolarHBondContact O-CB 3.49Å; C140-Q144 PolarHBondContact O-N 3.14Å |
| 141 | V | 91.3 | Very high | 90.8 | Very high | 8 Ų | 8 | 62.7 Ų | 62.7 | 5% | 0.048 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -61.9 | -41.8 | 179.2 | 171.5 | 0 | 0 | 0 | 0 | 111.6 | I137 V138 L139 S145 L148 A408 F409 | I137-V141 HydrophobicContact CG2-CG2 4.42Å; I137-V141 WeakPolarHBondContact O-CG2 3.43Å; I137-V141 PolarHBondContact O-N 3.2Å; V138-V141 PolarHBondContact O-N 2.91Å; L139-V141 PolarHBondContact O-N 3.5Å; V141-S145 WeakPolarHBondContact O-CB 3.28Å; V141-S145 PolarHBondContact O-N 2.91Å; V141-S145 VanDerWaalsContact O-N 3.12Å; V141-L148 HydrophobicContact CG1-CD1 4.11Å; V141-A408 HydrophobicContact CG1-CB 3.61Å; V141-F409 HydrophobicContact CG2-CB 4.22Å; V141-F409 HydrophobicContact CG2-CD2 3.93Å |
| 142 | I | 91.4 | Very high | 90.3 | Very high | 9 Ų | 9 | 63.8 Ų | 63.8 | 5% | 0.046 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -65 | -45.8 | 177.2 | -68.5 | 169.8 | 0 | 0 | 0 | 110.1 | V138 L139 C140 R149 Y154 I157 | V138-I142 HydrophobicContact CG1-CD1 3.79Å; V138-I142 VanDerWaalsContact O-CG1 3.29Å; V138-I142 WeakPolarHBondContact O-CG1 3.35Å; V138-I142 PolarHBondContact O-N 3.33Å; L139-I142 PolarHBondContact O-N 2.94Å; C140-I142 VanDerWaalsContact C-N 3.34Å; C140-I142 PolarHBondContact O-N 3.2Å; I142-R149 HydrophobicContact CG2-CG 4.47Å; I142-R149 WeakPolarHBondContact O-CG 3.33Å; I142-Y154 HydrophobicContact CG1-CD1 4.36Å; I142-I157 HydrophobicContact CD1-CB 4.43Å; I142-I157 HydrophobicContact CD1-CG2 4.04Å |
| 143 | L | 89.6 | Confident | 89.8 | Confident | 102 Ų | 102 | 62.9 Ų | 62.9 | 53% | 0.534 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -67.5 | -41 | -177.2 | -68.6 | 176.8 | 0 | 0 | 0 | 112.5 | L139 C140 R149 | L139-L143 HydrophobicContact CD1-CD1 4.23Å; L139-L143 HydrophobicContact CD1-CG 4.31Å; L139-L143 HydrophobicContact CG-CD1 3.93Å; L139-L143 HydrophobicContact CG-CG 4.38Å; L139-L143 WeakPolarHBondContact O-CB 3.29Å; L139-L143 VanDerWaalsContact O-CG 3.26Å; L139-L143 WeakPolarHBondContact O-CG 3.41Å; L139-L143 PolarHBondContact O-N 3.3Å; C140-L143 PolarHBondContact O-N 3.35Å; L143-R149 PolarHBondContact O-NE 3.38Å |
| 144 | Q | 88.8 | Confident | 89.5 | Confident | 105 Ų | 105 | 58.6 Ų | 58.6 | 49% | 0.491 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -68.6 | -38.7 | 179.6 | -170.4 | 172.2 | 3.5 | 0 | 0 | 112 | C140 R146 S412 | C140-Q144 VanDerWaalsContact O-CB 3.31Å; C140-Q144 WeakPolarHBondContact O-CB 3.49Å; C140-Q144 PolarHBondContact O-N 3.14Å; Q144-R146 PolarHBondContact O-N 3.37Å; Q144-S412 PolarHBondContact OE1-OG 3.37Å |
| 145 | S | 87.7 | Confident | 89.3 | Confident | 24 Ų | 24 | 58.7 Ų | 58.7 | 17% | 0.168 | 29% | 0.292 | C | S | . | . | trans | -84.6 | 105.2 | -176.7 | -174.1 | 0 | 0 | 0 | 0 | 113 | V141 T147 L148 R149 | V141-S145 WeakPolarHBondContact O-CB 3.28Å; V141-S145 PolarHBondContact O-N 2.91Å; V141-S145 VanDerWaalsContact O-N 3.12Å; S145-T147 PolarHBondContact O-N 3.3Å; S145-L148 PolarHBondContact O-N 2.91Å; S145-L148 VanDerWaalsContact O-N 3.16Å; S145-L148 WeakPolarHBondContact OG-CG 3.46Å; S145-R149 PolarHBondContact O-N 3.06Å; S145-R149 VanDerWaalsContact O-N 3.09Å | ||
| 146 | R | 85 | Confident | 89.1 | Confident | 192 Ų | 192 | 59.1 Ų | 59.1 | 73% | 0.725 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -56.5 | -37.8 | 173.5 | -172.1 | 178.2 | 178.4 | 178.4 | -0.1 | 112 | Q144 L148 R149 C150 | Q144-R146 PolarHBondContact O-N 3.37Å; R146-L148 VanDerWaalsContact C-N 3.33Å; R146-L148 PolarHBondContact O-N 2.84Å; R146-R149 PolarHBondContact O-N 3Å; R146-C150 PolarHBondContact O-N 2.97Å; R146-C150 VanDerWaalsContact O-N 3.13Å; R146-C150 PolarHBondContact O-SG 3.17Å |
| 147 | T | 85.3 | Confident | 88.9 | Confident | 102 Ų | 102 | 55.9 Ų | 55.9 | 63% | 0.626 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -62.1 | -39.8 | 179.4 | -53.1 | 0 | 0 | 0 | 0 | 112 | S145 R151 | S145-T147 PolarHBondContact O-N 3.3Å; T147-R151 WeakPolarHBondContact O-CG 3.34Å |
| 148 | L | 85 | Confident | 88.9 | Confident | 5 Ų | 5 | 52.3 Ų | 52.3 | 3% | 0.026 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -72.4 | -43.1 | 177.2 | -62.4 | -174.1 | 0 | 0 | 0 | 111.4 | V141 S145 R146 C150 R151 Y154 D404 A408 | V141-L148 HydrophobicContact CG1-CD1 4.11Å; S145-L148 PolarHBondContact O-N 2.91Å; S145-L148 VanDerWaalsContact O-N 3.16Å; S145-L148 WeakPolarHBondContact OG-CG 3.46Å; R146-L148 VanDerWaalsContact C-N 3.33Å; R146-L148 PolarHBondContact O-N 2.84Å; L148-C150 PolarHBondContact O-N 3.27Å; L148-R151 WeakPolarHBondContact O-CB 3.5Å; L148-R151 PolarHBondContact O-N 2.92Å; L148-Y154 HydrophobicContact CB-CD1 4.33Å; L148-Y154 HydrophobicContact CB-CG 4.28Å; L148-Y154 HydrophobicContact CD1-CD1 4.47Å; L148-Y154 HydrophobicContact CD1-CE1 4.26Å; L148-Y154 HydrophobicContact CD2-CD1 4.34Å; L148-Y154 HydrophobicContact CD2-CD2 4.37Å; L148-Y154 HydrophobicContact CD2-CE1 3.82Å; L148-Y154 HydrophobicContact CD2-CE2 3.84Å; L148-Y154 HydrophobicContact CG-CE1 4.46Å; L148-D404 HydrophobicContact CD2-CB 4.05Å; L148-A408 HydrophobicContact CD1-CB 3.59Å; L148-A408 HydrophobicContact CG-CB 4.28Å |
| 149 | R | 88.2 | Confident | 88.9 | Confident | 105 Ų | 105 | 52.3 Ų | 52.3 | 40% | 0.396 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -61.8 | -27.5 | 178.3 | -68.4 | -166.9 | -77.5 | 130.9 | -1.3 | 114.4 | I142 L143 S145 R146 R151 H155 | I142-R149 HydrophobicContact CG2-CG 4.47Å; I142-R149 WeakPolarHBondContact O-CG 3.33Å; L143-R149 PolarHBondContact O-NE 3.38Å; S145-R149 PolarHBondContact O-N 3.06Å; S145-R149 VanDerWaalsContact O-N 3.09Å; R146-R149 PolarHBondContact O-N 3Å; R149-R151 PolarHBondContact O-N 3.41Å; R149-H155 PolarHBondContact O-NE2 3.43Å |
| 150 | C | 85.5 | Confident | 88.9 | Confident | 76 Ų | 76 | 50.5 Ų | 50.5 | 51% | 0.514 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.2 | -16.1 | 176.9 | -70.8 | 0 | 0 | 0 | 0 | 113.1 | R146 L148 | R146-C150 PolarHBondContact O-N 2.97Å; R146-C150 VanDerWaalsContact O-N 3.13Å; R146-C150 PolarHBondContact O-SG 3.17Å; L148-C150 PolarHBondContact O-N 3.27Å |
| 151 | R | 86.1 | Confident | 89.1 | Confident | 136 Ų | 136 | 47.5 Ų | 47.5 | 51% | 0.513 | 23% | 0.232 | S | C | . | . | S | Bend | trans | -95.1 | 122.4 | -175.8 | -64.3 | -80.4 | -173.6 | 155.9 | 3.7 | 109.8 | T147 L148 R149 S153 Y154 | T147-R151 WeakPolarHBondContact O-CG 3.34Å; L148-R151 WeakPolarHBondContact O-CB 3.5Å; L148-R151 PolarHBondContact O-N 2.92Å; R149-R151 PolarHBondContact O-N 3.41Å; R151-S153 VanDerWaalsContact C-N 3.27Å; R151-S153 PolarHBondContact O-N 3.49Å; R151-Y154 HydrophobicContact CB-CD2 3.61Å; R151-Y154 HydrophobicContact CB-CE2 4.18Å; R151-Y154 HydrophobicContact CG-CD2 4.34Å; R151-Y154 HydrophobicContact CG-CE2 4.49Å; R151-Y154 PolarHBondContact O-N 3.33Å; R151-Y154 VanDerWaalsContact O-N 3.14Å |
| 152 | P | 84.8 | Confident | 89.3 | Confident | 22 Ų | 22 | 49.4 Ų | 49.4 | 14% | 0.143 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61 | -33.2 | -174.2 | 22.6 | -32.7 | 0 | 0 | 0 | 113.7 | Y154 H155 V229 A234 | P152-Y154 PolarHBondContact O-N 3.3Å; P152-H155 WeakPolarHBondContact O-CB 3.37Å; P152-H155 PolarHBondContact O-N 2.96Å; P152-V229 HydrophobicContact CB-CG1 4.06Å; P152-V229 HydrophobicContact CG-CG1 4.01Å; P152-A234 HydrophobicContact CB-CB 3.85Å |
| 153 | S | 86.3 | Confident | 89.5 | Confident | 19 Ų | 19 | 49 Ų | 49 | 13% | 0.133 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.1 | -28.7 | 179.1 | 60.5 | 0 | 0 | 0 | 0 | 113.8 | R151 H155 F156 I157 | R151-S153 VanDerWaalsContact C-N 3.27Å; R151-S153 PolarHBondContact O-N 3.49Å; S153-H155 VanDerWaalsContact C-N 3.33Å; S153-F156 PolarHBondContact O-N 2.86Å; S153-I157 PolarHBondContact O-N 2.81Å |
| 154 | Y | 89.1 | Confident | 89.8 | Confident | 15 Ų | 15 | 44.2 Ų | 44.2 | 6% | 0.059 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -79.3 | -15.8 | 179.1 | -74.2 | -88.6 | 0 | 0 | 0 | 112.9 | I142 L148 R151 P152 I157 G158 S402 D404 | I142-Y154 HydrophobicContact CG1-CD1 4.36Å; L148-Y154 HydrophobicContact CB-CD1 4.33Å; L148-Y154 HydrophobicContact CB-CG 4.28Å; L148-Y154 HydrophobicContact CD1-CD1 4.47Å; L148-Y154 HydrophobicContact CD1-CE1 4.26Å; L148-Y154 HydrophobicContact CD2-CD1 4.34Å; L148-Y154 HydrophobicContact CD2-CD2 4.37Å; L148-Y154 HydrophobicContact CD2-CE1 3.82Å; L148-Y154 HydrophobicContact CD2-CE2 3.84Å; L148-Y154 HydrophobicContact CG-CE1 4.46Å; R151-Y154 HydrophobicContact CB-CD2 3.61Å; R151-Y154 HydrophobicContact CB-CE2 4.18Å; R151-Y154 HydrophobicContact CG-CD2 4.34Å; R151-Y154 HydrophobicContact CG-CE2 4.49Å; R151-Y154 PolarHBondContact O-N 3.33Å; R151-Y154 VanDerWaalsContact O-N 3.14Å; P152-Y154 PolarHBondContact O-N 3.3Å; Y154-I157 HydrophobicContact CD1-CD1 4.09Å; Y154-I157 HydrophobicContact CE1-CD1 4.3Å; Y154-G158 PolarHBondContact O-N 2.84Å; Y154-S402 PolarHBondContact OH-OG 3.44Å; Y154-D404 WeakPolarHBondContact OH-CB 3.39Å |
| 155 | H | 90.2 | Very high | 90.2 | Very high | 36 Ų | 36 | 40.9 Ų | 40.9 | 17% | 0.167 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -69.1 | -35.6 | 169.6 | -67.7 | -52 | 0 | 0 | 0 | 111.6 | R149 P152 S153 G158 S159 F238 | R149-H155 PolarHBondContact O-NE2 3.43Å; P152-H155 WeakPolarHBondContact O-CB 3.37Å; P152-H155 PolarHBondContact O-N 2.96Å; S153-H155 VanDerWaalsContact C-N 3.33Å; H155-G158 PolarHBondContact O-N 3.1Å; H155-S159 VanDerWaalsContact O-CB 3.28Å; H155-S159 WeakPolarHBondContact O-CB 3.26Å; H155-S159 PolarHBondContact O-N 3.06Å; H155-F238 HydrophobicContact CB-CD1 4.21Å; H155-F238 HydrophobicContact CB-CE1 4.11Å |
| 156 | F | 90.2 | Very high | 90.5 | Very high | 12 Ų | 12 | 43.3 Ų | 43.3 | 5% | 0.053 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -67.8 | -41 | 173.8 | -55.6 | -52.6 | 0 | 0 | 0 | 111.9 | S153 S159 L160 L210 D214 A234 A237 | S153-F156 PolarHBondContact O-N 2.86Å; F156-S159 WeakPolarHBondContact O-CB 3.3Å; F156-S159 PolarHBondContact O-N 2.91Å; F156-L160 PolarHBondContact O-N 2.89Å; F156-L210 HydrophobicContact CD1-CB 3.82Å; F156-L210 HydrophobicContact CD1-CD1 4.03Å; F156-L210 HydrophobicContact CE1-CB 3.98Å; F156-L210 HydrophobicContact CE1-CD1 4.01Å; F156-L210 HydrophobicContact CE1-CG 4.46Å; F156-L210 HydrophobicContact CG-CB 4.36Å; F156-D214 HydrophobicContact CD2-CB 4.27Å; F156-D214 HydrophobicContact CE2-CB 4.06Å; F156-A234 HydrophobicContact CE1-CB 4.17Å; F156-A234 HydrophobicContact CE2-CB 4.31Å; F156-A234 HydrophobicContact CZ-CB 3.72Å; F156-A237 HydrophobicContact CE1-CB 4.48Å |
| 157 | I | 90.9 | Very high | 91 | Very high | 11 Ų | 11 | 34.2 Ų | 34.2 | 6% | 0.056 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -66.5 | -41.2 | 176 | -60.3 | 169.4 | 0 | 0 | 0 | 110.8 | V138 I142 S153 Y154 L160 A161 Y398 | V138-I157 HydrophobicContact CG1-CG2 4.22Å; I142-I157 HydrophobicContact CD1-CB 4.43Å; I142-I157 HydrophobicContact CD1-CG2 4.04Å; S153-I157 PolarHBondContact O-N 2.81Å; Y154-I157 HydrophobicContact CD1-CD1 4.09Å; Y154-I157 HydrophobicContact CE1-CD1 4.3Å; I157-L160 PolarHBondContact O-N 3.42Å; I157-A161 PolarHBondContact O-N 3.48Å; I157-Y398 HydrophobicContact CD1-CD1 4.25Å; I157-Y398 HydrophobicContact CG1-CD1 4.38Å; I157-Y398 HydrophobicContact CG1-CE1 4.25Å; I157-Y398 HydrophobicContact CG2-CD2 3.91Å; I157-Y398 HydrophobicContact CG2-CE2 4.13Å; I157-Y398 HydrophobicContact CG2-CG 4.16Å |
| 158 | G | 92.8 | Very high | 91.5 | Very high | 9 Ų | 9 | 29.4 Ų | 29.4 | 9% | 0.093 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64.4 | -42 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y154 H155 L160 A161 V162 | Y154-G158 PolarHBondContact O-N 2.84Å; H155-G158 PolarHBondContact O-N 3.1Å; G158-L160 VanDerWaalsContact C-N 3.33Å; G158-L160 PolarHBondContact O-N 2.89Å; G158-A161 PolarHBondContact O-N 3.31Å; G158-V162 WeakPolarHBondContact O-CG2 3.46Å; G158-V162 PolarHBondContact O-N 3.48Å |
| 159 | S | 94.1 | Very high | 92.1 | Very high | 8 Ų | 8 | 32.7 Ų | 32.7 | 6% | 0.056 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -57.1 | -46.3 | 172.9 | 173.6 | 0 | 0 | 0 | 0 | 111.5 | H155 F156 V162 A163 S207 W242 | H155-S159 VanDerWaalsContact O-CB 3.28Å; H155-S159 WeakPolarHBondContact O-CB 3.26Å; H155-S159 PolarHBondContact O-N 3.06Å; F156-S159 WeakPolarHBondContact O-CB 3.3Å; F156-S159 PolarHBondContact O-N 2.91Å; S159-V162 PolarHBondContact O-N 3.25Å; S159-A163 PolarHBondContact O-N 3.35Å; S159-S207 PolarHBondContact OG-OG 3.41Å; S159-W242 PolarHBondContact OG-NE1 3.27Å |
| 160 | L | 93.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 30.1 Ų | 30.1 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -62.2 | -45.2 | 176.2 | -178.5 | 65.4 | 0 | 0 | 0 | 112.1 | F156 I157 G158 V162 A163 D164 S204 L208 N394 Y398 | F156-L160 PolarHBondContact O-N 2.89Å; I157-L160 PolarHBondContact O-N 3.42Å; G158-L160 VanDerWaalsContact C-N 3.33Å; G158-L160 PolarHBondContact O-N 2.89Å; L160-V162 VanDerWaalsContact C-N 3.28Å; L160-V162 PolarHBondContact O-N 2.89Å; L160-A163 PolarHBondContact O-N 2.93Å; L160-A163 VanDerWaalsContact O-N 3.16Å; L160-D164 WeakPolarHBondContact O-CB 3.42Å; L160-D164 PolarHBondContact O-N 3.22Å; L160-S204 WeakPolarHBondContact CD1-O 3.4Å; L160-S204 WeakPolarHBondContact CD1-OG 3.48Å; L160-L208 HydrophobicContact CD1-CG 4.31Å; L160-L208 HydrophobicContact CD2-CD2 3.91Å; L160-L208 HydrophobicContact CD2-CG 4.45Å; L160-N394 HydrophobicContact CD2-CB 4.25Å; L160-Y398 HydrophobicContact CD2-CE2 3.68Å; L160-Y398 WeakPolarHBondContact CD2-OH 3Å |
| 161 | A | 95.1 | Very high | 92.9 | Very high | 2 Ų | 2 | 27.3 Ų | 27.3 | 2% | 0.017 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -61.4 | -36.7 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | N135 V138 I157 G158 L165 | N135-A161 HydrophobicContact CB-CB 4.47Å; N135-A161 WeakPolarHBondContact OD1-CA 3.34Å; V138-A161 HydrophobicContact CB-CB 4.41Å; V138-A161 HydrophobicContact CG1-CB 4.03Å; I157-A161 PolarHBondContact O-N 3.48Å; G158-A161 PolarHBondContact O-N 3.31Å; A161-L165 VanDerWaalsContact O-CB 3.25Å; A161-L165 WeakPolarHBondContact O-CB 3.38Å; A161-L165 PolarHBondContact O-N 2.9Å |
| 162 | V | 96.1 | Very high | 93.4 | Very high | 48 Ų | 48 | 21.6 Ų | 21.6 | 29% | 0.291 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -68.3 | -43.9 | 174.1 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | L139 G158 S159 L160 L165 L166 W242 | L139-V162 HydrophobicContact CD1-CG2 3.99Å; L139-V162 HydrophobicContact CD2-CG2 4.05Å; G158-V162 WeakPolarHBondContact O-CG2 3.46Å; G158-V162 PolarHBondContact O-N 3.48Å; S159-V162 PolarHBondContact O-N 3.25Å; L160-V162 VanDerWaalsContact C-N 3.28Å; L160-V162 PolarHBondContact O-N 2.89Å; V162-L165 PolarHBondContact O-N 3.4Å; V162-L166 HydrophobicContact CG1-CD1 3.9Å; V162-L166 HydrophobicContact CG1-CG 4.38Å; V162-L166 WeakPolarHBondContact O-CB 3.44Å; V162-L166 WeakPolarHBondContact O-CG 3.32Å; V162-L166 PolarHBondContact O-N 3.35Å; V162-W242 HydrophobicContact CB-CZ2 4.25Å; V162-W242 HydrophobicContact CG1-CH2 3.91Å; V162-W242 HydrophobicContact CG1-CZ2 3.95Å |
| 163 | A | 96.1 | Very high | 93.9 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62.1 | -44.1 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | S159 L160 G167 A203 W242 | S159-A163 PolarHBondContact O-N 3.35Å; L160-A163 PolarHBondContact O-N 2.93Å; L160-A163 VanDerWaalsContact O-N 3.16Å; A163-G167 WeakPolarHBondContact O-CA 3.29Å; A163-G167 PolarHBondContact O-N 3.4Å; A163-A203 HydrophobicContact CB-CB 4.09Å; A163-W242 HydrophobicContact CB-CH2 3.98Å; A163-W242 HydrophobicContact CB-CZ2 3.82Å |
| 164 | D | 95.9 | Very high | 94.2 | Very high | 1 Ų | 1 | 26.4 Ų | 26.4 | 1% | 0.005 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -68.2 | -36.8 | 178.5 | -75 | -17.3 | 0 | 0 | 0 | 111.8 | L160 S168 S204 S391 N394 | L160-D164 WeakPolarHBondContact O-CB 3.42Å; L160-D164 PolarHBondContact O-N 3.22Å; D164-S168 WeakPolarHBondContact O-CB 3.49Å; D164-S168 PolarHBondContact O-N 2.89Å; D164-S168 PolarHBondContact O-OG 3.37Å; D164-S204 PolarHBondContact OD1-OG 3Å; D164-S391 VanDerWaalsContact CG-CB 3.47Å; D164-S391 VanDerWaalsContact CG-OG 3.28Å; D164-S391 WeakPolarHBondContact OD1-CB 3.34Å; D164-S391 PolarHBondContact OD1-OG 3.35Å; D164-N394 PolarHBondContact OD2-ND2 2.88Å |
| 165 | L | 96 | Very high | 94.4 | Very high | 36 Ų | 36 | 26.4 Ų | 26.4 | 19% | 0.188 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -67.5 | -50.5 | 175 | -172.5 | 155.6 | 0 | 0 | 0 | 111.7 | N135 L136 A161 V162 S168 V169 | N135-L165 HydrophobicContact CB-CB 4.34Å; L136-L165 HydrophobicContact CB-CD1 4.18Å; L136-L165 HydrophobicContact CD1-CD1 4.2Å; A161-L165 VanDerWaalsContact O-CB 3.25Å; A161-L165 WeakPolarHBondContact O-CB 3.38Å; A161-L165 PolarHBondContact O-N 2.9Å; V162-L165 PolarHBondContact O-N 3.4Å; L165-S168 PolarHBondContact O-OG 3.19Å; L165-V169 WeakPolarHBondContact O-CG2 3.4Å; L165-V169 PolarHBondContact O-N 3.1Å; L165-V169 VanDerWaalsContact O-N 3.14Å |
| 166 | L | 95.6 | Very high | 94.6 | Very high | 74 Ų | 74 | 25.6 Ų | 25.6 | 39% | 0.387 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -63.3 | -45.2 | 178 | -69.9 | 175.5 | 0 | 0 | 0 | 111 | V162 V169 I170 W242 | V162-L166 HydrophobicContact CG1-CD1 3.9Å; V162-L166 HydrophobicContact CG1-CG 4.38Å; V162-L166 WeakPolarHBondContact O-CB 3.44Å; V162-L166 WeakPolarHBondContact O-CG 3.32Å; V162-L166 PolarHBondContact O-N 3.35Å; L166-V169 PolarHBondContact O-N 3.49Å; L166-I170 WeakPolarHBondContact O-CB 3.22Å; L166-I170 WeakPolarHBondContact O-CD1 3.5Å; L166-I170 WeakPolarHBondContact O-CG1 3.4Å; L166-I170 PolarHBondContact O-N 2.86Å; L166-W242 HydrophobicContact CD1-CH2 4.05Å; L166-W242 HydrophobicContact CD1-CZ3 4.28Å |
| 167 | G | 95.1 | Very high | 94.8 | Very high | 1 Ų | 1 | 25.6 Ų | 25.6 | 1% | 0.01 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -60.2 | -47.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A163 F171 S200 | A163-G167 WeakPolarHBondContact O-CA 3.29Å; A163-G167 PolarHBondContact O-N 3.4Å; G167-F171 WeakPolarHBondContact O-CA 3.23Å; G167-F171 WeakPolarHBondContact O-CB 3.47Å; G167-F171 PolarHBondContact O-N 3.36Å; G167-S200 PolarHBondContact N-OG 3.22Å |
| 168 | S | 95.7 | Very high | 94.8 | Very high | 1 Ų | 1 | 26 Ų | 26 | 1% | 0.007 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.2 | -43.9 | 179.6 | 53.8 | 0 | 0 | 0 | 0 | 112.9 | V132 D164 L165 V172 L388 | V132-S168 WeakPolarHBondContact CG2-OG 3.39Å; D164-S168 WeakPolarHBondContact O-CB 3.49Å; D164-S168 PolarHBondContact O-N 2.89Å; D164-S168 PolarHBondContact O-OG 3.37Å; L165-S168 PolarHBondContact O-OG 3.19Å; S168-V172 WeakPolarHBondContact O-CB 3.47Å; S168-V172 WeakPolarHBondContact O-CG2 3.48Å; S168-V172 PolarHBondContact O-N 3.36Å; S168-L388 VanDerWaalsContact CB-CD1 3.46Å |
| 169 | V | 96.3 | Very high | 94.7 | Very high | 74 Ų | 74 | 27 Ų | 27 | 45% | 0.448 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -63 | -50.3 | 178 | 173.5 | 0 | 0 | 0 | 0 | 111 | V132 L165 L166 Y173 | V132-V169 HydrophobicContact CG2-CG2 3.65Å; L165-V169 WeakPolarHBondContact O-CG2 3.4Å; L165-V169 PolarHBondContact O-N 3.1Å; L165-V169 VanDerWaalsContact O-N 3.14Å; L166-V169 PolarHBondContact O-N 3.49Å; V169-Y173 VanDerWaalsContact O-CB 3.29Å; V169-Y173 WeakPolarHBondContact O-CB 3.13Å; V169-Y173 PolarHBondContact O-N 2.91Å; V169-Y173 VanDerWaalsContact O-N 3.1Å |
| 170 | I | 96.1 | Very high | 94.6 | Very high | 51 Ų | 51 | 28.4 Ų | 28.4 | 26% | 0.262 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -67 | -42.7 | -177.9 | -60.1 | 168 | 0 | 0 | 0 | 110.2 | L166 S174 V197 | L166-I170 WeakPolarHBondContact O-CB 3.22Å; L166-I170 WeakPolarHBondContact O-CD1 3.5Å; L166-I170 WeakPolarHBondContact O-CG1 3.4Å; L166-I170 PolarHBondContact O-N 2.86Å; I170-S174 VanDerWaalsContact O-CB 3.22Å; I170-S174 WeakPolarHBondContact O-CB 3.3Å; I170-S174 PolarHBondContact O-N 3.25Å; I170-S174 PolarHBondContact O-OG 3.3Å; I170-V197 HydrophobicContact CB-CG2 4.32Å; I170-V197 HydrophobicContact CG2-CG2 3.71Å |
| 171 | F | 95.4 | Very high | 94.4 | Very high | 17 Ų | 17 | 35.5 Ų | 35.5 | 8% | 0.075 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62 | -54.5 | 179 | 176.2 | -98.1 | 0 | 0 | 0 | 111.1 | G167 Y173 S174 F175 V197 F201 M385 L388 | G167-F171 WeakPolarHBondContact O-CA 3.23Å; G167-F171 WeakPolarHBondContact O-CB 3.47Å; G167-F171 PolarHBondContact O-N 3.36Å; F171-Y173 VanDerWaalsContact C-N 3.33Å; F171-Y173 PolarHBondContact O-N 3.06Å; F171-S174 PolarHBondContact O-N 2.9Å; F171-F175 HydrophobicContact CE1-CB 4.46Å; F171-F175 HydrophobicContact CE1-CD2 4.33Å; F171-F175 HydrophobicContact CE1-CG 4.45Å; F171-F175 AromaticContact CE2-CD2 3.91Å; F171-F175 HydrophobicContact CE2-CD2 3.91Å; F171-F175 HydrophobicContact CZ-CB 4.44Å; F171-F175 AromaticContact CZ-CD2 3.64Å; F171-F175 HydrophobicContact CZ-CD2 3.64Å; F171-F175 HydrophobicContact CZ-CE2 4.26Å; F171-F175 HydrophobicContact CZ-CG 4.19Å; F171-F175 WeakPolarHBondContact O-CA 3.47Å; F171-F175 WeakPolarHBondContact O-CB 3.42Å; F171-F175 PolarHBondContact O-N 3.15Å; F171-V197 HydrophobicContact CB-CG1 4.46Å; F171-V197 HydrophobicContact CB-CG2 4.18Å; F171-V197 HydrophobicContact CD2-CG1 4Å; F171-F201 HydrophobicContact CD2-CE2 4.17Å; F171-M385 HydrophobicContact CE1-CE 4.35Å; F171-M385 HydrophobicContact CE1-SD 3.91Å; F171-M385 HydrophobicContact CZ-SD 4.16Å; F171-L388 HydrophobicContact CD1-CB 4.41Å; F171-L388 HydrophobicContact CD1-CD2 4.33Å; F171-L388 HydrophobicContact CE1-CB 4.29Å; F171-L388 HydrophobicContact CE1-CD2 4.37Å |
| 172 | V | 95.8 | Very high | 94 | Very high | 17 Ų | 17 | 39 Ų | 39 | 10% | 0.103 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -61.3 | -44.4 | -177 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | L125 S168 L176 L388 | L125-V172 HydrophobicContact CD2-CG1 4.27Å; S168-V172 WeakPolarHBondContact O-CB 3.47Å; S168-V172 WeakPolarHBondContact O-CG2 3.48Å; S168-V172 PolarHBondContact O-N 3.36Å; V172-L176 HydrophobicContact CG1-CD1 3.78Å; V172-L176 HydrophobicContact CG1-CG 4.46Å; V172-L176 WeakPolarHBondContact O-CB 3.42Å; V172-L176 WeakPolarHBondContact O-CD1 3.46Å; V172-L176 WeakPolarHBondContact O-CG 3.23Å; V172-L176 PolarHBondContact O-N 3.16Å; V172-L176 VanDerWaalsContact O-N 3.09Å; V172-L388 HydrophobicContact CG2-CD1 4.45Å; V172-L388 HydrophobicContact CG2-CD2 3.85Å |
| 173 | Y | 95.3 | Very high | 93.6 | Very high | 124 Ų | 124 | 43.2 Ų | 43.2 | 49% | 0.486 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -59.9 | -54.4 | 176.4 | 173.9 | -103.4 | 0 | 0 | 0 | 111.8 | V169 F171 F175 L176 D177 | V169-Y173 VanDerWaalsContact O-CB 3.29Å; V169-Y173 WeakPolarHBondContact O-CB 3.13Å; V169-Y173 PolarHBondContact O-N 2.91Å; V169-Y173 VanDerWaalsContact O-N 3.1Å; F171-Y173 VanDerWaalsContact C-N 3.33Å; F171-Y173 PolarHBondContact O-N 3.06Å; Y173-F175 VanDerWaalsContact C-N 3.32Å; Y173-F175 PolarHBondContact O-N 2.81Å; Y173-L176 PolarHBondContact O-N 3.45Å; Y173-D177 VanDerWaalsContact O-CB 3.24Å; Y173-D177 WeakPolarHBondContact O-CB 3.46Å; Y173-D177 PolarHBondContact O-N 2.91Å |
| 174 | S | 94 | Very high | 93.1 | Very high | 18 Ų | 18 | 48.4 Ų | 48.4 | 13% | 0.126 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -66.5 | -36.6 | -175.8 | -51 | 0 | 0 | 0 | 0 | 111.8 | I170 F171 F178 | I170-S174 VanDerWaalsContact O-CB 3.22Å; I170-S174 WeakPolarHBondContact O-CB 3.3Å; I170-S174 PolarHBondContact O-N 3.25Å; I170-S174 PolarHBondContact O-OG 3.3Å; F171-S174 PolarHBondContact O-N 2.9Å; S174-F178 VanDerWaalsContact O-CB 3.3Å; S174-F178 WeakPolarHBondContact O-CB 3.2Å; S174-F178 PolarHBondContact O-N 3.07Å |
| 175 | F | 92.8 | Very high | 92.8 | Very high | 15 Ų | 15 | 49.6 Ų | 49.6 | 7% | 0.066 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -66.8 | -44.7 | -179.6 | -169.6 | -76.8 | 0 | 0 | 0 | 111.5 | V120 F171 Y173 H179 A381 S384 | V120-F175 HydrophobicContact CB-CE1 4.13Å; V120-F175 HydrophobicContact CG1-CD1 3.95Å; V120-F175 HydrophobicContact CG1-CE1 3.09Å; V120-F175 HydrophobicContact CG1-CZ 3.57Å; F171-F175 HydrophobicContact CE1-CB 4.46Å; F171-F175 HydrophobicContact CE1-CD2 4.33Å; F171-F175 HydrophobicContact CE1-CG 4.45Å; F171-F175 AromaticContact CE2-CD2 3.91Å; F171-F175 HydrophobicContact CE2-CD2 3.91Å; F171-F175 HydrophobicContact CZ-CB 4.44Å; F171-F175 AromaticContact CZ-CD2 3.64Å; F171-F175 HydrophobicContact CZ-CD2 3.64Å; F171-F175 HydrophobicContact CZ-CE2 4.26Å; F171-F175 HydrophobicContact CZ-CG 4.19Å; F171-F175 WeakPolarHBondContact O-CA 3.47Å; F171-F175 WeakPolarHBondContact O-CB 3.42Å; F171-F175 PolarHBondContact O-N 3.15Å; Y173-F175 VanDerWaalsContact C-N 3.32Å; Y173-F175 PolarHBondContact O-N 2.81Å; F175-H179 HydrophobicContact CD1-CB 4.48Å; F175-H179 AromaticContact CD1-ND1 3.61Å; F175-H179 AromaticContact CD2-CE1 3.66Å; F175-H179 AromaticContact CD2-ND1 3.63Å; F175-H179 HydrophobicContact CE1-CB 4.02Å; F175-H179 AromaticContact CE1-CG 3.79Å; F175-H179 AromaticContact CE1-ND1 3.36Å; F175-H179 WeakPolarHBondContact CE1-ND1 3.1Å; F175-H179 AromaticContact CE2-CE1 3.3Å; F175-H179 WeakPolarHBondContact CE2-CE1 3.49Å; F175-H179 AromaticContact CE2-ND1 3.47Å; F175-H179 WeakPolarHBondContact CE2-ND1 3.45Å; F175-H179 AromaticContact CG-ND1 3.69Å; F175-H179 AromaticContact CZ-CE1 3.5Å; F175-H179 AromaticContact CZ-CG 3.87Å; F175-H179 AromaticContact CZ-ND1 3.33Å; F175-H179 VanDerWaalsContact CZ-ND1 3.33Å; F175-H179 WeakPolarHBondContact CZ-ND1 3.28Å; F175-H179 WeakPolarHBondContact O-CB 3.35Å; F175-H179 PolarHBondContact O-N 2.99Å; F175-H179 PolarHBondContact O-ND1 3.09Å; F175-A381 HydrophobicContact CZ-CB 4.32Å; F175-S384 VanDerWaalsContact CE2-OG 3.24Å; F175-S384 WeakPolarHBondContact CE2-OG 3.47Å |
| 176 | L | 94.4 | Very high | 92.5 | Very high | 18 Ų | 18 | 51 Ų | 51 | 9% | 0.094 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -68.9 | -44.1 | 177.1 | -69.4 | 172.2 | 0 | 0 | 0 | 112 | A121 S124 L125 V172 Y173 F178 V180 F181 | A121-L176 HydrophobicContact CB-CD2 3.84Å; S124-L176 WeakPolarHBondContact OG-CD2 3.21Å; L125-L176 HydrophobicContact CD1-CD1 4.45Å; L125-L176 HydrophobicContact CD2-CD1 3.52Å; L125-L176 HydrophobicContact CG-CD1 3.81Å; V172-L176 HydrophobicContact CG1-CD1 3.78Å; V172-L176 HydrophobicContact CG1-CG 4.46Å; V172-L176 WeakPolarHBondContact O-CB 3.42Å; V172-L176 WeakPolarHBondContact O-CD1 3.46Å; V172-L176 WeakPolarHBondContact O-CG 3.23Å; V172-L176 PolarHBondContact O-N 3.16Å; V172-L176 VanDerWaalsContact O-N 3.09Å; Y173-L176 PolarHBondContact O-N 3.45Å; L176-F178 PolarHBondContact O-N 3.27Å; L176-V180 HydrophobicContact CD2-CG2 3.83Å; L176-V180 WeakPolarHBondContact O-CA 3.31Å; L176-V180 VanDerWaalsContact O-CB 3.31Å; L176-V180 WeakPolarHBondContact O-CB 3.34Å; L176-V180 PolarHBondContact O-N 3.47Å; L176-F181 HydrophobicContact CB-CE2 4.37Å; L176-F181 WeakPolarHBondContact O-CD2 3.38Å; L176-F181 PolarHBondContact O-N 3.05Å; L176-F181 VanDerWaalsContact O-N 3.08Å |
| 177 | D | 93.7 | Very high | 92.2 | Very high | 12 Ų | 12 | 49.9 Ų | 49.9 | 6% | 0.064 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -58.1 | -38.6 | 178.3 | -165.9 | 56.6 | 0 | 0 | 0 | 111.4 | Y173 H182 R183 K193 | Y173-D177 VanDerWaalsContact O-CB 3.24Å; Y173-D177 WeakPolarHBondContact O-CB 3.46Å; Y173-D177 PolarHBondContact O-N 2.91Å; D177-H182 PolarHBondContact O-N 3.12Å; D177-R183 WeakPolarHBondContact O-CB 3.4Å; D177-R183 PolarHBondContact O-N 3.2Å; D177-R183 VanDerWaalsContact O-N 3.08Å; D177-R183 WeakPolarHBondContact OD1-CD 3.26Å; D177-R183 IonicContact OD1-NH1 2.87Å; D177-R183 WeakPolarHBondContact OD2-CD 3.4Å; D177-K193 IonicContact OD2-NZ 3.38Å; D177-K193 PolarHBondContact OD2-NZ 3.45Å |
| 178 | F | 91.8 | Very high | 92 | Very high | 21 Ų | 21 | 55 Ų | 55 | 9% | 0.092 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -78.9 | -56.4 | 177.6 | -170.9 | -99.2 | 0 | 0 | 0 | 113.6 | M106 F109 M110 S174 L176 H182 F190 P270 | M106-F178 HydrophobicContact SD-CE2 4.12Å; F109-F178 HydrophobicContact CB-CE1 4.14Å; F109-F178 HydrophobicContact CB-CZ 3.77Å; M110-F178 HydrophobicContact CE-CD2 3.84Å; M110-F178 HydrophobicContact CE-CE2 3.81Å; M110-F178 HydrophobicContact CE-CG 4.38Å; M110-F178 HydrophobicContact CE-CZ 4.31Å; M110-F178 HydrophobicContact CG-CE1 4.27Å; M110-F178 HydrophobicContact CG-CZ 4.28Å; S174-F178 VanDerWaalsContact O-CB 3.3Å; S174-F178 WeakPolarHBondContact O-CB 3.2Å; S174-F178 PolarHBondContact O-N 3.07Å; L176-F178 PolarHBondContact O-N 3.27Å; F178-H182 WeakPolarHBondContact O-CA 3.33Å; F178-H182 PolarHBondContact O-N 2.97Å; F178-F190 HydrophobicContact CD2-CE2 4.13Å; F178-F190 HydrophobicContact CE2-CE2 4.01Å; F178-P270 HydrophobicContact CZ-CG 4.28Å |
| 179 | H | 90.3 | Very high | 91.9 | Very high | 28 Ų | 28 | 57.9 Ų | 57.9 | 13% | 0.13 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -86.3 | -21.7 | -169.2 | -63.8 | 97.4 | 0 | 0 | 0 | 114.9 | L112 F175 | L112-H179 HydrophobicContact CD1-CB 4.18Å; L112-H179 WeakPolarHBondContact CD1-CD2 3.35Å; F175-H179 HydrophobicContact CD1-CB 4.48Å; F175-H179 AromaticContact CD1-ND1 3.61Å; F175-H179 AromaticContact CD2-CE1 3.66Å; F175-H179 AromaticContact CD2-ND1 3.63Å; F175-H179 HydrophobicContact CE1-CB 4.02Å; F175-H179 AromaticContact CE1-CG 3.79Å; F175-H179 AromaticContact CE1-ND1 3.36Å; F175-H179 WeakPolarHBondContact CE1-ND1 3.1Å; F175-H179 AromaticContact CE2-CE1 3.3Å; F175-H179 WeakPolarHBondContact CE2-CE1 3.49Å; F175-H179 AromaticContact CE2-ND1 3.47Å; F175-H179 WeakPolarHBondContact CE2-ND1 3.45Å; F175-H179 AromaticContact CG-ND1 3.69Å; F175-H179 AromaticContact CZ-CE1 3.5Å; F175-H179 AromaticContact CZ-CG 3.87Å; F175-H179 AromaticContact CZ-ND1 3.33Å; F175-H179 VanDerWaalsContact CZ-ND1 3.33Å; F175-H179 WeakPolarHBondContact CZ-ND1 3.28Å; F175-H179 WeakPolarHBondContact O-CB 3.35Å; F175-H179 PolarHBondContact O-N 2.99Å; F175-H179 PolarHBondContact O-ND1 3.09Å |
| 180 | V | 91.7 | Very high | 91.7 | Very high | 39 Ų | 39 | 55.4 Ų | 55.4 | 24% | 0.236 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -108.5 | -49.3 | -176.1 | -176.7 | 0 | 0 | 0 | 0 | 110.3 | A121 L176 H182 | A121-V180 HydrophobicContact CB-CG2 3.98Å; L176-V180 HydrophobicContact CD2-CG2 3.83Å; L176-V180 WeakPolarHBondContact O-CA 3.31Å; L176-V180 VanDerWaalsContact O-CB 3.31Å; L176-V180 WeakPolarHBondContact O-CB 3.34Å; L176-V180 PolarHBondContact O-N 3.47Å; V180-H182 VanDerWaalsContact C-N 3.34Å; V180-H182 PolarHBondContact O-CE1 3.39Å; V180-H182 PolarHBondContact O-ND1 3.33Å |
| 181 | F | 90.5 | Very high | 91.6 | Very high | 149 Ų | 149 | 53.3 Ų | 53.3 | 65% | 0.654 | 26% | 0.261 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.8 | -5.4 | -177.8 | -61.7 | -66.6 | 0 | 0 | 0 | 113.8 | L176 R183 | L176-F181 HydrophobicContact CB-CE2 4.37Å; L176-F181 WeakPolarHBondContact O-CD2 3.38Å; L176-F181 PolarHBondContact O-N 3.05Å; L176-F181 VanDerWaalsContact O-N 3.08Å; F181-R183 PolarHBondContact O-N 3.38Å; F181-R183 VanDerWaalsContact O-N 3.13Å |
| 182 | H | 86.3 | Confident | 91.6 | Very high | 75 Ų | 75 | 59.5 Ų | 59.5 | 35% | 0.347 | 29% | 0.288 | S | S | . | . | trans | 50.2 | 37.2 | 178 | -59 | 76.2 | 0 | 0 | 0 | 112.7 | M110 Q117 D177 F178 V180 K184 | M110-H182 HydrophobicContact CE-CB 4.48Å; M110-H182 HydrophobicContact SD-CB 3.71Å; M110-H182 VanDerWaalsContact SD-CD2 3.53Å; Q117-H182 PolarHBondContact NE2-CE1 3.21Å; Q117-H182 PolarHBondContact NE2-NE2 3.43Å; D177-H182 PolarHBondContact O-N 3.12Å; F178-H182 WeakPolarHBondContact O-CA 3.33Å; F178-H182 PolarHBondContact O-N 2.97Å; V180-H182 VanDerWaalsContact C-N 3.34Å; V180-H182 PolarHBondContact O-CE1 3.39Å; V180-H182 PolarHBondContact O-ND1 3.33Å; H182-K184 PolarHBondContact O-N 3.05Å | ||
| 183 | R | 87.4 | Confident | 91.5 | Very high | 136 Ų | 136 | 60 Ų | 60 | 51% | 0.513 | 29% | 0.288 | S | S | . | . | trans | -76 | 124.8 | -175.6 | -167.4 | 175.7 | -172.1 | 158.3 | 1.9 | 110.2 | D177 F181 D185 | D177-R183 WeakPolarHBondContact O-CB 3.4Å; D177-R183 PolarHBondContact O-N 3.2Å; D177-R183 VanDerWaalsContact O-N 3.08Å; D177-R183 WeakPolarHBondContact OD1-CD 3.26Å; D177-R183 IonicContact OD1-NH1 2.87Å; D177-R183 WeakPolarHBondContact OD2-CD 3.4Å; F181-R183 PolarHBondContact O-N 3.38Å; F181-R183 VanDerWaalsContact O-N 3.13Å; R183-D185 PolarHBondContact O-N 3Å | ||
| 184 | K | 85.9 | Confident | 91.5 | Very high | 109 Ų | 109 | 55.4 Ų | 55.4 | 47% | 0.474 | 27% | 0.272 | S | S | . | . | trans | -81.3 | 101.2 | 174.3 | -58.3 | -169.3 | -174.2 | -162.5 | 0 | 110.2 | D105 E107 H182 | D105-K184 IonicContact OD2-NZ 2.69Å; E107-K184 WeakPolarHBondContact OE1-CE 3.45Å; E107-K184 IonicContact OE1-NZ 3.52Å; E107-K184 PolarHBondContact OE1-NZ 3.42Å; E107-K184 IonicContact OE2-NZ 2.88Å; E107-K184 PolarHBondContact OE2-NZ 3.34Å; H182-K184 PolarHBondContact O-N 3.05Å | ||
| 185 | D | 88.2 | Confident | 91.5 | Very high | 27 Ų | 27 | 54.9 Ų | 54.9 | 14% | 0.144 | 27% | 0.27 | C | S | . | . | trans | -79.5 | 149.8 | 173.1 | -74.6 | -43.2 | 0 | 0 | 0 | 111.9 | R183 V189 F190 K193 | R183-D185 PolarHBondContact O-N 3Å; D185-V189 HydrophobicContact CB-CB 4.33Å; D185-V189 HydrophobicContact CB-CG1 4.18Å; D185-F190 HydrophobicContact CB-CB 4.06Å; D185-K193 IonicContact OD1-NZ 3.97Å; D185-K193 PolarHBondContact OD1-NZ 3.44Å; D185-K193 WeakPolarHBondContact OD2-CE 3.37Å; D185-K193 IonicContact OD2-NZ 3.7Å; D185-K193 PolarHBondContact OD2-NZ 3.26Å | ||
| 186 | S | 90.3 | Very high | 91.7 | Very high | 65 Ų | 65 | 55.1 Ų | 55.1 | 46% | 0.455 | 28% | 0.277 | S | S | . | . | trans | -64.4 | 151.1 | 164.2 | 73.2 | 0 | 0 | 0 | 0 | 110.4 | N188 V189 F190 | S186-N188 VanDerWaalsContact C-N 3.26Å; S186-N188 PolarHBondContact O-N 3.48Å; S186-N188 VanDerWaalsContact O-N 3.13Å; S186-V189 PolarHBondContact O-N 2.85Å; S186-V189 VanDerWaalsContact OG-CG2 3.25Å; S186-V189 WeakPolarHBondContact OG-CG2 3.31Å; S186-F190 PolarHBondContact O-N 3.13Å | ||
| 187 | P | 89.3 | Confident | 91.7 | Very high | 51 Ų | 51 | 55.1 Ų | 55.1 | 33% | 0.331 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -50.9 | -42.1 | -177.7 | -31.2 | 36.6 | 0 | 0 | 0 | 114.4 | F190 L191 L271 | P187-F190 PolarHBondContact O-N 3.36Å; P187-L191 WeakPolarHBondContact O-CB 3.38Å; P187-L191 VanDerWaalsContact O-CG 3.26Å; P187-L191 WeakPolarHBondContact O-CG 3.38Å; P187-L191 PolarHBondContact O-N 3.44Å; P187-L271 HydrophobicContact CB-CD1 3.67Å; P187-L271 HydrophobicContact CB-CD2 4.14Å; P187-L271 HydrophobicContact CG-CD1 4.31Å; P187-L271 HydrophobicContact CG-CD2 4.46Å |
| 188 | N | 91.4 | Very high | 91.7 | Very high | 107 Ų | 107 | 55.4 Ų | 55.4 | 57% | 0.572 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -70.1 | -36.4 | -179.7 | -66.6 | -12.2 | 0 | 0 | 0 | 112.6 | S186 F192 L253 | S186-N188 VanDerWaalsContact C-N 3.26Å; S186-N188 PolarHBondContact O-N 3.48Å; S186-N188 VanDerWaalsContact O-N 3.13Å; N188-F192 VanDerWaalsContact O-CB 3.23Å; N188-F192 WeakPolarHBondContact O-CB 3.45Å; N188-F192 PolarHBondContact O-N 2.96Å; N188-L253 HydrophobicContact CB-CD1 4.11Å |
| 189 | V | 93.3 | Very high | 91.9 | Very high | 62 Ų | 62 | 55 Ų | 55 | 38% | 0.376 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -68.7 | -43 | 176.6 | 171.8 | 0 | 0 | 0 | 0 | 110.2 | D185 S186 F192 K193 | D185-V189 HydrophobicContact CB-CB 4.33Å; D185-V189 HydrophobicContact CB-CG1 4.18Å; S186-V189 PolarHBondContact O-N 2.85Å; S186-V189 VanDerWaalsContact OG-CG2 3.25Å; S186-V189 WeakPolarHBondContact OG-CG2 3.31Å; V189-F192 PolarHBondContact O-N 2.98Å; V189-K193 HydrophobicContact CG1-CD 4.41Å; V189-K193 WeakPolarHBondContact O-CG 3.25Å; V189-K193 PolarHBondContact O-N 2.94Å |
| 190 | F | 92.1 | Very high | 92.1 | Very high | 22 Ų | 22 | 54 Ų | 54 | 10% | 0.096 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60.2 | -51.7 | 175.6 | 179.5 | -94 | 0 | 0 | 0 | 111.5 | M106 F178 D185 S186 P187 F192 K193 L194 P270 L271 | M106-F190 HydrophobicContact CE-CB 3.88Å; M106-F190 HydrophobicContact CE-CD1 3.81Å; M106-F190 HydrophobicContact CE-CD2 3.88Å; M106-F190 HydrophobicContact CE-CE1 4.36Å; M106-F190 HydrophobicContact CE-CE2 4.4Å; M106-F190 HydrophobicContact CE-CG 3.55Å; M106-F190 HydrophobicContact SD-CD2 4.35Å; M106-F190 HydrophobicContact SD-CE2 4.47Å; F178-F190 HydrophobicContact CD2-CE2 4.13Å; F178-F190 HydrophobicContact CE2-CE2 4.01Å; D185-F190 HydrophobicContact CB-CB 4.06Å; S186-F190 PolarHBondContact O-N 3.13Å; P187-F190 PolarHBondContact O-N 3.36Å; F190-F192 VanDerWaalsContact C-N 3.27Å; F190-F192 PolarHBondContact O-N 3.4Å; F190-K193 PolarHBondContact O-N 2.85Å; F190-L194 HydrophobicContact CE1-CD2 3.92Å; F190-L194 HydrophobicContact CZ-CD2 4.36Å; F190-L194 WeakPolarHBondContact O-CB 3.44Å; F190-L194 PolarHBondContact O-N 2.76Å; F190-P270 HydrophobicContact CE1-CB 4.02Å; F190-P270 HydrophobicContact CE1-CG 4.3Å; F190-P270 WeakPolarHBondContact CE1-O 3.32Å; F190-P270 HydrophobicContact CE2-CG 4.41Å; F190-P270 HydrophobicContact CZ-CB 4.1Å; F190-P270 HydrophobicContact CZ-CG 3.88Å; F190-L271 HydrophobicContact CD1-CD1 4.04Å |
| 191 | L | 94 | Very high | 92.1 | Very high | 7 Ų | 7 | 52.9 Ų | 52.9 | 4% | 0.037 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.2 | -31.8 | 178.5 | -69.8 | 175.8 | 0 | 0 | 0 | 112.4 | P187 G195 P252 L253 N257 L271 I272 | P187-L191 WeakPolarHBondContact O-CB 3.38Å; P187-L191 VanDerWaalsContact O-CG 3.26Å; P187-L191 WeakPolarHBondContact O-CG 3.38Å; P187-L191 PolarHBondContact O-N 3.44Å; L191-G195 WeakPolarHBondContact O-CA 3.31Å; L191-G195 PolarHBondContact O-N 3.36Å; L191-P252 HydrophobicContact CD2-CB 4.09Å; L191-L253 HydrophobicContact CB-CB 4.48Å; L191-L253 HydrophobicContact CB-CD1 4.03Å; L191-N257 HydrophobicContact CD1-CB 4.14Å; L191-L271 HydrophobicContact CD2-CB 4.09Å; L191-L271 HydrophobicContact CG-CB 4.46Å; L191-L271 HydrophobicContact CG-CD1 4.46Å; L191-I272 HydrophobicContact CD2-CD1 3.7Å |
| 192 | F | 95.2 | Very high | 92.3 | Very high | 148 Ų | 148 | 46.2 Ų | 46.2 | 65% | 0.649 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -68.9 | -45.7 | 173.6 | -179.9 | -96 | 0 | 0 | 0 | 112.3 | N188 V189 F190 G195 G196 L253 | N188-F192 VanDerWaalsContact O-CB 3.23Å; N188-F192 WeakPolarHBondContact O-CB 3.45Å; N188-F192 PolarHBondContact O-N 2.96Å; V189-F192 PolarHBondContact O-N 2.98Å; F190-F192 VanDerWaalsContact C-N 3.27Å; F190-F192 PolarHBondContact O-N 3.4Å; F192-G195 PolarHBondContact O-N 2.86Å; F192-G196 PolarHBondContact O-N 2.94Å; F192-L253 HydrophobicContact CD2-CD2 4.29Å |
| 193 | K | 94.4 | Very high | 92.8 | Very high | 26 Ų | 26 | 42.7 Ų | 42.7 | 11% | 0.113 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -59.3 | -50.9 | 174.9 | -74.1 | 179 | -172.2 | 172 | 0 | 110.6 | D177 D185 V189 F190 G196 V197 | D177-K193 IonicContact OD2-NZ 3.38Å; D177-K193 PolarHBondContact OD2-NZ 3.45Å; D185-K193 IonicContact OD1-NZ 3.97Å; D185-K193 PolarHBondContact OD1-NZ 3.44Å; D185-K193 WeakPolarHBondContact OD2-CE 3.37Å; D185-K193 IonicContact OD2-NZ 3.7Å; D185-K193 PolarHBondContact OD2-NZ 3.26Å; V189-K193 HydrophobicContact CG1-CD 4.41Å; V189-K193 WeakPolarHBondContact O-CG 3.25Å; V189-K193 PolarHBondContact O-N 2.94Å; F190-K193 PolarHBondContact O-N 2.85Å; K193-G196 PolarHBondContact O-N 3.48Å; K193-V197 WeakPolarHBondContact O-CG2 3.39Å; K193-V197 PolarHBondContact O-N 3.46Å; K193-V197 VanDerWaalsContact O-N 3.15Å |
| 194 | L | 93.8 | Very high | 93.1 | Very high | 28 Ų | 28 | 36.2 Ų | 36.2 | 15% | 0.147 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.7 | -44.8 | 177.8 | -177.2 | 59.5 | 0 | 0 | 0 | 111.4 | F190 G196 V197 T198 F269 I272 | F190-L194 HydrophobicContact CE1-CD2 3.92Å; F190-L194 HydrophobicContact CZ-CD2 4.36Å; F190-L194 WeakPolarHBondContact O-CB 3.44Å; F190-L194 PolarHBondContact O-N 2.76Å; L194-G196 VanDerWaalsContact C-N 3.31Å; L194-G196 PolarHBondContact O-N 2.94Å; L194-V197 WeakPolarHBondContact O-CB 3.33Å; L194-V197 PolarHBondContact O-N 3.04Å; L194-V197 VanDerWaalsContact O-N 3.12Å; L194-T198 WeakPolarHBondContact O-CB 3.2Å; L194-T198 PolarHBondContact O-N 2.84Å; L194-T198 PolarHBondContact O-OG1 3.08Å; L194-F269 HydrophobicContact CD1-CD1 3.99Å; L194-F269 HydrophobicContact CD1-CE1 3.97Å; L194-F269 HydrophobicContact CD2-CB 4.46Å; L194-F269 HydrophobicContact CD2-CD1 4.07Å; L194-I272 HydrophobicContact CD2-CD1 3.85Å; L194-I272 HydrophobicContact CD2-CG1 3.67Å |
| 195 | G | 95.4 | Very high | 93.4 | Very high | 8 Ų | 8 | 31.1 Ų | 31.1 | 8% | 0.082 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -59.1 | -39 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L191 F192 V197 T198 A199 A249 | L191-G195 WeakPolarHBondContact O-CA 3.31Å; L191-G195 PolarHBondContact O-N 3.36Å; F192-G195 PolarHBondContact O-N 2.86Å; G195-V197 PolarHBondContact O-N 2.65Å; G195-T198 PolarHBondContact O-N 2.82Å; G195-A199 WeakPolarHBondContact O-CB 3.47Å; G195-A199 PolarHBondContact O-N 3.42Å; G195-A249 VanDerWaalsContact O-CB 3.3Å; G195-A249 WeakPolarHBondContact O-CB 3.32Å |
| 196 | G | 95.8 | Very high | 93.6 | Very high | 20 Ų | 20 | 30 Ų | 30 | 21% | 0.206 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.7 | -42.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | F192 K193 L194 S200 | F192-G196 PolarHBondContact O-N 2.94Å; K193-G196 PolarHBondContact O-N 3.48Å; L194-G196 VanDerWaalsContact C-N 3.31Å; L194-G196 PolarHBondContact O-N 2.94Å; G196-S200 WeakPolarHBondContact O-CB 3.41Å; G196-S200 PolarHBondContact O-N 3.15Å; G196-S200 VanDerWaalsContact O-N 3.09Å; G196-S200 PolarHBondContact O-OG 3.49Å |
| 197 | V | 94.3 | Very high | 93.8 | Very high | 17 Ų | 17 | 27 Ų | 27 | 10% | 0.103 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64 | -50.5 | 174.5 | 175.3 | 0 | 0 | 0 | 0 | 110.7 | I170 F171 K193 L194 G195 A199 S200 F201 | I170-V197 HydrophobicContact CB-CG2 4.32Å; I170-V197 HydrophobicContact CG2-CG2 3.71Å; F171-V197 HydrophobicContact CB-CG1 4.46Å; F171-V197 HydrophobicContact CB-CG2 4.18Å; F171-V197 HydrophobicContact CD2-CG1 4Å; K193-V197 WeakPolarHBondContact O-CG2 3.39Å; K193-V197 PolarHBondContact O-N 3.46Å; K193-V197 VanDerWaalsContact O-N 3.15Å; L194-V197 WeakPolarHBondContact O-CB 3.33Å; L194-V197 PolarHBondContact O-N 3.04Å; L194-V197 VanDerWaalsContact O-N 3.12Å; G195-V197 PolarHBondContact O-N 2.65Å; V197-A199 PolarHBondContact O-N 2.96Å; V197-S200 PolarHBondContact O-N 3.41Å; V197-F201 HydrophobicContact CG1-CD2 3.48Å; V197-F201 VanDerWaalsContact CG1-CD2 3.48Å; V197-F201 HydrophobicContact CG1-CE2 3.39Å; V197-F201 VanDerWaalsContact O-CD2 3.29Å; V197-F201 WeakPolarHBondContact O-CD2 3.3Å; V197-F201 PolarHBondContact O-N 3.2Å |
| 198 | T | 94.5 | Very high | 93.8 | Very high | 19 Ų | 19 | 24.9 Ų | 24.9 | 12% | 0.117 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -60.9 | -43.1 | 179.1 | -57.7 | 0 | 0 | 0 | 0 | 111.9 | L194 G195 T202 A249 W280 | L194-T198 WeakPolarHBondContact O-CB 3.2Å; L194-T198 PolarHBondContact O-N 2.84Å; L194-T198 PolarHBondContact O-OG1 3.08Å; G195-T198 PolarHBondContact O-N 2.82Å; T198-T202 VanDerWaalsContact O-CB 3.22Å; T198-T202 WeakPolarHBondContact O-CB 3.37Å; T198-T202 PolarHBondContact O-N 3.46Å; T198-T202 PolarHBondContact O-OG1 2.98Å; T198-A249 HydrophobicContact CG2-CB 4.06Å; T198-W280 HydrophobicContact CG2-CZ2 4.41Å; T198-W280 VanDerWaalsContact CG2-NE1 3.33Å |
| 199 | A | 96.2 | Very high | 93.8 | Very high | 11 Ų | 11 | 22.1 Ų | 22.1 | 9% | 0.091 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -61.4 | -46 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | G195 V197 T202 A203 I246 A249 | G195-A199 WeakPolarHBondContact O-CB 3.47Å; G195-A199 PolarHBondContact O-N 3.42Å; V197-A199 PolarHBondContact O-N 2.96Å; A199-T202 PolarHBondContact O-N 3.19Å; A199-A203 VanDerWaalsContact O-CB 3.23Å; A199-A203 WeakPolarHBondContact O-CB 3.36Å; A199-A203 PolarHBondContact O-N 2.8Å; A199-I246 HydrophobicContact CB-CG1 4.4Å; A199-A249 HydrophobicContact CB-CB 3.58Å |
| 200 | S | 95.3 | Very high | 93.8 | Very high | 7 Ų | 7 | 20.3 Ų | 20.3 | 5% | 0.049 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -66.3 | -45.2 | -178.5 | -58.1 | 0 | 0 | 0 | 0 | 111.8 | G167 G196 V197 A203 S204 | G167-S200 PolarHBondContact N-OG 3.22Å; G196-S200 WeakPolarHBondContact O-CB 3.41Å; G196-S200 PolarHBondContact O-N 3.15Å; G196-S200 VanDerWaalsContact O-N 3.09Å; G196-S200 PolarHBondContact O-OG 3.49Å; V197-S200 PolarHBondContact O-N 3.41Å; S200-A203 PolarHBondContact O-N 2.97Å; S200-S204 WeakPolarHBondContact O-CB 3.2Å; S200-S204 PolarHBondContact O-N 3.08Å |
| 201 | F | 91.7 | Very high | 93.7 | Very high | 17 Ų | 17 | 19.6 Ų | 19.6 | 8% | 0.075 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -66 | -41.3 | 175.7 | -78.7 | -55.9 | 0 | 0 | 0 | 112.5 | F171 V197 A203 S204 V205 W357 C387 | F171-F201 HydrophobicContact CD2-CE2 4.17Å; V197-F201 HydrophobicContact CG1-CD2 3.48Å; V197-F201 VanDerWaalsContact CG1-CD2 3.48Å; V197-F201 HydrophobicContact CG1-CE2 3.39Å; V197-F201 VanDerWaalsContact O-CD2 3.29Å; V197-F201 WeakPolarHBondContact O-CD2 3.3Å; V197-F201 PolarHBondContact O-N 3.2Å; F201-A203 VanDerWaalsContact C-N 3.32Å; F201-A203 PolarHBondContact O-N 3.46Å; F201-S204 WeakPolarHBondContact O-CB 3.43Å; F201-S204 PolarHBondContact O-N 3.19Å; F201-V205 WeakPolarHBondContact O-CG2 3.29Å; F201-V205 PolarHBondContact O-N 2.88Å; F201-W357 HydrophobicContact CB-CH2 4.24Å; F201-C387 HydrophobicContact CD1-CB 4.29Å; F201-C387 HydrophobicContact CE1-CB 3.51Å; F201-C387 HydrophobicContact CE2-CB 4.08Å; F201-C387 HydrophobicContact CZ-CB 3.39Å |
| 202 | T | 94.3 | Very high | 93.4 | Very high | 9 Ų | 9 | 19.2 Ų | 19.2 | 6% | 0.055 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -62.4 | -41.7 | 175.7 | -53.8 | 0 | 0 | 0 | 0 | 110.7 | T198 A199 S204 V205 G206 W280 | T198-T202 VanDerWaalsContact O-CB 3.22Å; T198-T202 WeakPolarHBondContact O-CB 3.37Å; T198-T202 PolarHBondContact O-N 3.46Å; T198-T202 PolarHBondContact O-OG1 2.98Å; A199-T202 PolarHBondContact O-N 3.19Å; T202-S204 VanDerWaalsContact C-N 3.35Å; T202-S204 PolarHBondContact O-N 3.47Å; T202-V205 PolarHBondContact O-N 3.49Å; T202-G206 PolarHBondContact O-N 2.87Å; T202-W280 PolarHBondContact OG1-NE1 3.47Å; T202-W280 VanDerWaalsContact OG1-NE1 3.08Å |
| 203 | A | 95.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 14.7 Ų | 14.7 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -67.9 | -33.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | A163 A199 S200 F201 S207 M241 W242 S245 | A163-A203 HydrophobicContact CB-CB 4.09Å; A199-A203 VanDerWaalsContact O-CB 3.23Å; A199-A203 WeakPolarHBondContact O-CB 3.36Å; A199-A203 PolarHBondContact O-N 2.8Å; S200-A203 PolarHBondContact O-N 2.97Å; F201-A203 VanDerWaalsContact C-N 3.32Å; F201-A203 PolarHBondContact O-N 3.46Å; A203-S207 VanDerWaalsContact O-CB 3.3Å; A203-S207 WeakPolarHBondContact O-CB 3.45Å; A203-S207 PolarHBondContact O-N 2.92Å; A203-S207 PolarHBondContact O-OG 3.5Å; A203-M241 HydrophobicContact CB-SD 4.09Å; A203-M241 WeakPolarHBondContact O-CE 3.36Å; A203-W242 HydrophobicContact CB-CD2 4.17Å; A203-W242 HydrophobicContact CB-CE3 4.24Å; A203-W242 HydrophobicContact CB-CH2 4.34Å; A203-W242 HydrophobicContact CB-CZ2 4.28Å; A203-W242 HydrophobicContact CB-CZ3 4.32Å; A203-S245 PolarHBondContact N-OG 3.16Å |
| 204 | S | 93.8 | Very high | 93 | Very high | 1 Ų | 1 | 13.6 Ų | 13.6 | 1% | 0.007 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -65.6 | -51.1 | 174.3 | -177.2 | 0 | 0 | 0 | 0 | 110.7 | L160 D164 S200 F201 T202 G206 S207 L208 | L160-S204 WeakPolarHBondContact CD1-O 3.4Å; L160-S204 WeakPolarHBondContact CD1-OG 3.48Å; D164-S204 PolarHBondContact OD1-OG 3Å; S200-S204 WeakPolarHBondContact O-CB 3.2Å; S200-S204 PolarHBondContact O-N 3.08Å; F201-S204 WeakPolarHBondContact O-CB 3.43Å; F201-S204 PolarHBondContact O-N 3.19Å; T202-S204 VanDerWaalsContact C-N 3.35Å; T202-S204 PolarHBondContact O-N 3.47Å; S204-G206 VanDerWaalsContact C-N 3.34Å; S204-G206 PolarHBondContact O-N 2.95Å; S204-S207 WeakPolarHBondContact O-CB 3.36Å; S204-S207 PolarHBondContact O-N 3.31Å; S204-S207 VanDerWaalsContact O-N 3.15Å; S204-L208 PolarHBondContact O-N 3.1Å |
| 205 | V | 92.4 | Very high | 92.6 | Very high | 1 Ų | 1 | 15.3 Ų | 15.3 | 1% | 0.006 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -60.9 | -42.7 | 173.9 | 177.3 | 0 | 0 | 0 | 0 | 111.4 | F201 T202 S207 L208 F209 L287 V288 I291 W357 | F201-V205 WeakPolarHBondContact O-CG2 3.29Å; F201-V205 PolarHBondContact O-N 2.88Å; T202-V205 PolarHBondContact O-N 3.49Å; V205-S207 VanDerWaalsContact C-N 3.31Å; V205-S207 PolarHBondContact O-N 3.48Å; V205-L208 WeakPolarHBondContact O-CB 3.4Å; V205-L208 PolarHBondContact O-N 2.86Å; V205-F209 WeakPolarHBondContact O-CB 3.48Å; V205-F209 PolarHBondContact O-N 2.9Å; V205-L287 HydrophobicContact CG1-CB 3.94Å; V205-L287 HydrophobicContact CG1-CD1 4.29Å; V205-V288 HydrophobicContact CG1-CG2 4.27Å; V205-I291 HydrophobicContact CG1-CD1 4.24Å; V205-W357 HydrophobicContact CG2-CH2 3.58Å; V205-W357 HydrophobicContact CG2-CZ2 3.1Å; V205-W357 HydrophobicContact CG2-CZ3 4.46Å |
| 206 | G | 93.7 | Very high | 92.2 | Very high | 5 Ų | 5 | 18.6 Ų | 18.6 | 5% | 0.052 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -60.5 | -38.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | T202 S204 F209 L210 | T202-G206 PolarHBondContact O-N 2.87Å; S204-G206 VanDerWaalsContact C-N 3.34Å; S204-G206 PolarHBondContact O-N 2.95Å; G206-F209 WeakPolarHBondContact O-CB 3.47Å; G206-F209 PolarHBondContact O-N 3.28Å; G206-L210 WeakPolarHBondContact O-CG 3.1Å; G206-L210 PolarHBondContact O-N 3.41Å |
| 207 | S | 93.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 19.3 Ų | 19.3 | 0% | 0 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -68.8 | -37 | 175.1 | -61.5 | 0 | 0 | 0 | 0 | 112.1 | S159 A203 S204 V205 L210 T211 M241 | S159-S207 PolarHBondContact OG-OG 3.41Å; A203-S207 VanDerWaalsContact O-CB 3.3Å; A203-S207 WeakPolarHBondContact O-CB 3.45Å; A203-S207 PolarHBondContact O-N 2.92Å; A203-S207 PolarHBondContact O-OG 3.5Å; S204-S207 WeakPolarHBondContact O-CB 3.36Å; S204-S207 PolarHBondContact O-N 3.31Å; S204-S207 VanDerWaalsContact O-N 3.15Å; V205-S207 VanDerWaalsContact C-N 3.31Å; V205-S207 PolarHBondContact O-N 3.48Å; S207-L210 PolarHBondContact O-N 2.81Å; S207-T211 WeakPolarHBondContact O-CB 3.33Å; S207-T211 PolarHBondContact O-N 2.91Å; S207-T211 PolarHBondContact O-OG1 3.41Å; S207-M241 WeakPolarHBondContact OG-CE 3.28Å |
| 208 | L | 89.6 | Confident | 91.4 | Very high | 8 Ų | 8 | 20 Ų | 20 | 4% | 0.042 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -64.8 | -39.9 | 171.6 | -70.5 | 173.6 | 0 | 0 | 0 | 111.7 | L160 S204 V205 T211 A212 I291 L353 | L160-L208 HydrophobicContact CD1-CG 4.31Å; L160-L208 HydrophobicContact CD2-CD2 3.91Å; L160-L208 HydrophobicContact CD2-CG 4.45Å; S204-L208 PolarHBondContact O-N 3.1Å; V205-L208 WeakPolarHBondContact O-CB 3.4Å; V205-L208 PolarHBondContact O-N 2.86Å; L208-T211 WeakPolarHBondContact O-CB 3.44Å; L208-T211 PolarHBondContact O-N 2.92Å; L208-A212 PolarHBondContact O-N 3.34Å; L208-I291 HydrophobicContact CB-CD1 4.02Å; L208-L353 HydrophobicContact CD1-CD1 4.17Å |
| 209 | F | 92.2 | Very high | 90.8 | Very high | 48 Ų | 48 | 22 Ų | 22 | 21% | 0.211 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.7 | -47.9 | 174.3 | 172.2 | -101.2 | 0 | 0 | 0 | 112.2 | V205 G206 T211 A212 I213 L287 F290 I291 | V205-F209 WeakPolarHBondContact O-CB 3.48Å; V205-F209 PolarHBondContact O-N 2.9Å; G206-F209 WeakPolarHBondContact O-CB 3.47Å; G206-F209 PolarHBondContact O-N 3.28Å; F209-T211 VanDerWaalsContact C-N 3.26Å; F209-T211 PolarHBondContact O-N 3.38Å; F209-A212 WeakPolarHBondContact O-CA 3.46Å; F209-A212 WeakPolarHBondContact O-CB 3.46Å; F209-A212 PolarHBondContact O-N 2.98Å; F209-I213 HydrophobicContact CD1-CD1 3.9Å; F209-I213 HydrophobicContact CE1-CD1 3.3Å; F209-I213 HydrophobicContact CE1-CG1 4.36Å; F209-I213 HydrophobicContact CE2-CD1 4.15Å; F209-I213 HydrophobicContact CZ-CD1 3.46Å; F209-I213 VanDerWaalsContact CZ-CD1 3.46Å; F209-I213 HydrophobicContact CZ-CG1 4.3Å; F209-I213 PolarHBondContact O-N 2.74Å; F209-L287 HydrophobicContact CB-CD2 4.44Å; F209-L287 HydrophobicContact CD1-CD2 4.25Å; F209-L287 HydrophobicContact CD2-CD2 3.86Å; F209-L287 HydrophobicContact CE1-CD2 4.44Å; F209-L287 HydrophobicContact CE2-CD2 4.05Å; F209-L287 HydrophobicContact CG-CD2 3.95Å; F209-L287 HydrophobicContact CZ-CD2 4.34Å; F209-F290 HydrophobicContact CD2-CB 4.5Å; F209-F290 AromaticContact CD2-CD1 3.46Å; F209-F290 HydrophobicContact CD2-CD1 3.46Å; F209-F290 VanDerWaalsContact CD2-CD1 3.46Å; F209-F290 AromaticContact CD2-CE1 3.92Å; F209-F290 HydrophobicContact CD2-CE1 3.92Å; F209-F290 HydrophobicContact CD2-CG 4.19Å; F209-F290 HydrophobicContact CE2-CB 4.25Å; F209-F290 AromaticContact CE2-CD1 3.16Å; F209-F290 HydrophobicContact CE2-CD1 3.16Å; F209-F290 HydrophobicContact CE2-CD2 4.34Å; F209-F290 AromaticContact CE2-CE1 3.41Å; F209-F290 HydrophobicContact CE2-CE1 3.41Å; F209-F290 VanDerWaalsContact CE2-CE1 3.41Å; F209-F290 AromaticContact CE2-CG 3.67Å; F209-F290 HydrophobicContact CE2-CG 3.67Å; F209-F290 HydrophobicContact CE2-CZ 4.11Å; F209-F290 HydrophobicContact CZ-CD1 4.33Å; F209-F290 HydrophobicContact CZ-CE1 4.25Å; F209-I291 HydrophobicContact CB-CD1 4.04Å; F209-I291 HydrophobicContact CB-CG1 4.11Å; F209-I291 HydrophobicContact CD2-CG1 4.39Å |
| 210 | L | 92.3 | Very high | 90.2 | Very high | 24 Ų | 24 | 24.2 Ų | 24.2 | 13% | 0.126 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61 | -37.6 | 174.6 | -70.7 | 176.9 | 0 | 0 | 0 | 111.8 | F156 G206 S207 I213 D214 A237 F238 M241 | F156-L210 HydrophobicContact CD1-CB 3.82Å; F156-L210 HydrophobicContact CD1-CD1 4.03Å; F156-L210 HydrophobicContact CE1-CB 3.98Å; F156-L210 HydrophobicContact CE1-CD1 4.01Å; F156-L210 HydrophobicContact CE1-CG 4.46Å; F156-L210 HydrophobicContact CG-CB 4.36Å; G206-L210 WeakPolarHBondContact O-CG 3.1Å; G206-L210 PolarHBondContact O-N 3.41Å; S207-L210 PolarHBondContact O-N 2.81Å; L210-I213 PolarHBondContact O-N 2.83Å; L210-D214 PolarHBondContact O-N 3.23Å; L210-A237 HydrophobicContact CD2-CB 4.3Å; L210-F238 HydrophobicContact CD1-CB 4.32Å; L210-M241 HydrophobicContact CD1-CB 4.03Å; L210-M241 HydrophobicContact CD1-CE 4.32Å; L210-M241 HydrophobicContact CD1-CG 4.22Å |
| 211 | T | 89.8 | Confident | 89.7 | Confident | 7 Ų | 7 | 31.1 Ų | 31.1 | 4% | 0.043 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.7 | -41.7 | 172.9 | -58.6 | 0 | 0 | 0 | 0 | 111.3 | S207 L208 F209 D214 R215 | S207-T211 WeakPolarHBondContact O-CB 3.33Å; S207-T211 PolarHBondContact O-N 2.91Å; S207-T211 PolarHBondContact O-OG1 3.41Å; L208-T211 WeakPolarHBondContact O-CB 3.44Å; L208-T211 PolarHBondContact O-N 2.92Å; F209-T211 VanDerWaalsContact C-N 3.26Å; F209-T211 PolarHBondContact O-N 3.38Å; T211-D214 PolarHBondContact O-N 3.11Å; T211-R215 VanDerWaalsContact O-CG 3.31Å; T211-R215 WeakPolarHBondContact O-CG 2.82Å; T211-R215 PolarHBondContact O-N 3.37Å |
| 212 | A | 88.8 | Confident | 89.4 | Confident | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -62.9 | -41.9 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | L208 F209 R215 Y216 I291 A294 Y295 | L208-A212 PolarHBondContact O-N 3.34Å; F209-A212 WeakPolarHBondContact O-CA 3.46Å; F209-A212 WeakPolarHBondContact O-CB 3.46Å; F209-A212 PolarHBondContact O-N 2.98Å; A212-R215 PolarHBondContact O-N 2.98Å; A212-Y216 VanDerWaalsContact O-CB 3.29Å; A212-Y216 WeakPolarHBondContact O-CB 3.32Å; A212-Y216 PolarHBondContact O-N 3.09Å; A212-I291 HydrophobicContact CB-CG1 4.38Å; A212-A294 HydrophobicContact CB-CB 4.24Å; A212-Y295 HydrophobicContact CB-CE2 4.39Å |
| 213 | I | 90.1 | Very high | 89.1 | Confident | 52 Ų | 52 | 42.6 Ų | 42.6 | 27% | 0.267 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -61.8 | -47.9 | 173.7 | -69.4 | 175.4 | 0 | 0 | 0 | 111.3 | F209 L210 R215 Y216 I217 F290 | F209-I213 HydrophobicContact CD1-CD1 3.9Å; F209-I213 HydrophobicContact CE1-CD1 3.3Å; F209-I213 HydrophobicContact CE1-CG1 4.36Å; F209-I213 HydrophobicContact CE2-CD1 4.15Å; F209-I213 HydrophobicContact CZ-CD1 3.46Å; F209-I213 VanDerWaalsContact CZ-CD1 3.46Å; F209-I213 HydrophobicContact CZ-CG1 4.3Å; F209-I213 PolarHBondContact O-N 2.74Å; L210-I213 PolarHBondContact O-N 2.83Å; I213-R215 VanDerWaalsContact C-N 3.28Å; I213-R215 PolarHBondContact O-N 2.74Å; I213-Y216 WeakPolarHBondContact O-CB 2.99Å; I213-Y216 PolarHBondContact O-N 3.23Å; I213-I217 HydrophobicContact CG2-CD1 3.64Å; I213-I217 HydrophobicContact CG2-CG1 4.26Å; I213-I217 VanDerWaalsContact O-CG1 3.31Å; I213-I217 WeakPolarHBondContact O-CG1 3.44Å; I213-I217 PolarHBondContact O-N 3.43Å; I213-F290 HydrophobicContact CG1-CE1 4.15Å |
| 214 | D | 89.6 | Confident | 88.9 | Confident | 4 Ų | 4 | 43.7 Ų | 43.7 | 2% | 0.021 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -54.3 | -47.3 | 176.6 | 171.2 | 70.9 | 0 | 0 | 0 | 111 | F156 L210 T211 I217 S218 Y225 | F156-D214 HydrophobicContact CD2-CB 4.27Å; F156-D214 HydrophobicContact CE2-CB 4.06Å; L210-D214 PolarHBondContact O-N 3.23Å; T211-D214 PolarHBondContact O-N 3.11Å; D214-I217 PolarHBondContact O-N 3.38Å; D214-S218 WeakPolarHBondContact O-CB 3.17Å; D214-S218 PolarHBondContact O-N 3.33Å; D214-Y225 VanDerWaalsContact OD1-CE2 3.27Å; D214-Y225 WeakPolarHBondContact OD1-CE2 3.35Å; D214-Y225 PolarHBondContact OD1-OH 2.94Å |
| 215 | R | 86.4 | Confident | 88.6 | Confident | 63 Ų | 63 | 45.9 Ų | 45.9 | 24% | 0.238 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -65.6 | -43.4 | 177.6 | -64.1 | -49.4 | 178.5 | 179.8 | -6.2 | 112.5 | T211 A212 I213 I217 S218 I219 I298 | T211-R215 VanDerWaalsContact O-CG 3.31Å; T211-R215 WeakPolarHBondContact O-CG 2.82Å; T211-R215 PolarHBondContact O-N 3.37Å; A212-R215 PolarHBondContact O-N 2.98Å; I213-R215 VanDerWaalsContact C-N 3.28Å; I213-R215 PolarHBondContact O-N 2.74Å; R215-I217 PolarHBondContact O-N 3.35Å; R215-S218 WeakPolarHBondContact CA-OG 3.32Å; R215-S218 PolarHBondContact O-N 2.87Å; R215-S218 PolarHBondContact O-OG 3.36Å; R215-I219 PolarHBondContact O-N 3.46Å; R215-I298 HydrophobicContact CB-CD1 3.84Å |
| 216 | Y | 86.9 | Confident | 88.4 | Confident | 77 Ų | 77 | 56 Ų | 56 | 30% | 0.302 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -57.2 | -48.8 | 176.4 | 178 | -93 | 0 | 0 | 0 | 111.7 | A212 I213 S218 I219 H220 Y297 | A212-Y216 VanDerWaalsContact O-CB 3.29Å; A212-Y216 WeakPolarHBondContact O-CB 3.32Å; A212-Y216 PolarHBondContact O-N 3.09Å; I213-Y216 WeakPolarHBondContact O-CB 2.99Å; I213-Y216 PolarHBondContact O-N 3.23Å; Y216-S218 PolarHBondContact O-N 3.4Å; Y216-I219 PolarHBondContact O-N 3.41Å; Y216-H220 HydrophobicContact CE1-CB 4.28Å; Y216-H220 VanDerWaalsContact O-CB 3.28Å; Y216-H220 WeakPolarHBondContact O-CB 3.11Å; Y216-H220 PolarHBondContact O-N 3.38Å; Y216-Y297 AromaticContact CD2-CD1 3.89Å; Y216-Y297 HydrophobicContact CD2-CD1 3.89Å; Y216-Y297 HydrophobicContact CD2-CE1 4.12Å; Y216-Y297 AromaticContact CE2-CD1 3.59Å; Y216-Y297 HydrophobicContact CE2-CD1 3.59Å; Y216-Y297 AromaticContact CE2-CE1 3.53Å; Y216-Y297 HydrophobicContact CE2-CE1 3.53Å; Y216-Y297 HydrophobicContact CE2-CG 4.47Å |
| 217 | I | 89 | Confident | 88.2 | Confident | 36 Ų | 36 | 65.2 Ų | 65.2 | 19% | 0.185 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64.1 | -42.2 | 179 | -62.2 | 168.4 | 0 | 0 | 0 | 110.6 | I213 D214 R215 I219 H220 R221 Y225 I228 V229 | I213-I217 HydrophobicContact CG2-CD1 3.64Å; I213-I217 HydrophobicContact CG2-CG1 4.26Å; I213-I217 VanDerWaalsContact O-CG1 3.31Å; I213-I217 WeakPolarHBondContact O-CG1 3.44Å; I213-I217 PolarHBondContact O-N 3.43Å; D214-I217 PolarHBondContact O-N 3.38Å; R215-I217 PolarHBondContact O-N 3.35Å; I217-I219 PolarHBondContact O-N 3.09Å; I217-H220 PolarHBondContact O-N 3.14Å; I217-R221 CarbonylContact O-C 3.55Å; I217-R221 PolarHBondContact O-N 3.18Å; I217-Y225 HydrophobicContact CG2-CD2 4.1Å; I217-I228 HydrophobicContact CD1-CG2 4.2Å; I217-I228 HydrophobicContact CG2-CB 4.32Å; I217-I228 HydrophobicContact CG2-CD1 4.05Å; I217-I228 HydrophobicContact CG2-CG2 4.08Å; I217-V229 HydrophobicContact CD1-CG2 4.24Å; I217-V229 HydrophobicContact CG2-CG2 4.27Å |
| 218 | S | 84.3 | Confident | 88.1 | Confident | 30 Ų | 30 | 68.1 Ų | 68.1 | 21% | 0.21 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -59.6 | -32.9 | -179.6 | 76.1 | 0 | 0 | 0 | 0 | 113.3 | D214 R215 Y216 P222 | D214-S218 WeakPolarHBondContact O-CB 3.17Å; D214-S218 PolarHBondContact O-N 3.33Å; R215-S218 WeakPolarHBondContact CA-OG 3.32Å; R215-S218 PolarHBondContact O-N 2.87Å; R215-S218 PolarHBondContact O-OG 3.36Å; Y216-S218 PolarHBondContact O-N 3.4Å; S218-P222 WeakPolarHBondContact O-CA 3.38Å |
| 219 | I | 82.1 | Confident | 88.1 | Confident | 63 Ų | 63 | 68.7 Ų | 68.7 | 32% | 0.323 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -93.5 | -34.5 | -178.4 | -64.8 | 174.5 | 0 | 0 | 0 | 111.7 | R215 Y216 I217 I298 K301 | R215-I219 PolarHBondContact O-N 3.46Å; Y216-I219 PolarHBondContact O-N 3.41Å; I217-I219 PolarHBondContact O-N 3.09Å; I219-I298 HydrophobicContact CD1-CB 4.28Å; I219-I298 HydrophobicContact CD1-CG1 4.09Å; I219-I298 HydrophobicContact CD1-CG2 3.37Å; I219-K301 HydrophobicContact CG2-CD 4.08Å; I219-K301 HydrophobicContact CG2-CG 4.33Å |
| 220 | H | 83.4 | Confident | 88.1 | Confident | 56 Ų | 56 | 68.7 Ų | 68.7 | 26% | 0.259 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -79 | -38 | -179.1 | -163.7 | 100.5 | 0 | 0 | 0 | 112.7 | Y216 I217 Y297 K301 | Y216-H220 HydrophobicContact CE1-CB 4.28Å; Y216-H220 VanDerWaalsContact O-CB 3.28Å; Y216-H220 WeakPolarHBondContact O-CB 3.11Å; Y216-H220 PolarHBondContact O-N 3.38Å; I217-H220 PolarHBondContact O-N 3.14Å; H220-Y297 PolarHBondContact ND1-OH 3.29Å; H220-K301 PolarHBondContact ND1-NZ 2.89Å |
| 221 | R | 85.4 | Confident | 87.9 | Confident | 153 Ų | 153 | 74.5 Ų | 74.5 | 58% | 0.577 | 34% | 0.34 | S | S | * | . | trans | -130.7 | 67 | -179.2 | -58.8 | -61.7 | -174.9 | -176.3 | -1 | 111.3 | I217 L223 A224 Y225 I228 | I217-R221 CarbonylContact O-C 3.55Å; I217-R221 PolarHBondContact O-N 3.18Å; R221-L223 VanDerWaalsContact C-N 3.32Å; R221-L223 PolarHBondContact O-N 3.42Å; R221-A224 HydrophobicContact CB-CB 4.24Å; R221-A224 PolarHBondContact O-N 2.9Å; R221-A224 VanDerWaalsContact O-N 3.16Å; R221-Y225 PolarHBondContact O-N 2.68Å; R221-I228 HydrophobicContact CB-CD1 4.42Å | ||
| 222 | P | 84.5 | Confident | 87.9 | Confident | 89 Ų | 89 | 78.9 Ų | 78.9 | 58% | 0.578 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -38.9 | -174.6 | 23.1 | -33.7 | 0 | 0 | 0 | 113.3 | S218 | S218-P222 WeakPolarHBondContact O-CA 3.38Š|
| 223 | L | 88.5 | Confident | 88.1 | Confident | 178 Ų | 178 | 84.8 Ų | 84.8 | 93% | 0.932 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.4 | -30.8 | -179.6 | -59.5 | 177.6 | 0 | 0 | 0 | 113.1 | R221 | R221-L223 VanDerWaalsContact C-N 3.32Å; R221-L223 PolarHBondContact O-N 3.42Å |
| 224 | A | 90.3 | Very high | 88.1 | Confident | 22 Ų | 22 | 82.4 Ų | 82.4 | 18% | 0.182 | 38% | 0.381 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | -8.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | R221 R226 R227 I228 | R221-A224 HydrophobicContact CB-CB 4.24Å; R221-A224 PolarHBondContact O-N 2.9Å; R221-A224 VanDerWaalsContact O-N 3.16Å; A224-R226 VanDerWaalsContact C-N 3.35Å; A224-R226 PolarHBondContact O-N 3.29Å; A224-R227 WeakPolarHBondContact O-CA 3.43Å; A224-R227 WeakPolarHBondContact O-CB 3.22Å; A224-R227 PolarHBondContact O-N 3.4Å; A224-I228 HydrophobicContact CB-CD1 3.75Å; A224-I228 HydrophobicContact CB-CG1 4.31Å; A224-I228 WeakPolarHBondContact O-CG1 3.43Å; A224-I228 PolarHBondContact O-N 3.36Å |
| 225 | Y | 89.3 | Confident | 88.2 | Confident | 48 Ų | 48 | 84.6 Ų | 84.6 | 19% | 0.188 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -51.5 | -49.8 | -175.9 | 172.6 | -102.2 | 0 | 0 | 0 | 112.5 | D214 I217 R221 R227 I228 V229 | D214-Y225 VanDerWaalsContact OD1-CE2 3.27Å; D214-Y225 WeakPolarHBondContact OD1-CE2 3.35Å; D214-Y225 PolarHBondContact OD1-OH 2.94Å; I217-Y225 HydrophobicContact CG2-CD2 4.1Å; R221-Y225 PolarHBondContact O-N 2.68Å; Y225-R227 PolarHBondContact O-N 3.35Å; Y225-I228 PolarHBondContact O-N 2.99Å; Y225-I228 VanDerWaalsContact O-N 3.11Å; Y225-V229 HydrophobicContact CD2-CB 4.32Å; Y225-V229 HydrophobicContact CD2-CG2 3.91Å; Y225-V229 HydrophobicContact CE2-CB 3.88Å; Y225-V229 HydrophobicContact CE2-CG1 4.37Å; Y225-V229 HydrophobicContact CE2-CG2 3.64Å; Y225-V229 PolarHBondContact O-N 3.26Å |
| 226 | R | 86.4 | Confident | 88.6 | Confident | 214 Ų | 214 | 86.3 Ų | 86.3 | 81% | 0.808 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -62.3 | -25.2 | -179.9 | -67.8 | -170.5 | -179.9 | -171.8 | 2.2 | 113.7 | A224 | A224-R226 VanDerWaalsContact C-N 3.35Å; A224-R226 PolarHBondContact O-N 3.29Å |
| 227 | R | 90.3 | Very high | 88.9 | Confident | 197 Ų | 197 | 84.2 Ų | 84.2 | 74% | 0.743 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -85.7 | -33.3 | 176.6 | -173.3 | -178.8 | 67.7 | 178.8 | 1.5 | 111.9 | A224 Y225 | A224-R227 WeakPolarHBondContact O-CA 3.43Å; A224-R227 WeakPolarHBondContact O-CB 3.22Å; A224-R227 PolarHBondContact O-N 3.4Å; Y225-R227 PolarHBondContact O-N 3.35Å |
| 228 | I | 90.4 | Very high | 89 | Confident | 62 Ų | 62 | 84.7 Ų | 84.7 | 32% | 0.318 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -80.3 | -53.2 | -176.6 | -64.2 | 165.6 | 0 | 0 | 0 | 110.6 | I217 R221 A224 Y225 T230 K233 | I217-I228 HydrophobicContact CD1-CG2 4.2Å; I217-I228 HydrophobicContact CG2-CB 4.32Å; I217-I228 HydrophobicContact CG2-CD1 4.05Å; I217-I228 HydrophobicContact CG2-CG2 4.08Å; R221-I228 HydrophobicContact CB-CD1 4.42Å; A224-I228 HydrophobicContact CB-CD1 3.75Å; A224-I228 HydrophobicContact CB-CG1 4.31Å; A224-I228 WeakPolarHBondContact O-CG1 3.43Å; A224-I228 PolarHBondContact O-N 3.36Å; Y225-I228 PolarHBondContact O-N 2.99Å; Y225-I228 VanDerWaalsContact O-N 3.11Å; I228-T230 PolarHBondContact O-N 3.06Å; I228-K233 WeakPolarHBondContact O-CD 3.25Å |
| 229 | V | 90.5 | Very high | 89.5 | Confident | 19 Ų | 19 | 86 Ų | 86 | 12% | 0.115 | 42% | 0.415 | C | S | . | . | S | Bend | trans | -95.2 | 89.8 | -175.2 | -174.7 | 0 | 0 | 0 | 0 | 109.2 | P152 I217 Y225 | P152-V229 HydrophobicContact CB-CG1 4.06Å; P152-V229 HydrophobicContact CG-CG1 4.01Å; I217-V229 HydrophobicContact CD1-CG2 4.24Å; I217-V229 HydrophobicContact CG2-CG2 4.27Å; Y225-V229 HydrophobicContact CD2-CB 4.32Å; Y225-V229 HydrophobicContact CD2-CG2 3.91Å; Y225-V229 HydrophobicContact CE2-CB 3.88Å; Y225-V229 HydrophobicContact CE2-CG1 4.37Å; Y225-V229 HydrophobicContact CE2-CG2 3.64Å; Y225-V229 PolarHBondContact O-N 3.26Å |
| 230 | T | 91.6 | Very high | 90.2 | Very high | 49 Ų | 49 | 86.6 Ų | 86.6 | 30% | 0.301 | 42% | 0.421 | S | S | . | . | trans | -101.6 | 160.8 | 175.7 | 67.8 | 0 | 0 | 0 | 0 | 111.1 | I228 T232 K233 A234 | I228-T230 PolarHBondContact O-N 3.06Å; T230-T232 PolarHBondContact O-N 3.33Å; T230-K233 PolarHBondContact O-N 3.27Å; T230-K233 WeakPolarHBondContact OG1-CG 3.31Å; T230-A234 WeakPolarHBondContact O-CB 3.47Å; T230-A234 PolarHBondContact O-N 3.44Å | ||
| 231 | R | 88.4 | Confident | 90.8 | Very high | 145 Ų | 145 | 84.9 Ų | 84.9 | 55% | 0.547 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -56.1 | -48.7 | 179.1 | -176.3 | 179.9 | 172.8 | -155.4 | -7.4 | 112.3 | K233 A234 V235 | R231-K233 VanDerWaalsContact C-N 3.33Å; R231-K233 PolarHBondContact O-N 3.42Å; R231-A234 PolarHBondContact O-N 2.98Å; R231-V235 WeakPolarHBondContact O-CG2 3.48Å; R231-V235 PolarHBondContact O-N 2.97Å |
| 232 | T | 90.3 | Very high | 91.3 | Very high | 100 Ų | 100 | 79.8 Ų | 79.8 | 61% | 0.613 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -60.3 | -44 | -179.5 | -46 | 0 | 0 | 0 | 0 | 111.6 | T230 V235 I236 | T230-T232 PolarHBondContact O-N 3.33Å; T232-V235 PolarHBondContact O-N 2.88Å; T232-I236 HydrophobicContact CG2-CD1 4.1Å; T232-I236 VanDerWaalsContact O-CG1 3.31Å; T232-I236 WeakPolarHBondContact O-CG1 3.34Å; T232-I236 PolarHBondContact O-N 3.42Å |
| 233 | K | 92.3 | Very high | 91.9 | Very high | 123 Ų | 123 | 79.6 Ų | 79.6 | 54% | 0.535 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -66.1 | -39.2 | 177.6 | -70.4 | -179.2 | 177.5 | -176.3 | 0 | 112.2 | I228 T230 R231 V235 I236 A237 | I228-K233 WeakPolarHBondContact O-CD 3.25Å; T230-K233 PolarHBondContact O-N 3.27Å; T230-K233 WeakPolarHBondContact OG1-CG 3.31Å; R231-K233 VanDerWaalsContact C-N 3.33Å; R231-K233 PolarHBondContact O-N 3.42Å; K233-V235 VanDerWaalsContact C-N 3.34Å; K233-I236 PolarHBondContact O-N 2.88Å; K233-A237 VanDerWaalsContact O-CB 3.26Å; K233-A237 WeakPolarHBondContact O-CB 3.39Å; K233-A237 PolarHBondContact O-N 3.4Å |
| 234 | A | 90.3 | Very high | 92.3 | Very high | 2 Ų | 2 | 74.9 Ų | 74.9 | 2% | 0.017 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -63.2 | -41.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | P152 F156 T230 R231 A237 F238 | P152-A234 HydrophobicContact CB-CB 3.85Å; F156-A234 HydrophobicContact CE1-CB 4.17Å; F156-A234 HydrophobicContact CE2-CB 4.31Å; F156-A234 HydrophobicContact CZ-CB 3.72Å; T230-A234 WeakPolarHBondContact O-CB 3.47Å; T230-A234 PolarHBondContact O-N 3.44Å; R231-A234 PolarHBondContact O-N 2.98Å; A234-A237 PolarHBondContact O-N 2.92Å; A234-F238 WeakPolarHBondContact O-CD1 3.36Å; A234-F238 PolarHBondContact O-N 3.3Å |
| 235 | V | 91.6 | Very high | 92.6 | Very high | 51 Ų | 51 | 74 Ų | 74 | 31% | 0.309 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61.8 | -50.5 | 176 | 173.9 | 0 | 0 | 0 | 0 | 111.6 | R231 T232 K233 A237 F238 C239 | R231-V235 WeakPolarHBondContact O-CG2 3.48Å; R231-V235 PolarHBondContact O-N 2.97Å; T232-V235 PolarHBondContact O-N 2.88Å; K233-V235 VanDerWaalsContact C-N 3.34Å; V235-A237 VanDerWaalsContact C-N 3.3Å; V235-A237 PolarHBondContact O-N 2.89Å; V235-F238 VanDerWaalsContact CA-CE1 3.41Å; V235-F238 HydrophobicContact CB-CE1 3.98Å; V235-F238 HydrophobicContact CB-CZ 4.48Å; V235-F238 HydrophobicContact CG1-CE1 4.1Å; V235-F238 HydrophobicContact CG1-CZ 4.09Å; V235-F238 HydrophobicContact CG2-CE1 3.87Å; V235-F238 HydrophobicContact CG2-CZ 4.47Å; V235-F238 PolarHBondContact O-N 3.39Å; V235-C239 WeakPolarHBondContact O-CB 3.41Å; V235-C239 PolarHBondContact O-N 3.44Å; V235-C239 PolarHBondContact O-SG 3.34Å |
| 236 | I | 94.5 | Very high | 92.9 | Very high | 99 Ų | 99 | 75.6 Ų | 75.6 | 51% | 0.508 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -57.5 | -46.1 | 176.3 | -66.1 | 165.3 | 0 | 0 | 0 | 110.4 | T232 K233 F238 C239 V240 | T232-I236 HydrophobicContact CG2-CD1 4.1Å; T232-I236 VanDerWaalsContact O-CG1 3.31Å; T232-I236 WeakPolarHBondContact O-CG1 3.34Å; T232-I236 PolarHBondContact O-N 3.42Å; K233-I236 PolarHBondContact O-N 2.88Å; I236-F238 PolarHBondContact O-N 2.86Å; I236-C239 PolarHBondContact O-N 3.3Å; I236-V240 HydrophobicContact CG2-CG2 4.2Å; I236-V240 WeakPolarHBondContact O-CB 3.25Å; I236-V240 VanDerWaalsContact O-CG2 3.26Å; I236-V240 WeakPolarHBondContact O-CG2 3.46Å; I236-V240 PolarHBondContact O-N 3.46Å |
| 237 | A | 92.8 | Very high | 93.3 | Very high | 33 Ų | 33 | 69 Ų | 69 | 27% | 0.273 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.7 | -46.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | F156 L210 K233 A234 V235 M241 | F156-A237 HydrophobicContact CE1-CB 4.48Å; L210-A237 HydrophobicContact CD2-CB 4.3Å; K233-A237 VanDerWaalsContact O-CB 3.26Å; K233-A237 WeakPolarHBondContact O-CB 3.39Å; K233-A237 PolarHBondContact O-N 3.4Å; A234-A237 PolarHBondContact O-N 2.92Å; V235-A237 VanDerWaalsContact C-N 3.3Å; V235-A237 PolarHBondContact O-N 2.89Å; A237-M241 WeakPolarHBondContact O-CB 3.35Å; A237-M241 PolarHBondContact O-N 3.31Å; A237-M241 VanDerWaalsContact O-N 3.07Å |
| 238 | F | 92.3 | Very high | 93.5 | Very high | 46 Ų | 46 | 62.3 Ų | 62.3 | 20% | 0.202 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -71.4 | -39.1 | 177.9 | 81.1 | -111 | 0 | 0 | 0 | 111.6 | H155 L210 A234 V235 I236 V240 M241 W242 | H155-F238 HydrophobicContact CB-CD1 4.21Å; H155-F238 HydrophobicContact CB-CE1 4.11Å; L210-F238 HydrophobicContact CD1-CB 4.32Å; A234-F238 WeakPolarHBondContact O-CD1 3.36Å; A234-F238 PolarHBondContact O-N 3.3Å; V235-F238 VanDerWaalsContact CA-CE1 3.41Å; V235-F238 HydrophobicContact CB-CE1 3.98Å; V235-F238 HydrophobicContact CB-CZ 4.48Å; V235-F238 HydrophobicContact CG1-CE1 4.1Å; V235-F238 HydrophobicContact CG1-CZ 4.09Å; V235-F238 HydrophobicContact CG2-CE1 3.87Å; V235-F238 HydrophobicContact CG2-CZ 4.47Å; V235-F238 PolarHBondContact O-N 3.39Å; I236-F238 PolarHBondContact O-N 2.86Å; F238-V240 VanDerWaalsContact C-N 3.33Å; F238-V240 PolarHBondContact O-N 2.99Å; F238-M241 PolarHBondContact O-N 3.37Å; F238-W242 VanDerWaalsContact O-CD1 3.23Å; F238-W242 PolarHBondContact O-N 3.49Å |
| 239 | C | 95.3 | Very high | 93.8 | Very high | 57 Ų | 57 | 59.5 Ų | 59.5 | 39% | 0.385 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -59.2 | -43.6 | 176.6 | -71.8 | 0 | 0 | 0 | 0 | 112.2 | V235 I236 W242 T243 | V235-C239 WeakPolarHBondContact O-CB 3.41Å; V235-C239 PolarHBondContact O-N 3.44Å; V235-C239 PolarHBondContact O-SG 3.34Å; I236-C239 PolarHBondContact O-N 3.3Å; C239-W242 PolarHBondContact O-N 3.49Å; C239-T243 PolarHBondContact O-N 3.09Å; C239-T243 PolarHBondContact O-OG1 3.45Å |
| 240 | V | 96.1 | Very high | 94 | Very high | 75 Ų | 75 | 61 Ų | 61 | 46% | 0.455 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -62.5 | -46 | 175.6 | 169.2 | 0 | 0 | 0 | 0 | 110.6 | I236 F238 W242 T243 I244 | I236-V240 HydrophobicContact CG2-CG2 4.2Å; I236-V240 WeakPolarHBondContact O-CB 3.25Å; I236-V240 VanDerWaalsContact O-CG2 3.26Å; I236-V240 WeakPolarHBondContact O-CG2 3.46Å; I236-V240 PolarHBondContact O-N 3.46Å; F238-V240 VanDerWaalsContact C-N 3.33Å; F238-V240 PolarHBondContact O-N 2.99Å; V240-W242 PolarHBondContact O-N 2.79Å; V240-T243 PolarHBondContact O-N 3.45Å; V240-I244 HydrophobicContact CG1-CD1 3.7Å; V240-I244 HydrophobicContact CG1-CG1 4.42Å; V240-I244 VanDerWaalsContact O-CG1 3.3Å; V240-I244 WeakPolarHBondContact O-CG1 3.34Å; V240-I244 PolarHBondContact O-N 2.81Å |
| 241 | M | 95.5 | Very high | 94.2 | Very high | 20 Ų | 20 | 60.7 Ų | 60.7 | 10% | 0.099 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -60.9 | -43.7 | 178.6 | 178.7 | -78.2 | -65.7 | 0 | 0 | 112.3 | A203 S207 L210 A237 F238 I244 S245 | A203-M241 HydrophobicContact CB-SD 4.09Å; A203-M241 WeakPolarHBondContact O-CE 3.36Å; S207-M241 WeakPolarHBondContact OG-CE 3.28Å; L210-M241 HydrophobicContact CD1-CB 4.03Å; L210-M241 HydrophobicContact CD1-CE 4.32Å; L210-M241 HydrophobicContact CD1-CG 4.22Å; A237-M241 WeakPolarHBondContact O-CB 3.35Å; A237-M241 PolarHBondContact O-N 3.31Å; A237-M241 VanDerWaalsContact O-N 3.07Å; F238-M241 PolarHBondContact O-N 3.37Å; M241-I244 PolarHBondContact O-N 2.94Å; M241-S245 WeakPolarHBondContact O-CB 3.46Å; M241-S245 PolarHBondContact O-N 3.36Å; M241-S245 PolarHBondContact O-OG 3.22Å |
| 242 | W | 97.1 | Very high | 94.5 | Very high | 46 Ų | 46 | 54 Ų | 54 | 17% | 0.174 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -61.3 | -44.6 | 174.7 | -88.5 | 87.2 | 0 | 0 | 0 | 112.1 | S159 V162 A163 L166 A203 F238 C239 V240 I244 S245 I246 | S159-W242 PolarHBondContact OG-NE1 3.27Å; V162-W242 HydrophobicContact CB-CZ2 4.25Å; V162-W242 HydrophobicContact CG1-CH2 3.91Å; V162-W242 HydrophobicContact CG1-CZ2 3.95Å; A163-W242 HydrophobicContact CB-CH2 3.98Å; A163-W242 HydrophobicContact CB-CZ2 3.82Å; L166-W242 HydrophobicContact CD1-CH2 4.05Å; L166-W242 HydrophobicContact CD1-CZ3 4.28Å; A203-W242 HydrophobicContact CB-CD2 4.17Å; A203-W242 HydrophobicContact CB-CE3 4.24Å; A203-W242 HydrophobicContact CB-CH2 4.34Å; A203-W242 HydrophobicContact CB-CZ2 4.28Å; A203-W242 HydrophobicContact CB-CZ3 4.32Å; F238-W242 VanDerWaalsContact O-CD1 3.23Å; F238-W242 PolarHBondContact O-N 3.49Å; C239-W242 PolarHBondContact O-N 3.49Å; V240-W242 PolarHBondContact O-N 2.79Å; W242-I244 VanDerWaalsContact C-N 3.35Å; W242-I244 PolarHBondContact O-N 2.77Å; W242-S245 PolarHBondContact O-N 2.82Å; W242-I246 HydrophobicContact CE3-CD1 4.39Å; W242-I246 WeakPolarHBondContact O-CG1 3.35Å; W242-I246 PolarHBondContact O-N 3.41Å |
| 243 | T | 96.9 | Very high | 94.6 | Very high | 85 Ų | 85 | 51.8 Ų | 51.8 | 52% | 0.521 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -60.1 | -47.1 | 178.2 | -52.7 | 0 | 0 | 0 | 0 | 110.6 | C239 V240 S245 I246 V247 | C239-T243 PolarHBondContact O-N 3.09Å; C239-T243 PolarHBondContact O-OG1 3.45Å; V240-T243 PolarHBondContact O-N 3.45Å; T243-S245 VanDerWaalsContact C-N 3.32Å; T243-S245 PolarHBondContact O-N 2.84Å; T243-I246 PolarHBondContact O-N 2.84Å; T243-V247 HydrophobicContact CG2-CG2 4.43Å; T243-V247 WeakPolarHBondContact O-CB 3.42Å; T243-V247 VanDerWaalsContact O-CG2 3.22Å; T243-V247 WeakPolarHBondContact O-CG2 3.49Å; T243-V247 PolarHBondContact O-N 2.94Å |
| 244 | I | 95.6 | Very high | 94.7 | Very high | 79 Ų | 79 | 52.4 Ų | 52.4 | 41% | 0.405 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -61 | -42.6 | 176.9 | -67.2 | 167.2 | 0 | 0 | 0 | 111 | V240 M241 W242 I246 V247 F248 | V240-I244 HydrophobicContact CG1-CD1 3.7Å; V240-I244 HydrophobicContact CG1-CG1 4.42Å; V240-I244 VanDerWaalsContact O-CG1 3.3Å; V240-I244 WeakPolarHBondContact O-CG1 3.34Å; V240-I244 PolarHBondContact O-N 2.81Å; M241-I244 PolarHBondContact O-N 2.94Å; W242-I244 VanDerWaalsContact C-N 3.35Å; W242-I244 PolarHBondContact O-N 2.77Å; I244-I246 PolarHBondContact O-N 3.47Å; I244-V247 PolarHBondContact O-N 3.21Å; I244-F248 HydrophobicContact CG2-CD2 3.81Å; I244-F248 HydrophobicContact CG2-CE1 4.44Å; I244-F248 HydrophobicContact CG2-CE2 3.42Å; I244-F248 VanDerWaalsContact CG2-CE2 3.42Å; I244-F248 HydrophobicContact CG2-CG 4.47Å; I244-F248 HydrophobicContact CG2-CZ 3.78Å; I244-F248 WeakPolarHBondContact O-CG 3.32Å; I244-F248 PolarHBondContact O-N 2.86Å |
| 245 | S | 96.4 | Very high | 94.7 | Very high | 4 Ų | 4 | 53 Ų | 53 | 3% | 0.028 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -63.4 | -43.1 | -179.3 | -57.5 | 0 | 0 | 0 | 0 | 112 | A203 M241 W242 T243 A249 | A203-S245 PolarHBondContact N-OG 3.16Å; M241-S245 WeakPolarHBondContact O-CB 3.46Å; M241-S245 PolarHBondContact O-N 3.36Å; M241-S245 PolarHBondContact O-OG 3.22Å; W242-S245 PolarHBondContact O-N 2.82Å; T243-S245 VanDerWaalsContact C-N 3.32Å; T243-S245 PolarHBondContact O-N 2.84Å; S245-A249 WeakPolarHBondContact O-CB 3.34Å; S245-A249 PolarHBondContact O-N 3.09Å; S245-A249 VanDerWaalsContact O-N 3.13Å |
| 246 | I | 96.4 | Very high | 94.8 | Very high | 82 Ų | 82 | 54.8 Ų | 54.8 | 42% | 0.421 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -67.7 | -45.2 | 176.5 | -67 | 167.1 | 0 | 0 | 0 | 110.5 | A199 W242 T243 I244 F248 A249 V250 | A199-I246 HydrophobicContact CB-CG1 4.4Å; W242-I246 HydrophobicContact CE3-CD1 4.39Å; W242-I246 WeakPolarHBondContact O-CG1 3.35Å; W242-I246 PolarHBondContact O-N 3.41Å; T243-I246 PolarHBondContact O-N 2.84Å; I244-I246 PolarHBondContact O-N 3.47Å; I246-F248 PolarHBondContact O-N 3.33Å; I246-A249 PolarHBondContact O-N 2.77Å; I246-V250 HydrophobicContact CG2-CG2 4.17Å; I246-V250 WeakPolarHBondContact O-CB 3.5Å; I246-V250 VanDerWaalsContact O-CG2 3.3Å; I246-V250 WeakPolarHBondContact O-CG2 3.26Å; I246-V250 PolarHBondContact O-N 3.33Å |
| 247 | V | 95.9 | Very high | 94.7 | Very high | 76 Ų | 76 | 50.8 Ų | 50.8 | 46% | 0.461 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -57.2 | -50.5 | 179.4 | 167.1 | 0 | 0 | 0 | 0 | 110.4 | T243 I244 A249 V250 L251 | T243-V247 HydrophobicContact CG2-CG2 4.43Å; T243-V247 WeakPolarHBondContact O-CB 3.42Å; T243-V247 VanDerWaalsContact O-CG2 3.22Å; T243-V247 WeakPolarHBondContact O-CG2 3.49Å; T243-V247 PolarHBondContact O-N 2.94Å; I244-V247 PolarHBondContact O-N 3.21Å; V247-A249 PolarHBondContact O-N 2.94Å; V247-V250 PolarHBondContact O-N 3.13Å; V247-L251 WeakPolarHBondContact O-CG 3.4Å; V247-L251 PolarHBondContact O-N 3.1Å |
| 248 | F | 93.8 | Very high | 94.6 | Very high | 56 Ų | 56 | 49.4 Ų | 49.4 | 25% | 0.246 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -62.2 | -41.2 | 179.2 | -69.1 | -17.2 | 0 | 0 | 0 | 112.8 | I244 I246 V250 L251 Y276 F279 V283 | I244-F248 HydrophobicContact CG2-CD2 3.81Å; I244-F248 HydrophobicContact CG2-CE1 4.44Å; I244-F248 HydrophobicContact CG2-CE2 3.42Å; I244-F248 VanDerWaalsContact CG2-CE2 3.42Å; I244-F248 HydrophobicContact CG2-CG 4.47Å; I244-F248 HydrophobicContact CG2-CZ 3.78Å; I244-F248 WeakPolarHBondContact O-CG 3.32Å; I244-F248 PolarHBondContact O-N 2.86Å; I246-F248 PolarHBondContact O-N 3.33Å; F248-V250 VanDerWaalsContact C-N 3.32Å; F248-V250 PolarHBondContact O-N 3.27Å; F248-L251 HydrophobicContact CD1-CD1 4.27Å; F248-L251 PolarHBondContact O-N 2.89Å; F248-Y276 WeakPolarHBondContact O-CE2 3.34Å; F248-Y276 PolarHBondContact O-OH 3.41Å; F248-F279 HydrophobicContact CD1-CE1 4.17Å; F248-F279 HydrophobicContact CD1-CZ 4.33Å; F248-F279 HydrophobicContact CD2-CE1 4.49Å; F248-F279 HydrophobicContact CE1-CE1 4.32Å; F248-F279 HydrophobicContact CE1-CZ 4.01Å; F248-F279 HydrophobicContact CE2-CZ 4.34Å; F248-F279 HydrophobicContact CG-CE1 4.27Å; F248-F279 HydrophobicContact CZ-CZ 4.02Å; F248-V283 HydrophobicContact CE2-CG1 4.48Å |
| 249 | A | 95.6 | Very high | 94.3 | Very high | 3 Ų | 3 | 54 Ų | 54 | 3% | 0.025 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -70.6 | -26 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | G195 T198 A199 S245 I246 V247 P252 | G195-A249 VanDerWaalsContact O-CB 3.3Å; G195-A249 WeakPolarHBondContact O-CB 3.32Å; T198-A249 HydrophobicContact CG2-CB 4.06Å; A199-A249 HydrophobicContact CB-CB 3.58Å; S245-A249 WeakPolarHBondContact O-CB 3.34Å; S245-A249 PolarHBondContact O-N 3.09Å; S245-A249 VanDerWaalsContact O-N 3.13Å; I246-A249 PolarHBondContact O-N 2.77Å; V247-A249 PolarHBondContact O-N 2.94Å; A249-P252 WeakPolarHBondContact O-CD 3.23Å |
| 250 | V | 95.6 | Very high | 94 | Very high | 49 Ų | 49 | 57.4 Ų | 57.4 | 30% | 0.297 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -87.9 | -10.3 | -179.1 | 172.3 | 0 | 0 | 0 | 0 | 112.2 | I246 V247 F248 L253 L254 | I246-V250 HydrophobicContact CG2-CG2 4.17Å; I246-V250 WeakPolarHBondContact O-CB 3.5Å; I246-V250 VanDerWaalsContact O-CG2 3.3Å; I246-V250 WeakPolarHBondContact O-CG2 3.26Å; I246-V250 PolarHBondContact O-N 3.33Å; V247-V250 PolarHBondContact O-N 3.13Å; F248-V250 VanDerWaalsContact C-N 3.32Å; F248-V250 PolarHBondContact O-N 3.27Å; V250-L253 HydrophobicContact CG1-CB 4.44Å; V250-L253 HydrophobicContact CG1-CD2 4.46Å; V250-L253 WeakPolarHBondContact O-CB 3.49Å; V250-L253 PolarHBondContact O-N 3.16Å; V250-L254 HydrophobicContact CG1-CD1 3.99Å; V250-L254 HydrophobicContact CG1-CD2 4.46Å; V250-L254 HydrophobicContact CG1-CG 3.87Å; V250-L254 PolarHBondContact O-N 3.33Å; V250-L254 VanDerWaalsContact O-N 3.07Å |
| 251 | L | 95.2 | Very high | 93.7 | Very high | 43 Ų | 43 | 58.3 Ų | 58.3 | 23% | 0.225 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -53.3 | -43.5 | 179.6 | -67.2 | 175.4 | 0 | 0 | 0 | 114.3 | V247 F248 L253 L254 G255 W256 Y276 | V247-L251 WeakPolarHBondContact O-CG 3.4Å; V247-L251 PolarHBondContact O-N 3.1Å; F248-L251 HydrophobicContact CD1-CD1 4.27Å; F248-L251 PolarHBondContact O-N 2.89Å; L251-L253 VanDerWaalsContact C-N 3.29Å; L251-L253 PolarHBondContact O-N 2.83Å; L251-L254 PolarHBondContact O-N 2.78Å; L251-G255 PolarHBondContact O-N 2.74Å; L251-W256 HydrophobicContact CB-CB 4.42Å; L251-W256 HydrophobicContact CB-CE3 4.39Å; L251-W256 HydrophobicContact CD1-CE3 4.06Å; L251-W256 HydrophobicContact CD1-CZ3 4.19Å; L251-W256 PolarHBondContact O-N 3.39Å; L251-Y276 HydrophobicContact CB-CD2 4.42Å; L251-Y276 HydrophobicContact CB-CE2 4.18Å |
| 252 | P | 94.5 | Very high | 93.3 | Very high | 4 Ų | 4 | 64.5 Ų | 64.5 | 3% | 0.026 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.9 | -35.5 | 177.9 | -23.9 | 36.5 | 0 | 0 | 0 | 113.1 | L191 A249 L254 G255 W256 N257 I272 Y276 | L191-P252 HydrophobicContact CD2-CB 4.09Å; A249-P252 WeakPolarHBondContact O-CD 3.23Å; P252-L254 VanDerWaalsContact C-N 3.33Å; P252-G255 PolarHBondContact O-N 3.4Å; P252-W256 WeakPolarHBondContact CA-O 3.42Å; P252-N257 PolarHBondContact O-ND2 3.16Å; P252-I272 HydrophobicContact CB-CD1 3.84Å; P252-I272 HydrophobicContact CG-CD1 3.94Å; P252-Y276 HydrophobicContact CG-CD1 3.85Å; P252-Y276 HydrophobicContact CG-CD2 3.88Å; P252-Y276 HydrophobicContact CG-CE1 3.52Å; P252-Y276 HydrophobicContact CG-CE2 3.57Å; P252-Y276 HydrophobicContact CG-CG 4Å |
| 253 | L | 93.6 | Very high | 92.9 | Very high | 55 Ų | 55 | 63.9 Ų | 63.9 | 29% | 0.288 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -68.5 | -32.2 | 176.9 | -174.1 | 67.9 | 0 | 0 | 0 | 112 | N188 L191 F192 V250 L251 G255 | N188-L253 HydrophobicContact CB-CD1 4.11Å; L191-L253 HydrophobicContact CB-CB 4.48Å; L191-L253 HydrophobicContact CB-CD1 4.03Å; F192-L253 HydrophobicContact CD2-CD2 4.29Å; V250-L253 HydrophobicContact CG1-CB 4.44Å; V250-L253 HydrophobicContact CG1-CD2 4.46Å; V250-L253 WeakPolarHBondContact O-CB 3.49Å; V250-L253 PolarHBondContact O-N 3.16Å; L251-L253 VanDerWaalsContact C-N 3.29Å; L251-L253 PolarHBondContact O-N 2.83Å; L253-G255 VanDerWaalsContact C-N 3.32Å |
| 254 | L | 93.7 | Very high | 92.5 | Very high | 136 Ų | 136 | 64.3 Ų | 64.3 | 71% | 0.712 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -79.9 | -12.5 | 177.3 | -67.1 | 173.6 | 0 | 0 | 0 | 113.8 | V250 L251 P252 | V250-L254 HydrophobicContact CG1-CD1 3.99Å; V250-L254 HydrophobicContact CG1-CD2 4.46Å; V250-L254 HydrophobicContact CG1-CG 3.87Å; V250-L254 PolarHBondContact O-N 3.33Å; V250-L254 VanDerWaalsContact O-N 3.07Å; L251-L254 PolarHBondContact O-N 2.78Å; P252-L254 VanDerWaalsContact C-N 3.33Å |
| 255 | G | 90.7 | Very high | 92.2 | Very high | 13 Ų | 13 | 61.8 Ų | 61.8 | 13% | 0.134 | 32% | 0.324 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 138.4 | -0.9 | 171 | 0 | 0 | 0 | 0 | 0 | 115.9 | L251 P252 L253 N257 | L251-G255 PolarHBondContact O-N 2.74Å; P252-G255 PolarHBondContact O-N 3.4Å; L253-G255 VanDerWaalsContact C-N 3.32Å; G255-N257 PolarHBondContact O-N 3.14Å |
| 256 | W | 93.7 | Very high | 92 | Very high | 89 Ų | 89 | 61.6 Ų | 61.6 | 34% | 0.337 | 32% | 0.323 | S | S | . | . | trans | -81.4 | 54.7 | 171.1 | -158.4 | -19.8 | 0 | 0 | 0 | 111.5 | L251 P252 L261 D273 K275 Y276 | L251-W256 HydrophobicContact CB-CB 4.42Å; L251-W256 HydrophobicContact CB-CE3 4.39Å; L251-W256 HydrophobicContact CD1-CE3 4.06Å; L251-W256 HydrophobicContact CD1-CZ3 4.19Å; L251-W256 PolarHBondContact O-N 3.39Å; P252-W256 WeakPolarHBondContact CA-O 3.42Å; W256-L261 VanDerWaalsContact CD1-CD1 3.48Å; W256-L261 HydrophobicContact CG-CD1 4.22Å; W256-D273 PolarHBondContact NE1-OD1 3.18Å; W256-K275 HydrophobicContact CZ2-CB 4.48Å; W256-Y276 HydrophobicContact CD2-CD2 4.46Å | ||
| 257 | N | 92.3 | Very high | 91.6 | Very high | 15 Ų | 15 | 59.5 Ų | 59.5 | 8% | 0.08 | 31% | 0.312 | C | S | . | . | B | Isolated β-bridge | trans | -120.4 | 152.6 | 177.4 | 63.2 | 71.5 | 0 | 0 | 0 | 110 | L191 P252 G255 K259 Q260 L261 L271 | L191-N257 HydrophobicContact CD1-CB 4.14Å; P252-N257 PolarHBondContact O-ND2 3.16Å; G255-N257 PolarHBondContact O-N 3.14Å; N257-K259 VanDerWaalsContact C-N 3.26Å; N257-K259 PolarHBondContact O-N 3.32Å; N257-K259 PolarHBondContact OD1-N 3.26Å; N257-Q260 PolarHBondContact O-N 3.45Å; N257-Q260 WeakPolarHBondContact OD1-CB 3.4Å; N257-Q260 PolarHBondContact OD1-N 3.25Å; N257-L261 PolarHBondContact O-N 3.31Å; N257-L261 VanDerWaalsContact O-N 3.13Å; N257-L271 WeakPolarHBondContact CA-O 3.2Å; N257-L271 VanDerWaalsContact CB-O 3.31Å; N257-L271 WeakPolarHBondContact CB-O 3.45Å |
| 258 | C | 89.9 | Confident | 91.3 | Very high | 4 Ų | 4 | 56.8 Ų | 56.8 | 3% | 0.027 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -66.4 | -28.9 | -171.7 | 63.2 | 0 | 0 | 0 | 0 | 113.1 | N262 S263 C265 L271 D273 | C258-N262 WeakPolarHBondContact O-CA 3.41Å; C258-N262 PolarHBondContact O-N 3.47Å; C258-S263 WeakPolarHBondContact CA-OG 3.35Å; C258-S263 PolarHBondContact O-N 3.25Å; C258-S263 VanDerWaalsContact O-N 3.16Å; C258-C265 HydrophobicContact CB-CB 3.85Å; C258-C265 WeakPolarHBondContact CB-SG 3.49Å; C258-C265 WeakPolarHBondContact SG-CB 3.15Å; C258-C265 CovalentContact SG-SG 2.04Å; C258-C265 PolarHBondContact SG-SG 3Å; C258-L271 PolarHBondContact N-O 2.84Å; C258-L271 VanDerWaalsContact N-O 3.1Å; C258-L271 VanDerWaalsContact SG-C 3.52Å; C258-L271 VanDerWaalsContact SG-CA 3.59Å; C258-D273 HydrophobicContact CB-CB 4.37Å |
| 259 | K | 87.5 | Confident | 91.2 | Very high | 143 Ų | 143 | 55.8 Ų | 55.8 | 62% | 0.622 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -68.6 | -38 | 178.5 | -173.8 | 174.7 | -178 | 173.9 | 0 | 113 | N257 N262 L271 | N257-K259 VanDerWaalsContact C-N 3.26Å; N257-K259 PolarHBondContact O-N 3.32Å; N257-K259 PolarHBondContact OD1-N 3.26Å; K259-N262 PolarHBondContact O-OD1 2.9Å; K259-L271 HydrophobicContact CB-CD2 4.21Å; K259-L271 HydrophobicContact CD-CD2 4.3Å |
| 260 | Q | 89.1 | Confident | 90.9 | Very high | 128 Ų | 128 | 56 Ų | 56 | 60% | 0.598 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -82.6 | -32.3 | -179.5 | -173.7 | 164.9 | -3.1 | 0 | 0 | 112.2 | N257 | N257-Q260 PolarHBondContact O-N 3.45Å; N257-Q260 WeakPolarHBondContact OD1-CB 3.4Å; N257-Q260 PolarHBondContact OD1-N 3.25Å |
| 261 | L | 88.9 | Confident | 90.6 | Very high | 94 Ų | 94 | 54.8 Ų | 54.8 | 49% | 0.492 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -89.3 | -6.4 | 179.5 | -70.2 | 168.6 | 0 | 0 | 0 | 113.8 | W256 N257 S263 | W256-L261 VanDerWaalsContact CD1-CD1 3.48Å; W256-L261 HydrophobicContact CG-CD1 4.22Å; N257-L261 PolarHBondContact O-N 3.31Å; N257-L261 VanDerWaalsContact O-N 3.13Å; L261-S263 PolarHBondContact O-N 2.5Å |
| 262 | N | 86.6 | Confident | 90.5 | Very high | 151 Ų | 151 | 53 Ų | 53 | 81% | 0.807 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.9 | 47.2 | -171.7 | -63.8 | -42.2 | 0 | 0 | 0 | 111.8 | C258 K259 | C258-N262 WeakPolarHBondContact O-CA 3.41Å; C258-N262 PolarHBondContact O-N 3.47Å; K259-N262 PolarHBondContact O-OD1 2.9Å |
| 263 | S | 88.6 | Confident | 90.5 | Very high | 32 Ų | 32 | 53 Ų | 53 | 22% | 0.224 | 27% | 0.273 | C | S | . | . | trans | -112.2 | 174.4 | -177.6 | 57.3 | 0 | 0 | 0 | 0 | 111.4 | C258 L261 C265 D273 | C258-S263 WeakPolarHBondContact CA-OG 3.35Å; C258-S263 PolarHBondContact O-N 3.25Å; C258-S263 VanDerWaalsContact O-N 3.16Å; L261-S263 PolarHBondContact O-N 2.5Å; S263-C265 PolarHBondContact O-N 3.25Å; S263-D273 WeakPolarHBondContact CB-OD2 3.49Å; S263-D273 PolarHBondContact OG-OD2 3.29Å | ||
| 264 | V | 88.3 | Confident | 90.5 | Very high | 95 Ų | 95 | 53 Ų | 53 | 58% | 0.576 | 27% | 0.272 | S | S | * | . | P | Polyproline II helix | trans | -69.3 | 129.2 | 177.9 | -168.8 | 0 | 0 | 0 | 0 | 109.4 | E274 | V264-E274 HydrophobicContact CB-CG 4.43Å; V264-E274 HydrophobicContact CG1-CG 4.34Å; V264-E274 WeakPolarHBondContact CG1-OE1 3.42Å; V264-E274 PolarHBondContact O-N 3.33Å |
| 265 | C | 90.6 | Very high | 90.5 | Very high | 26 Ų | 26 | 53.1 Ų | 53.1 | 18% | 0.176 | 27% | 0.267 | C | S | . | . | B | Isolated β-bridge | trans | -90.1 | 151.7 | 177.4 | -54.4 | 0 | 0 | 0 | 0 | 110.7 | C258 S263 I272 | C258-C265 HydrophobicContact CB-CB 3.85Å; C258-C265 WeakPolarHBondContact CB-SG 3.49Å; C258-C265 WeakPolarHBondContact SG-CB 3.15Å; C258-C265 CovalentContact SG-SG 2.04Å; C258-C265 PolarHBondContact SG-SG 3Å; S263-C265 PolarHBondContact O-N 3.25Å; C265-I272 CarbonylContact C-O 3.58Å; C265-I272 WeakPolarHBondContact CA-O 3.37Å |
| 266 | S | 91.6 | Very high | 90.7 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 26% | 0.263 | C | S | . | . | P | Polyproline II helix | trans | -64.2 | 141.5 | 170 | 167.7 | 0 | 0 | 0 | 0 | 112.1 | I268 F269 I272 D367 | S266-I268 VanDerWaalsContact C-N 3.29Å; S266-I268 PolarHBondContact OG-N 2.83Å; S266-F269 PolarHBondContact OG-N 3.31Å; S266-I272 PolarHBondContact N-O 3.2Å; S266-D367 VanDerWaalsContact CB-OD2 3.3Å; S266-D367 WeakPolarHBondContact CB-OD2 2.99Å; S266-D367 PolarHBondContact OG-OD2 2.99Å |
| 267 | D | 87.8 | Confident | 90.8 | Very high | 38 Ų | 38 | 49 Ų | 49 | 20% | 0.203 | 25% | 0.248 | C | C | . | . | S | Bend | trans | -79.1 | -14.7 | 174.9 | -71.6 | -26.2 | 0 | 0 | 0 | 112.3 | F109 D367 M372 K377 | F109-D267 WeakPolarHBondContact CD1-O 3.21Å; F109-D267 WeakPolarHBondContact CE1-O 3.38Å; D267-D367 WeakPolarHBondContact CB-OD1 3.47Å; D267-D367 PolarHBondContact N-OD1 3.44Å; D267-D367 VanDerWaalsContact N-OD1 3.15Å; D267-M372 HydrophobicContact CB-CB 3.79Å; D267-M372 HydrophobicContact CB-CG 3.95Å; D267-M372 PolarHBondContact OD2-N 3.15Å; D267-M372 VanDerWaalsContact OD2-N 3.08Å; D267-K377 WeakPolarHBondContact O-CE 3.35Å |
| 268 | I | 89.3 | Confident | 90.9 | Very high | 18 Ų | 18 | 53.3 Ų | 53.3 | 9% | 0.092 | 27% | 0.269 | C | S | . | . | S | Bend | trans | -95.6 | -43.3 | 177.5 | -65.3 | 176.1 | 0 | 0 | 0 | 111.8 | S266 I363 D367 M372 F380 | S266-I268 VanDerWaalsContact C-N 3.29Å; S266-I268 PolarHBondContact OG-N 2.83Å; I268-I363 HydrophobicContact CD1-CG2 3.79Å; I268-D367 HydrophobicContact CD1-CB 3.79Å; I268-D367 HydrophobicContact CG1-CB 4.28Å; I268-D367 PolarHBondContact N-OD1 3.36Å; I268-M372 HydrophobicContact CD1-CE 3.94Å; I268-M372 HydrophobicContact CG1-CE 4.47Å; I268-M372 HydrophobicContact CG1-CG 4.38Å; I268-F380 HydrophobicContact CD1-CD2 4.07Å; I268-F380 HydrophobicContact CD1-CE2 4.39Å; I268-F380 HydrophobicContact CD1-CG 4.23Å; I268-F380 HydrophobicContact CG2-CD1 3.39Å; I268-F380 HydrophobicContact CG2-CD2 4.29Å; I268-F380 HydrophobicContact CG2-CE1 3.18Å; I268-F380 HydrophobicContact CG2-CE2 4.12Å; I268-F380 HydrophobicContact CG2-CG 3.96Å; I268-F380 HydrophobicContact CG2-CZ 3.59Å |
| 269 | F | 91.1 | Very high | 91.2 | Very high | 36 Ų | 36 | 56.8 Ų | 56.8 | 16% | 0.158 | 28% | 0.283 | C | S | . | . | S | Bend | trans | -113.9 | 107.1 | -173.9 | -65.6 | -72 | 0 | 0 | 0 | 111.2 | L194 S266 L271 I272 L277 M364 F380 | L194-F269 HydrophobicContact CD1-CD1 3.99Å; L194-F269 HydrophobicContact CD1-CE1 3.97Å; L194-F269 HydrophobicContact CD2-CB 4.46Å; L194-F269 HydrophobicContact CD2-CD1 4.07Å; S266-F269 PolarHBondContact OG-N 3.31Å; F269-L271 PolarHBondContact O-N 3.04Å; F269-I272 HydrophobicContact CB-CB 3.79Å; F269-I272 HydrophobicContact CB-CG1 3.66Å; F269-I272 HydrophobicContact CB-CG2 4.47Å; F269-I272 WeakPolarHBondContact O-CB 3.48Å; F269-I272 PolarHBondContact O-N 3.32Å; F269-L277 HydrophobicContact CD2-CD1 4.23Å; F269-L277 HydrophobicContact CE2-CD1 4.29Å; F269-M364 HydrophobicContact CE2-CE 3.76Å; F269-M364 HydrophobicContact CE2-CG 4.39Å; F269-M364 HydrophobicContact CZ-CE 3.65Å; F269-F380 HydrophobicContact CE1-CE1 4.36Å; F269-F380 HydrophobicContact CE1-CZ 4.3Å; F269-F380 HydrophobicContact CE2-CZ 4.08Å; F269-F380 HydrophobicContact CZ-CE1 4.05Å; F269-F380 AromaticContact CZ-CZ 3.58Å; F269-F380 HydrophobicContact CZ-CZ 3.58Å |
| 270 | P | 89.5 | Confident | 91.6 | Very high | 6 Ų | 6 | 51 Ų | 51 | 4% | 0.039 | 26% | 0.258 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51.9 | 141.8 | 174.8 | -22.8 | 26.7 | 0 | 0 | 0 | 112.2 | M106 F109 F178 F190 I272 | M106-P270 HydrophobicContact CE-CB 3.7Å; M106-P270 HydrophobicContact CE-CG 4.45Å; M106-P270 HydrophobicContact SD-CB 3.31Å; M106-P270 WeakPolarHBondContact SD-CB 3.45Å; M106-P270 HydrophobicContact SD-CG 3.55Å; M106-P270 VanDerWaalsContact SD-CG 3.55Å; F109-P270 HydrophobicContact CB-CG 4.27Å; F109-P270 HydrophobicContact CD1-CG 3.77Å; F109-P270 HydrophobicContact CD2-CB 4.37Å; F109-P270 HydrophobicContact CD2-CG 3.7Å; F109-P270 HydrophobicContact CE1-CG 3.93Å; F109-P270 HydrophobicContact CE2-CB 4.12Å; F109-P270 HydrophobicContact CE2-CG 3.88Å; F109-P270 HydrophobicContact CG-CG 3.65Å; F109-P270 HydrophobicContact CZ-CB 4.21Å; F109-P270 HydrophobicContact CZ-CG 4Å; F178-P270 HydrophobicContact CZ-CG 4.28Å; F190-P270 HydrophobicContact CE1-CB 4.02Å; F190-P270 HydrophobicContact CE1-CG 4.3Å; F190-P270 WeakPolarHBondContact CE1-O 3.32Å; F190-P270 HydrophobicContact CE2-CG 4.41Å; F190-P270 HydrophobicContact CZ-CB 4.1Å; F190-P270 HydrophobicContact CZ-CG 3.88Å; P270-I272 PolarHBondContact O-N 3.4Å |
| 271 | L | 90.4 | Very high | 91.9 | Very high | 25 Ų | 25 | 45.3 Ų | 45.3 | 13% | 0.131 | 23% | 0.231 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 65.7 | -6.1 | 177.3 | -57.5 | 153.3 | 0 | 0 | 0 | 115.8 | M106 P187 F190 L191 N257 C258 K259 F269 | M106-L271 HydrophobicContact CE-CD1 3.41Å; M106-L271 VanDerWaalsContact CE-CD1 3.41Å; M106-L271 HydrophobicContact CE-CG 4.2Å; P187-L271 HydrophobicContact CB-CD1 3.67Å; P187-L271 HydrophobicContact CB-CD2 4.14Å; P187-L271 HydrophobicContact CG-CD1 4.31Å; P187-L271 HydrophobicContact CG-CD2 4.46Å; F190-L271 HydrophobicContact CD1-CD1 4.04Å; L191-L271 HydrophobicContact CD2-CB 4.09Å; L191-L271 HydrophobicContact CG-CB 4.46Å; L191-L271 HydrophobicContact CG-CD1 4.46Å; N257-L271 WeakPolarHBondContact CA-O 3.2Å; N257-L271 VanDerWaalsContact CB-O 3.31Å; N257-L271 WeakPolarHBondContact CB-O 3.45Å; C258-L271 PolarHBondContact N-O 2.84Å; C258-L271 VanDerWaalsContact N-O 3.1Å; C258-L271 VanDerWaalsContact SG-C 3.52Å; C258-L271 VanDerWaalsContact SG-CA 3.59Å; K259-L271 HydrophobicContact CB-CD2 4.21Å; K259-L271 HydrophobicContact CD-CD2 4.3Å; F269-L271 PolarHBondContact O-N 3.04Å |
| 272 | I | 93.7 | Very high | 92.2 | Very high | 6 Ų | 6 | 42.4 Ų | 42.4 | 3% | 0.031 | 22% | 0.224 | C | C | . | . | B | Isolated β-bridge | trans | -83.6 | 130.3 | 179.1 | -65.8 | -58.8 | 0 | 0 | 0 | 110.3 | L191 L194 P252 C265 S266 F269 P270 Y276 L277 | L191-I272 HydrophobicContact CD2-CD1 3.7Å; L194-I272 HydrophobicContact CD2-CD1 3.85Å; L194-I272 HydrophobicContact CD2-CG1 3.67Å; P252-I272 HydrophobicContact CB-CD1 3.84Å; P252-I272 HydrophobicContact CG-CD1 3.94Å; C265-I272 CarbonylContact C-O 3.58Å; C265-I272 WeakPolarHBondContact CA-O 3.37Å; S266-I272 PolarHBondContact N-O 3.2Å; F269-I272 HydrophobicContact CB-CB 3.79Å; F269-I272 HydrophobicContact CB-CG1 3.66Å; F269-I272 HydrophobicContact CB-CG2 4.47Å; F269-I272 WeakPolarHBondContact O-CB 3.48Å; F269-I272 PolarHBondContact O-N 3.32Å; P270-I272 PolarHBondContact O-N 3.4Å; I272-Y276 HydrophobicContact CD1-CD1 4.42Å; I272-Y276 HydrophobicContact CD1-CE1 4.33Å; I272-Y276 HydrophobicContact CG2-CD1 3.75Å; I272-Y276 HydrophobicContact CG2-CE1 4.36Å; I272-L277 HydrophobicContact CG2-CB 4.12Å |
| 273 | D | 93.9 | Very high | 92.6 | Very high | 3 Ų | 3 | 37.3 Ų | 37.3 | 2% | 0.016 | 20% | 0.198 | C | C | . | . | B | Isolated β-bridge | trans | -74.8 | 136.5 | 172.7 | 172.3 | -103.3 | 0 | 0 | 0 | 111.1 | W256 C258 S263 K275 Y276 L277 | W256-D273 PolarHBondContact NE1-OD1 3.18Å; C258-D273 HydrophobicContact CB-CB 4.37Å; S263-D273 WeakPolarHBondContact CB-OD2 3.49Å; S263-D273 PolarHBondContact OG-OD2 3.29Å; D273-K275 PolarHBondContact O-N 3.1Å; D273-K275 WeakPolarHBondContact OD1-CA 3.11Å; D273-K275 WeakPolarHBondContact OD1-CB 3.5Å; D273-K275 PolarHBondContact OD1-N 3.46Å; D273-Y276 WeakPolarHBondContact O-CB 3.37Å; D273-Y276 PolarHBondContact O-N 3.46Å; D273-Y276 PolarHBondContact OD1-N 2.95Å; D273-Y276 VanDerWaalsContact OD1-N 3.08Å; D273-L277 PolarHBondContact O-N 3.03Å |
| 274 | E | 92.9 | Very high | 92.8 | Very high | 55 Ų | 55 | 35.9 Ų | 35.9 | 26% | 0.257 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -59.4 | -33.2 | 179.8 | -71.2 | -180 | 170.4 | 0 | 0 | 113 | V264 L277 M278 L368 | V264-E274 HydrophobicContact CB-CG 4.43Å; V264-E274 HydrophobicContact CG1-CG 4.34Å; V264-E274 WeakPolarHBondContact CG1-OE1 3.42Å; V264-E274 PolarHBondContact O-N 3.33Å; E274-L277 PolarHBondContact O-N 3.34Å; E274-M278 WeakPolarHBondContact O-CB 3.37Å; E274-M278 PolarHBondContact O-N 3.31Å; E274-L368 HydrophobicContact CB-CD2 4.16Å; E274-L368 WeakPolarHBondContact O-CD2 2.98Å |
| 275 | K | 94.4 | Very high | 93 | Very high | 139 Ų | 139 | 32.5 Ų | 32.5 | 60% | 0.604 | 17% | 0.169 | S | C | * | . | H | α-helix | trans | -72.3 | -37 | -179.9 | -49.4 | 172.4 | -179 | 167.4 | 0 | 111.1 | W256 D273 F279 | W256-K275 HydrophobicContact CZ2-CB 4.48Å; D273-K275 PolarHBondContact O-N 3.1Å; D273-K275 WeakPolarHBondContact OD1-CA 3.11Å; D273-K275 WeakPolarHBondContact OD1-CB 3.5Å; D273-K275 PolarHBondContact OD1-N 3.46Å; K275-F279 WeakPolarHBondContact O-CB 3.48Å; K275-F279 PolarHBondContact O-N 2.95Å |
| 276 | Y | 95.3 | Very high | 93.2 | Very high | 11 Ų | 11 | 36.2 Ų | 36.2 | 4% | 0.043 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.2 | -46 | 169.7 | 168.2 | -93.8 | 0 | 0 | 0 | 110.9 | F248 L251 P252 W256 I272 D273 M278 F279 W280 | F248-Y276 WeakPolarHBondContact O-CE2 3.34Å; F248-Y276 PolarHBondContact O-OH 3.41Å; L251-Y276 HydrophobicContact CB-CD2 4.42Å; L251-Y276 HydrophobicContact CB-CE2 4.18Å; P252-Y276 HydrophobicContact CG-CD1 3.85Å; P252-Y276 HydrophobicContact CG-CD2 3.88Å; P252-Y276 HydrophobicContact CG-CE1 3.52Å; P252-Y276 HydrophobicContact CG-CE2 3.57Å; P252-Y276 HydrophobicContact CG-CG 4Å; W256-Y276 HydrophobicContact CD2-CD2 4.46Å; I272-Y276 HydrophobicContact CD1-CD1 4.42Å; I272-Y276 HydrophobicContact CD1-CE1 4.33Å; I272-Y276 HydrophobicContact CG2-CD1 3.75Å; I272-Y276 HydrophobicContact CG2-CE1 4.36Å; D273-Y276 WeakPolarHBondContact O-CB 3.37Å; D273-Y276 PolarHBondContact O-N 3.46Å; D273-Y276 PolarHBondContact OD1-N 2.95Å; D273-Y276 VanDerWaalsContact OD1-N 3.08Å; Y276-M278 PolarHBondContact O-N 3.07Å; Y276-F279 WeakPolarHBondContact O-CB 3.48Å; Y276-F279 PolarHBondContact O-N 2.95Å; Y276-W280 PolarHBondContact O-N 3.08Å |
| 277 | L | 94.9 | Very high | 93.2 | Very high | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.026 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.4 | -45.4 | 179 | -177.8 | 60.1 | 0 | 0 | 0 | 111.1 | F269 I272 D273 E274 F279 W280 I281 D367 L368 | F269-L277 HydrophobicContact CD2-CD1 4.23Å; F269-L277 HydrophobicContact CE2-CD1 4.29Å; I272-L277 HydrophobicContact CG2-CB 4.12Å; D273-L277 PolarHBondContact O-N 3.03Å; E274-L277 PolarHBondContact O-N 3.34Å; L277-F279 PolarHBondContact O-N 3Å; L277-W280 PolarHBondContact O-N 3.1Å; L277-I281 HydrophobicContact CD1-CD1 3.94Å; L277-I281 HydrophobicContact CD1-CG1 4.24Å; L277-I281 HydrophobicContact CG-CD1 3.73Å; L277-I281 HydrophobicContact CG-CG1 4.47Å; L277-I281 WeakPolarHBondContact O-CB 3.48Å; L277-I281 WeakPolarHBondContact O-CD1 3.26Å; L277-I281 VanDerWaalsContact O-CG1 3.22Å; L277-I281 WeakPolarHBondContact O-CG1 3.3Å; L277-I281 PolarHBondContact O-N 3.17Å; L277-D367 WeakPolarHBondContact CD2-OD2 3.49Å; L277-L368 HydrophobicContact CB-CD2 4.15Å; L277-L368 HydrophobicContact CD2-CD2 3.99Å; L277-L368 HydrophobicContact CG-CD2 4.08Å |
| 278 | M | 95.4 | Very high | 93.4 | Very high | 105 Ų | 105 | 36.7 Ų | 36.7 | 52% | 0.517 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -58.5 | -45.4 | 173.9 | -175.1 | -172 | -63.7 | 0 | 0 | 112.5 | E274 Y276 G282 L368 | E274-M278 WeakPolarHBondContact O-CB 3.37Å; E274-M278 PolarHBondContact O-N 3.31Å; Y276-M278 PolarHBondContact O-N 3.07Å; M278-G282 PolarHBondContact O-N 3.09Å; M278-L368 HydrophobicContact CB-CD1 3.79Å; M278-L368 HydrophobicContact CB-CD2 4.24Å; M278-L368 HydrophobicContact CE-CD1 4.49Å; M278-L368 HydrophobicContact CG-CD1 4.05Å |
| 279 | F | 95.8 | Very high | 93.6 | Very high | 76 Ų | 76 | 42.7 Ų | 42.7 | 33% | 0.333 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -59.2 | -48.7 | 176.1 | 169 | -101.4 | 0 | 0 | 0 | 111.4 | F248 K275 Y276 L277 G282 V283 | F248-F279 HydrophobicContact CD1-CE1 4.17Å; F248-F279 HydrophobicContact CD1-CZ 4.33Å; F248-F279 HydrophobicContact CD2-CE1 4.49Å; F248-F279 HydrophobicContact CE1-CE1 4.32Å; F248-F279 HydrophobicContact CE1-CZ 4.01Å; F248-F279 HydrophobicContact CE2-CZ 4.34Å; F248-F279 HydrophobicContact CG-CE1 4.27Å; F248-F279 HydrophobicContact CZ-CZ 4.02Å; K275-F279 WeakPolarHBondContact O-CB 3.48Å; K275-F279 PolarHBondContact O-N 2.95Å; Y276-F279 WeakPolarHBondContact O-CB 3.48Å; Y276-F279 PolarHBondContact O-N 2.95Å; L277-F279 PolarHBondContact O-N 3Å; F279-G282 PolarHBondContact O-N 3.38Å; F279-V283 HydrophobicContact CD2-CG2 4.32Å; F279-V283 HydrophobicContact CE1-CG2 4.37Å; F279-V283 HydrophobicContact CE2-CG2 3.88Å; F279-V283 HydrophobicContact CZ-CG2 3.91Å; F279-V283 WeakPolarHBondContact O-CG2 3.3Å; F279-V283 PolarHBondContact O-N 2.68Å |
| 280 | W | 95.4 | Very high | 93.7 | Very high | 22 Ų | 22 | 44.9 Ų | 44.9 | 8% | 0.083 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -65.5 | -42.9 | -179 | -178.1 | 84.8 | 0 | 0 | 0 | 112.5 | T198 T202 Y276 L277 G282 V283 T284 W357 M364 | T198-W280 HydrophobicContact CG2-CZ2 4.41Å; T198-W280 VanDerWaalsContact CG2-NE1 3.33Å; T202-W280 PolarHBondContact OG1-NE1 3.47Å; T202-W280 VanDerWaalsContact OG1-NE1 3.08Å; Y276-W280 PolarHBondContact O-N 3.08Å; L277-W280 PolarHBondContact O-N 3.1Å; W280-G282 VanDerWaalsContact C-N 3.33Å; W280-G282 PolarHBondContact O-N 3.19Å; W280-V283 PolarHBondContact O-N 3.01Å; W280-T284 WeakPolarHBondContact O-CB 3.33Å; W280-T284 PolarHBondContact O-N 3.5Å; W280-T284 PolarHBondContact O-OG1 3.23Å; W280-W357 HydrophobicContact CH2-CZ3 4.15Å; W280-M364 HydrophobicContact CH2-CE 4.42Å; W280-M364 HydrophobicContact CH2-SD 4.43Å; W280-M364 HydrophobicContact CZ3-CE 4.06Å; W280-M364 HydrophobicContact CZ3-SD 3.65Å |
| 281 | I | 94.9 | Very high | 93.8 | Very high | 8 Ų | 8 | 44.7 Ų | 44.7 | 4% | 0.041 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.8 | -44.5 | 174.6 | -69.8 | 162.6 | 0 | 0 | 0 | 110.3 | L277 T284 S285 M364 V365 L368 | L277-I281 HydrophobicContact CD1-CD1 3.94Å; L277-I281 HydrophobicContact CD1-CG1 4.24Å; L277-I281 HydrophobicContact CG-CD1 3.73Å; L277-I281 HydrophobicContact CG-CG1 4.47Å; L277-I281 WeakPolarHBondContact O-CB 3.48Å; L277-I281 WeakPolarHBondContact O-CD1 3.26Å; L277-I281 VanDerWaalsContact O-CG1 3.22Å; L277-I281 WeakPolarHBondContact O-CG1 3.3Å; L277-I281 PolarHBondContact O-N 3.17Å; I281-T284 PolarHBondContact O-N 3.36Å; I281-S285 WeakPolarHBondContact O-CB 3.3Å; I281-S285 PolarHBondContact O-N 3.5Å; I281-S285 PolarHBondContact O-OG 3.26Å; I281-M364 HydrophobicContact CD1-CB 3.68Å; I281-M364 WeakPolarHBondContact CD1-O 3.21Å; I281-M364 HydrophobicContact CG1-CB 4.14Å; I281-V365 HydrophobicContact CG2-CG2 3.73Å; I281-L368 HydrophobicContact CD1-CD1 3.83Å; I281-L368 HydrophobicContact CD1-CG 4.3Å |
| 282 | G | 95.6 | Very high | 93.8 | Very high | 34 Ų | 34 | 45.4 Ų | 45.4 | 35% | 0.351 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -60 | -50.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112 | M278 F279 W280 T284 S285 V286 | M278-G282 PolarHBondContact O-N 3.09Å; F279-G282 PolarHBondContact O-N 3.38Å; W280-G282 VanDerWaalsContact C-N 3.33Å; W280-G282 PolarHBondContact O-N 3.19Å; G282-T284 PolarHBondContact O-N 2.87Å; G282-S285 PolarHBondContact O-N 3.26Å; G282-V286 VanDerWaalsContact O-CG2 3.29Å; G282-V286 WeakPolarHBondContact O-CG2 3.34Å; G282-V286 PolarHBondContact O-N 3.32Å |
| 283 | V | 94.1 | Very high | 93.7 | Very high | 43 Ų | 43 | 52 Ų | 52 | 26% | 0.261 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -59.7 | -47.8 | 177.2 | 172.1 | 0 | 0 | 0 | 0 | 111.1 | F248 F279 W280 S285 V286 L287 | F248-V283 HydrophobicContact CE2-CG1 4.48Å; F279-V283 HydrophobicContact CD2-CG2 4.32Å; F279-V283 HydrophobicContact CE1-CG2 4.37Å; F279-V283 HydrophobicContact CE2-CG2 3.88Å; F279-V283 HydrophobicContact CZ-CG2 3.91Å; F279-V283 WeakPolarHBondContact O-CG2 3.3Å; F279-V283 PolarHBondContact O-N 2.68Å; W280-V283 PolarHBondContact O-N 3.01Å; V283-S285 PolarHBondContact O-N 3.14Å; V283-V286 PolarHBondContact O-N 3.47Å; V283-L287 HydrophobicContact CG1-CD1 4.26Å; V283-L287 WeakPolarHBondContact O-CG 3.18Å; V283-L287 PolarHBondContact O-N 2.87Å; V283-L287 VanDerWaalsContact O-N 3.1Å |
| 284 | T | 92.8 | Very high | 93.5 | Very high | 3 Ų | 3 | 51.9 Ų | 51.9 | 2% | 0.018 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.1 | -43.5 | -178.9 | -58.1 | 0 | 0 | 0 | 0 | 111.5 | W280 I281 G282 L287 V288 W357 L361 | W280-T284 WeakPolarHBondContact O-CB 3.33Å; W280-T284 PolarHBondContact O-N 3.5Å; W280-T284 PolarHBondContact O-OG1 3.23Å; I281-T284 PolarHBondContact O-N 3.36Å; G282-T284 PolarHBondContact O-N 2.87Å; T284-L287 PolarHBondContact O-N 2.88Å; T284-V288 HydrophobicContact CG2-CG2 4.43Å; T284-V288 WeakPolarHBondContact O-CG2 3.24Å; T284-V288 PolarHBondContact O-N 3.4Å; T284-W357 HydrophobicContact CG2-CE3 4.08Å; T284-W357 HydrophobicContact CG2-CH2 4.3Å; T284-W357 HydrophobicContact CG2-CZ3 3.72Å; T284-L361 HydrophobicContact CG2-CD2 4.28Å |
| 285 | S | 93.5 | Very high | 93.3 | Very high | 24 Ų | 24 | 49.4 Ų | 49.4 | 17% | 0.168 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.8 | -45.2 | 178.3 | -61.1 | 0 | 0 | 0 | 0 | 111.4 | I281 G282 V283 L287 V288 F289 | I281-S285 WeakPolarHBondContact O-CB 3.3Å; I281-S285 PolarHBondContact O-N 3.5Å; I281-S285 PolarHBondContact O-OG 3.26Å; G282-S285 PolarHBondContact O-N 3.26Å; V283-S285 PolarHBondContact O-N 3.14Å; S285-L287 VanDerWaalsContact C-N 3.3Å; S285-L287 PolarHBondContact O-N 3.49Å; S285-V288 PolarHBondContact O-N 2.9Å; S285-F289 WeakPolarHBondContact O-CB 3.47Å; S285-F289 WeakPolarHBondContact O-CD2 3.35Å; S285-F289 PolarHBondContact O-N 2.87Å |
| 286 | V | 94.8 | Very high | 93 | Very high | 103 Ų | 103 | 47.2 Ų | 47.2 | 62% | 0.624 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -58.1 | -43.8 | 176.2 | 168.5 | 0 | 0 | 0 | 0 | 111.2 | G282 V283 F290 | G282-V286 VanDerWaalsContact O-CG2 3.29Å; G282-V286 WeakPolarHBondContact O-CG2 3.34Å; G282-V286 PolarHBondContact O-N 3.32Å; V283-V286 PolarHBondContact O-N 3.47Å; V286-F290 WeakPolarHBondContact O-CB 3.45Å; V286-F290 PolarHBondContact O-N 3.32Å |
| 287 | L | 92.5 | Very high | 92.7 | Very high | 38 Ų | 38 | 48.9 Ų | 48.9 | 20% | 0.199 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63.8 | -46.2 | 176.5 | -69 | 173.6 | 0 | 0 | 0 | 111.9 | V205 F209 V283 T284 S285 F290 I291 | V205-L287 HydrophobicContact CG1-CB 3.94Å; V205-L287 HydrophobicContact CG1-CD1 4.29Å; F209-L287 HydrophobicContact CB-CD2 4.44Å; F209-L287 HydrophobicContact CD1-CD2 4.25Å; F209-L287 HydrophobicContact CD2-CD2 3.86Å; F209-L287 HydrophobicContact CE1-CD2 4.44Å; F209-L287 HydrophobicContact CE2-CD2 4.05Å; F209-L287 HydrophobicContact CG-CD2 3.95Å; F209-L287 HydrophobicContact CZ-CD2 4.34Å; V283-L287 HydrophobicContact CG1-CD1 4.26Å; V283-L287 WeakPolarHBondContact O-CG 3.18Å; V283-L287 PolarHBondContact O-N 2.87Å; V283-L287 VanDerWaalsContact O-N 3.1Å; T284-L287 PolarHBondContact O-N 2.88Å; S285-L287 VanDerWaalsContact C-N 3.3Å; S285-L287 PolarHBondContact O-N 3.49Å; L287-F290 PolarHBondContact O-N 3.14Å; L287-I291 VanDerWaalsContact O-CG1 3.23Å; L287-I291 WeakPolarHBondContact O-CG1 3.42Å; L287-I291 PolarHBondContact O-N 2.94Å |
| 288 | V | 92.1 | Very high | 92.3 | Very high | 11 Ų | 11 | 48.7 Ų | 48.7 | 7% | 0.067 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.9 | -46.4 | 179 | 170.2 | 0 | 0 | 0 | 0 | 111.1 | V205 T284 S285 F290 I291 I292 L353 W357 | V205-V288 HydrophobicContact CG1-CG2 4.27Å; T284-V288 HydrophobicContact CG2-CG2 4.43Å; T284-V288 WeakPolarHBondContact O-CG2 3.24Å; T284-V288 PolarHBondContact O-N 3.4Å; S285-V288 PolarHBondContact O-N 2.9Å; V288-F290 VanDerWaalsContact C-N 3.32Å; V288-F290 PolarHBondContact O-N 2.91Å; V288-I291 WeakPolarHBondContact O-CB 3.32Å; V288-I291 PolarHBondContact O-N 3.32Å; V288-I291 VanDerWaalsContact O-N 3.17Å; V288-I292 HydrophobicContact CG1-CD1 3.87Å; V288-I292 HydrophobicContact CG1-CG1 4.49Å; V288-I292 VanDerWaalsContact O-CG1 3.31Å; V288-I292 WeakPolarHBondContact O-CG1 3.39Å; V288-I292 PolarHBondContact O-N 3.32Å; V288-L353 HydrophobicContact CG1-CD2 4.1Å; V288-L353 HydrophobicContact CG1-CG 4.33Å; V288-W357 HydrophobicContact CG2-CG 4.46Å |
| 289 | F | 92.7 | Very high | 91.8 | Very high | 144 Ų | 144 | 45.1 Ų | 45.1 | 63% | 0.632 | 23% | 0.226 | S | C | * | . | H | α-helix | trans | -61.2 | -40.2 | 175.8 | -79.9 | -62 | 0 | 0 | 0 | 112.2 | S285 I292 Y293 | S285-F289 WeakPolarHBondContact O-CB 3.47Å; S285-F289 WeakPolarHBondContact O-CD2 3.35Å; S285-F289 PolarHBondContact O-N 2.87Å; F289-I292 PolarHBondContact O-N 2.94Å; F289-Y293 WeakPolarHBondContact O-CB 3.15Å; F289-Y293 PolarHBondContact O-N 3Å |
| 290 | F | 92.1 | Very high | 91.3 | Very high | 82 Ų | 82 | 49.2 Ų | 49.2 | 36% | 0.36 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -63 | -43.1 | 174.4 | -177.2 | -82.5 | 0 | 0 | 0 | 111.8 | F209 I213 V286 L287 V288 I292 Y293 A294 | F209-F290 HydrophobicContact CD2-CB 4.5Å; F209-F290 AromaticContact CD2-CD1 3.46Å; F209-F290 HydrophobicContact CD2-CD1 3.46Å; F209-F290 VanDerWaalsContact CD2-CD1 3.46Å; F209-F290 AromaticContact CD2-CE1 3.92Å; F209-F290 HydrophobicContact CD2-CE1 3.92Å; F209-F290 HydrophobicContact CD2-CG 4.19Å; F209-F290 HydrophobicContact CE2-CB 4.25Å; F209-F290 AromaticContact CE2-CD1 3.16Å; F209-F290 HydrophobicContact CE2-CD1 3.16Å; F209-F290 HydrophobicContact CE2-CD2 4.34Å; F209-F290 AromaticContact CE2-CE1 3.41Å; F209-F290 HydrophobicContact CE2-CE1 3.41Å; F209-F290 VanDerWaalsContact CE2-CE1 3.41Å; F209-F290 AromaticContact CE2-CG 3.67Å; F209-F290 HydrophobicContact CE2-CG 3.67Å; F209-F290 HydrophobicContact CE2-CZ 4.11Å; F209-F290 HydrophobicContact CZ-CD1 4.33Å; F209-F290 HydrophobicContact CZ-CE1 4.25Å; I213-F290 HydrophobicContact CG1-CE1 4.15Å; V286-F290 WeakPolarHBondContact O-CB 3.45Å; V286-F290 PolarHBondContact O-N 3.32Å; L287-F290 PolarHBondContact O-N 3.14Å; V288-F290 VanDerWaalsContact C-N 3.32Å; V288-F290 PolarHBondContact O-N 2.91Å; F290-I292 VanDerWaalsContact C-N 3.34Å; F290-I292 PolarHBondContact O-N 3.48Å; F290-Y293 PolarHBondContact O-N 3.13Å; F290-A294 HydrophobicContact CD1-CB 4.45Å; F290-A294 HydrophobicContact CE1-CB 4.26Å; F290-A294 VanDerWaalsContact O-CB 3.29Å; F290-A294 WeakPolarHBondContact O-CB 3.39Å; F290-A294 PolarHBondContact O-N 3.46Å |
| 291 | I | 91.7 | Very high | 90.8 | Very high | 2 Ų | 2 | 51 Ų | 51 | 1% | 0.01 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -60.3 | -46.5 | 177 | -69.1 | 162.5 | 0 | 0 | 0 | 110.2 | V205 L208 F209 A212 L287 V288 A294 Y295 L353 | V205-I291 HydrophobicContact CG1-CD1 4.24Å; L208-I291 HydrophobicContact CB-CD1 4.02Å; F209-I291 HydrophobicContact CB-CD1 4.04Å; F209-I291 HydrophobicContact CB-CG1 4.11Å; F209-I291 HydrophobicContact CD2-CG1 4.39Å; A212-I291 HydrophobicContact CB-CG1 4.38Å; L287-I291 VanDerWaalsContact O-CG1 3.23Å; L287-I291 WeakPolarHBondContact O-CG1 3.42Å; L287-I291 PolarHBondContact O-N 2.94Å; V288-I291 WeakPolarHBondContact O-CB 3.32Å; V288-I291 PolarHBondContact O-N 3.32Å; V288-I291 VanDerWaalsContact O-N 3.17Å; I291-A294 PolarHBondContact O-N 2.94Å; I291-Y295 HydrophobicContact CG2-CD2 3.55Å; I291-Y295 HydrophobicContact CG2-CE2 3.46Å; I291-Y295 VanDerWaalsContact CG2-CE2 3.46Å; I291-Y295 VanDerWaalsContact O-CD2 3.28Å; I291-Y295 WeakPolarHBondContact O-CD2 3.23Å; I291-Y295 PolarHBondContact O-N 3.03Å; I291-L353 HydrophobicContact CB-CD2 4.19Å; I291-L353 HydrophobicContact CG2-CD2 3.69Å |
| 292 | I | 91.5 | Very high | 90.1 | Very high | 40 Ų | 40 | 52.1 Ų | 52.1 | 21% | 0.205 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -57.5 | -52.2 | 175.9 | -70 | 168.3 | 0 | 0 | 0 | 110.1 | V288 F289 F290 A294 Y295 M296 L350 L353 V354 | V288-I292 HydrophobicContact CG1-CD1 3.87Å; V288-I292 HydrophobicContact CG1-CG1 4.49Å; V288-I292 VanDerWaalsContact O-CG1 3.31Å; V288-I292 WeakPolarHBondContact O-CG1 3.39Å; V288-I292 PolarHBondContact O-N 3.32Å; F289-I292 PolarHBondContact O-N 2.94Å; F290-I292 VanDerWaalsContact C-N 3.34Å; F290-I292 PolarHBondContact O-N 3.48Å; I292-A294 PolarHBondContact O-N 3.41Å; I292-Y295 PolarHBondContact O-N 3.48Å; I292-M296 HydrophobicContact CG2-CG 4.32Å; I292-M296 WeakPolarHBondContact O-CB 3.23Å; I292-M296 VanDerWaalsContact O-CG 3.26Å; I292-M296 WeakPolarHBondContact O-CG 3.26Å; I292-M296 PolarHBondContact O-N 3.14Å; I292-L350 HydrophobicContact CB-CD1 3.94Å; I292-L350 HydrophobicContact CG1-CD1 3.68Å; I292-L350 HydrophobicContact CG2-CD1 3.91Å; I292-L353 HydrophobicContact CG1-CD2 4.05Å; I292-V354 HydrophobicContact CD1-CG2 4.15Å |
| 293 | Y | 91.6 | Very high | 89.4 | Confident | 143 Ų | 143 | 55.4 Ų | 55.4 | 56% | 0.561 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -57.4 | -47.8 | 178.2 | 170.3 | -97 | 0 | 0 | 0 | 111.9 | F289 F290 Y295 M296 Y297 | F289-Y293 WeakPolarHBondContact O-CB 3.15Å; F289-Y293 PolarHBondContact O-N 3Å; F290-Y293 PolarHBondContact O-N 3.13Å; Y293-Y295 PolarHBondContact O-N 3.02Å; Y293-M296 PolarHBondContact O-N 3.21Å; Y293-Y297 VanDerWaalsContact O-CB 3.29Å; Y293-Y297 WeakPolarHBondContact O-CB 3.3Å; Y293-Y297 PolarHBondContact O-N 3.39Å |
| 294 | A | 89.6 | Confident | 88.8 | Confident | 2 Ų | 2 | 56.8 Ų | 56.8 | 2% | 0.017 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61 | -44.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | A212 F290 I291 I292 Y297 I298 | A212-A294 HydrophobicContact CB-CB 4.24Å; F290-A294 HydrophobicContact CD1-CB 4.45Å; F290-A294 HydrophobicContact CE1-CB 4.26Å; F290-A294 VanDerWaalsContact O-CB 3.29Å; F290-A294 WeakPolarHBondContact O-CB 3.39Å; F290-A294 PolarHBondContact O-N 3.46Å; I291-A294 PolarHBondContact O-N 2.94Å; I292-A294 PolarHBondContact O-N 3.41Å; A294-Y297 PolarHBondContact O-N 3.48Å; A294-I298 WeakPolarHBondContact O-CB 3.36Å; A294-I298 WeakPolarHBondContact O-CD1 3.33Å; A294-I298 WeakPolarHBondContact O-CG1 3.33Å; A294-I298 PolarHBondContact O-N 2.9Å |
| 295 | Y | 88.4 | Confident | 88.1 | Confident | 3 Ų | 3 | 61 Ų | 61 | 1% | 0.012 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -69.9 | -39.5 | 177.7 | -76.7 | -51.8 | 0 | 0 | 0 | 113.2 | A212 I291 I292 Y293 Y297 I298 L299 L346 I349 | A212-Y295 HydrophobicContact CB-CE2 4.39Å; I291-Y295 HydrophobicContact CG2-CD2 3.55Å; I291-Y295 HydrophobicContact CG2-CE2 3.46Å; I291-Y295 VanDerWaalsContact CG2-CE2 3.46Å; I291-Y295 VanDerWaalsContact O-CD2 3.28Å; I291-Y295 WeakPolarHBondContact O-CD2 3.23Å; I291-Y295 PolarHBondContact O-N 3.03Å; I292-Y295 PolarHBondContact O-N 3.48Å; Y293-Y295 PolarHBondContact O-N 3.02Å; Y295-Y297 VanDerWaalsContact C-N 3.35Å; Y295-I298 HydrophobicContact CD1-CD1 4.03Å; Y295-I298 HydrophobicContact CE1-CD1 4.46Å; Y295-I298 WeakPolarHBondContact O-CB 3.48Å; Y295-I298 PolarHBondContact O-N 2.95Å; Y295-L299 WeakPolarHBondContact O-CB 3.45Å; Y295-L299 WeakPolarHBondContact O-CG 3.3Å; Y295-L299 PolarHBondContact O-N 2.88Å; Y295-L346 HydrophobicContact CD1-CD2 3.67Å; Y295-L346 HydrophobicContact CD1-CG 4.5Å; Y295-L346 HydrophobicContact CE1-CD2 3.54Å; Y295-I349 HydrophobicContact CD2-CG2 4.34Å; Y295-I349 HydrophobicContact CE2-CG2 3.78Å |
| 296 | M | 89 | Confident | 87.4 | Confident | 93 Ų | 93 | 60.8 Ų | 60.8 | 46% | 0.458 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.1 | -43.5 | 173.7 | -71.8 | -61.3 | -74.4 | 0 | 0 | 111.3 | I292 Y293 I298 L299 W300 L350 | I292-M296 HydrophobicContact CG2-CG 4.32Å; I292-M296 WeakPolarHBondContact O-CB 3.23Å; I292-M296 VanDerWaalsContact O-CG 3.26Å; I292-M296 WeakPolarHBondContact O-CG 3.26Å; I292-M296 PolarHBondContact O-N 3.14Å; Y293-M296 PolarHBondContact O-N 3.21Å; M296-I298 PolarHBondContact O-N 2.9Å; M296-L299 PolarHBondContact O-N 3.46Å; M296-L299 HydrophobicContact SD-CD1 4.41Å; M296-W300 WeakPolarHBondContact O-CB 3.49Å; M296-W300 PolarHBondContact O-N 3.5Å; M296-L350 HydrophobicContact CG-CD2 4.25Å; M296-L350 HydrophobicContact SD-CD2 3.58Å; M296-L350 VanDerWaalsContact SD-CD2 3.58Å |
| 297 | Y | 88.5 | Confident | 86.7 | Confident | 45 Ų | 45 | 58.8 Ų | 58.8 | 18% | 0.176 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -61.5 | -42.8 | 173.9 | 177.3 | -93.7 | 0 | 0 | 0 | 112 | Y216 H220 Y293 A294 Y295 W300 K301 | Y216-Y297 AromaticContact CD2-CD1 3.89Å; Y216-Y297 HydrophobicContact CD2-CD1 3.89Å; Y216-Y297 HydrophobicContact CD2-CE1 4.12Å; Y216-Y297 AromaticContact CE2-CD1 3.59Å; Y216-Y297 HydrophobicContact CE2-CD1 3.59Å; Y216-Y297 AromaticContact CE2-CE1 3.53Å; Y216-Y297 HydrophobicContact CE2-CE1 3.53Å; Y216-Y297 HydrophobicContact CE2-CG 4.47Å; H220-Y297 PolarHBondContact ND1-OH 3.29Å; Y293-Y297 VanDerWaalsContact O-CB 3.29Å; Y293-Y297 WeakPolarHBondContact O-CB 3.3Å; Y293-Y297 PolarHBondContact O-N 3.39Å; A294-Y297 PolarHBondContact O-N 3.48Å; Y295-Y297 VanDerWaalsContact C-N 3.35Å; Y297-W300 HydrophobicContact CD2-CE3 4.08Å; Y297-W300 HydrophobicContact CD2-CZ3 4.34Å; Y297-W300 HydrophobicContact CE2-CE3 4.34Å; Y297-W300 HydrophobicContact CE2-CZ3 4.32Å; Y297-W300 PolarHBondContact O-N 3Å; Y297-K301 HydrophobicContact CE1-CD 3.9Å; Y297-K301 VanDerWaalsContact O-CB 3.32Å; Y297-K301 WeakPolarHBondContact O-CB 3.3Å; Y297-K301 PolarHBondContact O-N 3Å |
| 298 | I | 85.5 | Confident | 86 | Confident | 2 Ų | 2 | 63.5 Ų | 63.5 | 1% | 0.01 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60 | -47.3 | 176.1 | -73.8 | 163.2 | 0 | 0 | 0 | 110.7 | R215 I219 A294 Y295 M296 K301 A302 L346 | R215-I298 HydrophobicContact CB-CD1 3.84Å; I219-I298 HydrophobicContact CD1-CB 4.28Å; I219-I298 HydrophobicContact CD1-CG1 4.09Å; I219-I298 HydrophobicContact CD1-CG2 3.37Å; A294-I298 WeakPolarHBondContact O-CB 3.36Å; A294-I298 WeakPolarHBondContact O-CD1 3.33Å; A294-I298 WeakPolarHBondContact O-CG1 3.33Å; A294-I298 PolarHBondContact O-N 2.9Å; Y295-I298 HydrophobicContact CD1-CD1 4.03Å; Y295-I298 HydrophobicContact CE1-CD1 4.46Å; Y295-I298 WeakPolarHBondContact O-CB 3.48Å; Y295-I298 PolarHBondContact O-N 2.95Å; M296-I298 PolarHBondContact O-N 2.9Å; I298-K301 PolarHBondContact O-N 3.33Å; I298-A302 VanDerWaalsContact O-CB 3.28Å; I298-A302 WeakPolarHBondContact O-CB 3.34Å; I298-A302 PolarHBondContact O-N 2.79Å; I298-L346 HydrophobicContact CB-CD1 4.45Å; I298-L346 HydrophobicContact CG2-CD1 3.42Å; I298-L346 VanDerWaalsContact CG2-CD1 3.42Å |
| 299 | L | 84.7 | Confident | 85 | Confident | 29 Ų | 29 | 66.9 Ų | 66.9 | 15% | 0.152 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -61.1 | -46.7 | 178.1 | -74.7 | 171.6 | 0 | 0 | 0 | 111.3 | Y295 M296 K301 A302 H303 A343 L346 V347 | Y295-L299 WeakPolarHBondContact O-CB 3.45Å; Y295-L299 WeakPolarHBondContact O-CG 3.3Å; Y295-L299 PolarHBondContact O-N 2.88Å; M296-L299 PolarHBondContact O-N 3.46Å; M296-L299 HydrophobicContact SD-CD1 4.41Å; L299-K301 PolarHBondContact O-N 2.91Å; L299-A302 PolarHBondContact O-N 3.17Å; L299-H303 WeakPolarHBondContact O-CB 3.45Å; L299-H303 PolarHBondContact O-N 3.03Å; L299-A343 HydrophobicContact CD2-CB 3.68Å; L299-L346 HydrophobicContact CD2-CB 3.96Å; L299-L346 HydrophobicContact CD2-CD1 4.23Å; L299-L346 HydrophobicContact CG-CB 4.3Å; L299-V347 HydrophobicContact CD1-CG2 3.72Å; L299-V347 HydrophobicContact CD2-CG2 4.18Å |
| 300 | W | 86.4 | Confident | 84 | Confident | 163 Ų | 163 | 64.8 Ų | 64.8 | 62% | 0.617 | 30% | 0.3 | S | S | * | . | H | α-helix | trans | -60.9 | -46.2 | 177.9 | 177.1 | 44.4 | 0 | 0 | 0 | 112 | M296 Y297 H303 H304 | M296-W300 WeakPolarHBondContact O-CB 3.49Å; M296-W300 PolarHBondContact O-N 3.5Å; Y297-W300 HydrophobicContact CD2-CE3 4.08Å; Y297-W300 HydrophobicContact CD2-CZ3 4.34Å; Y297-W300 HydrophobicContact CE2-CE3 4.34Å; Y297-W300 HydrophobicContact CE2-CZ3 4.32Å; Y297-W300 PolarHBondContact O-N 3Å; W300-H303 PolarHBondContact O-N 3.12Å; W300-H304 WeakPolarHBondContact O-CB 3.42Å; W300-H304 PolarHBondContact O-N 3.15Å |
| 301 | K | 84.6 | Confident | 83 | Confident | 60 Ų | 60 | 64.3 Ų | 64.3 | 26% | 0.261 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -66.5 | -40.3 | 179.3 | -172.1 | 163.7 | -179.6 | 170.2 | 0 | 112.3 | I219 H220 Y297 I298 L299 H304 H305 | I219-K301 HydrophobicContact CG2-CD 4.08Å; I219-K301 HydrophobicContact CG2-CG 4.33Å; H220-K301 PolarHBondContact ND1-NZ 2.89Å; Y297-K301 HydrophobicContact CE1-CD 3.9Å; Y297-K301 VanDerWaalsContact O-CB 3.32Å; Y297-K301 WeakPolarHBondContact O-CB 3.3Å; Y297-K301 PolarHBondContact O-N 3Å; I298-K301 PolarHBondContact O-N 3.33Å; L299-K301 PolarHBondContact O-N 2.91Å; K301-H304 PolarHBondContact O-N 2.81Å; K301-H305 WeakPolarHBondContact O-CB 3.23Å; K301-H305 PolarHBondContact O-N 2.7Å |
| 302 | A | 79.8 | Confident | 81.7 | Confident | 30 Ų | 30 | 72.9 Ų | 72.9 | 25% | 0.248 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.3 | -45.1 | 175 | 0 | 0 | 0 | 0 | 0 | 111.3 | I298 L299 H305 A306 | I298-A302 VanDerWaalsContact O-CB 3.28Å; I298-A302 WeakPolarHBondContact O-CB 3.34Å; I298-A302 PolarHBondContact O-N 2.79Å; L299-A302 PolarHBondContact O-N 3.17Å; A302-H305 PolarHBondContact O-N 3.05Å; A302-A306 WeakPolarHBondContact O-CB 3.23Å; A302-A306 PolarHBondContact O-N 2.04Å |
| 303 | H | 82 | Confident | 80.2 | Confident | 104 Ų | 104 | 74.9 Ų | 74.9 | 48% | 0.481 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.1 | -48.5 | 175.8 | -178.1 | -94.6 | 0 | 0 | 0 | 111.6 | L299 W300 H305 A306 V307 | L299-H303 WeakPolarHBondContact O-CB 3.45Å; L299-H303 PolarHBondContact O-N 3.03Å; W300-H303 PolarHBondContact O-N 3.12Å; H303-H305 VanDerWaalsContact C-N 3.3Å; H303-H305 PolarHBondContact O-N 3.39Å; H303-A306 PolarHBondContact O-N 3Å; H303-A306 VanDerWaalsContact O-N 3.15Å; H303-V307 WeakPolarHBondContact O-CG2 3.25Å; H303-V307 PolarHBondContact O-N 3.24Å |
| 304 | H | 81.3 | Confident | 78.3 | Confident | 72 Ų | 72 | 72.5 Ų | 72.5 | 33% | 0.333 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -60.9 | -40.2 | 179 | -166.1 | -28.8 | 0 | 0 | 0 | 111.7 | W300 K301 R308 | W300-H304 WeakPolarHBondContact O-CB 3.42Å; W300-H304 PolarHBondContact O-N 3.15Å; K301-H304 PolarHBondContact O-N 2.81Å; H304-R308 PolarHBondContact CE1-NE 3.37Å; H304-R308 PolarHBondContact CE1-NH2 3.09Å; H304-R308 VanDerWaalsContact ND1-CZ 3.29Å; H304-R308 PolarHBondContact ND1-NE 3.35Å; H304-R308 VanDerWaalsContact ND1-NE 3.15Å; H304-R308 PolarHBondContact ND1-NH2 2.95Å; H304-R308 PolarHBondContact NE2-NH2 3.09Å; H304-R308 WeakPolarHBondContact O-CG 3.49Å; H304-R308 PolarHBondContact O-N 3.47Å |
| 305 | H | 78.4 | Confident | 76.3 | Confident | 92 Ų | 92 | 80.9 Ų | 80.9 | 43% | 0.426 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -63.8 | -45.5 | 174.7 | -175.7 | -93.1 | 0 | 0 | 0 | 111.6 | K301 A302 H303 V307 R308 M309 | K301-H305 WeakPolarHBondContact O-CB 3.23Å; K301-H305 PolarHBondContact O-N 2.7Å; A302-H305 PolarHBondContact O-N 3.05Å; H303-H305 VanDerWaalsContact C-N 3.3Å; H303-H305 PolarHBondContact O-N 3.39Å; H305-V307 PolarHBondContact O-N 3.44Å; H305-R308 PolarHBondContact O-N 3.26Å; H305-M309 WeakPolarHBondContact O-CG 3.47Å; H305-M309 PolarHBondContact O-N 3.49Å |
| 306 | A | 78 | Confident | 74.2 | Confident | 18 Ų | 18 | 89.4 Ų | 89.4 | 15% | 0.149 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -59.7 | -44.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | A302 H303 M309 L310 | A302-A306 WeakPolarHBondContact O-CB 3.23Å; A302-A306 PolarHBondContact O-N 2.04Å; H303-A306 PolarHBondContact O-N 3Å; H303-A306 VanDerWaalsContact O-N 3.15Å; A306-M309 PolarHBondContact O-N 2.99Å; A306-L310 WeakPolarHBondContact O-CG 3.29Å; A306-L310 PolarHBondContact O-N 3.02Å |
| 307 | V | 79.8 | Confident | 72 | Confident | 62 Ų | 62 | 89.4 Ų | 89.4 | 38% | 0.376 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62.3 | -47.7 | 176.4 | 174.5 | 0 | 0 | 0 | 0 | 111.1 | H303 H305 M309 L310 S311 | H303-V307 WeakPolarHBondContact O-CG2 3.25Å; H303-V307 PolarHBondContact O-N 3.24Å; H305-V307 PolarHBondContact O-N 3.44Å; V307-M309 VanDerWaalsContact C-N 3.27Å; V307-M309 PolarHBondContact O-N 2.97Å; V307-L310 PolarHBondContact O-N 3.18Å; V307-L310 VanDerWaalsContact O-N 3.15Å; V307-S311 PolarHBondContact O-N 3.32Å; V307-S311 PolarHBondContact O-OG 3.4Å; V307-S311 VanDerWaalsContact O-OG 3.09Å |
| 308 | R | 79.3 | Confident | 70 | Confident | 137 Ų | 137 | 94.1 Ų | 94.1 | 52% | 0.517 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.2 | -37.8 | 176.8 | -76.4 | -178.3 | -170.9 | 141.2 | 10.2 | 112.5 | H304 H305 R312 | H304-R308 PolarHBondContact CE1-NE 3.37Å; H304-R308 PolarHBondContact CE1-NH2 3.09Å; H304-R308 VanDerWaalsContact ND1-CZ 3.29Å; H304-R308 PolarHBondContact ND1-NE 3.35Å; H304-R308 VanDerWaalsContact ND1-NE 3.15Å; H304-R308 PolarHBondContact ND1-NH2 2.95Å; H304-R308 PolarHBondContact NE2-NH2 3.09Å; H304-R308 WeakPolarHBondContact O-CG 3.49Å; H304-R308 PolarHBondContact O-N 3.47Å; H305-R308 PolarHBondContact O-N 3.26Å; R308-R312 WeakPolarHBondContact O-CB 3.5Å; R308-R312 WeakPolarHBondContact O-CG 3.22Å; R308-R312 PolarHBondContact O-N 3.3Å |
| 309 | M | 71.1 | Confident | 68.3 | Low | 81 Ų | 81 | 98.9 Ų | 98.9 | 40% | 0.399 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.8 | -42.7 | 177.4 | -68.3 | -69.9 | -91.2 | 0 | 0 | 111 | H305 A306 V307 R312 T313 | H305-M309 WeakPolarHBondContact O-CG 3.47Å; H305-M309 PolarHBondContact O-N 3.49Å; A306-M309 PolarHBondContact O-N 2.99Å; V307-M309 VanDerWaalsContact C-N 3.27Å; V307-M309 PolarHBondContact O-N 2.97Å; M309-R312 PolarHBondContact O-N 3.26Å; M309-T313 WeakPolarHBondContact O-CB 3.4Å; M309-T313 PolarHBondContact O-N 3.42Å; M309-T313 PolarHBondContact O-OG1 2.91Å; M309-T313 VanDerWaalsContact O-OG1 3.14Å |
| 310 | L | 71.8 | Confident | 66.6 | Low | 100 Ų | 100 | 102.8 Ų | 102.8 | 52% | 0.524 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 174.7 | -71 | 169.4 | 0 | 0 | 0 | 112 | A306 V307 R312 T313 S314 T336 | A306-L310 WeakPolarHBondContact O-CG 3.29Å; A306-L310 PolarHBondContact O-N 3.02Å; V307-L310 PolarHBondContact O-N 3.18Å; V307-L310 VanDerWaalsContact O-N 3.15Å; L310-R312 PolarHBondContact O-N 2.94Å; L310-T313 PolarHBondContact O-N 3.26Å; L310-S314 WeakPolarHBondContact O-CB 3.33Å; L310-S314 PolarHBondContact O-N 2.52Å; L310-T336 HydrophobicContact CD2-CG2 4.32Å; L310-T336 HydrophobicContact CG-CG2 4.39Å |
| 311 | S | 70.1 | Confident | 64.8 | Low | 72 Ų | 72 | 104.8 Ų | 104.8 | 50% | 0.503 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63 | -38.8 | 176.1 | -54 | 0 | 0 | 0 | 0 | 112.5 | V307 | V307-S311 PolarHBondContact O-N 3.32Å; V307-S311 PolarHBondContact O-OG 3.4Å; V307-S311 VanDerWaalsContact O-OG 3.09Å |
| 312 | R | 65.3 | Low | 63.4 | Low | 182 Ų | 182 | 106.1 Ų | 106.1 | 69% | 0.687 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -72.8 | -34.7 | 176.4 | -76.4 | 178.6 | 169.3 | 179.7 | -3.7 | 113.4 | R308 M309 L310 Q315 K316 | R308-R312 WeakPolarHBondContact O-CB 3.5Å; R308-R312 WeakPolarHBondContact O-CG 3.22Å; R308-R312 PolarHBondContact O-N 3.3Å; M309-R312 PolarHBondContact O-N 3.26Å; L310-R312 PolarHBondContact O-N 2.94Å; R312-Q315 PolarHBondContact O-N 3.13Å; R312-K316 PolarHBondContact O-N 3.03Å |
| 313 | T | 59.2 | Low | 62.2 | Low | 82 Ų | 82 | 110.1 Ų | 110.1 | 50% | 0.503 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -71.7 | -35.5 | 175.4 | -67.1 | 0 | 0 | 0 | 0 | 111.4 | M309 L310 Q315 K316 S317 | M309-T313 WeakPolarHBondContact O-CB 3.4Å; M309-T313 PolarHBondContact O-N 3.42Å; M309-T313 PolarHBondContact O-OG1 2.91Å; M309-T313 VanDerWaalsContact O-OG1 3.14Å; L310-T313 PolarHBondContact O-N 3.26Å; T313-Q315 PolarHBondContact O-N 3.33Å; T313-K316 PolarHBondContact O-N 3.37Å; T313-K316 VanDerWaalsContact O-N 3.1Å; T313-S317 PolarHBondContact O-N 3.14Å |
| 314 | S | 51.3 | Low | 61 | Low | 94 Ų | 94 | 112 Ų | 112 | 66% | 0.657 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63.1 | -23.7 | 174.9 | -162 | 0 | 0 | 0 | 0 | 113.5 | L310 | L310-S314 WeakPolarHBondContact O-CB 3.33Å; L310-S314 PolarHBondContact O-N 2.52Å |
| 315 | Q | 47.3 | Very low | 59.7 | Low | 177 Ų | 177 | 112.2 Ų | 112.2 | 83% | 0.827 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.5 | -11 | 174.6 | -77 | -164.4 | -27.4 | 0 | 0 | 114.3 | R312 T313 | R312-Q315 PolarHBondContact O-N 3.13Å; T313-Q315 PolarHBondContact O-N 3.33Å |
| 316 | K | 45.1 | Very low | 58.6 | Low | 183 Ų | 183 | 113.5 Ų | 113.5 | 80% | 0.796 | 63% | 0.633 | S | S | * | * | trans | -115.3 | 24.9 | -178.8 | -79.3 | -168.7 | 177.4 | -174.9 | 0 | 113.9 | R312 T313 L318 | R312-K316 PolarHBondContact O-N 3.03Å; T313-K316 PolarHBondContact O-N 3.37Å; T313-K316 VanDerWaalsContact O-N 3.1Å; K316-L318 PolarHBondContact O-N 2.89Å | ||
| 317 | S | 42.7 | Very low | 57.1 | Low | 93 Ų | 93 | 122.5 Ų | 122.5 | 65% | 0.65 | 67% | 0.668 | S | S | * | * | trans | -74.8 | 72.1 | 162.8 | 61.2 | 0 | 0 | 0 | 0 | 109.6 | T313 V319 | T313-S317 PolarHBondContact O-N 3.14Å; S317-V319 PolarHBondContact O-N 3.34Å | ||
| 318 | L | 47.3 | Very low | 55.3 | Low | 143 Ų | 143 | 125 Ų | 125 | 75% | 0.749 | 69% | 0.688 | S | S | * | * | trans | -70.7 | 107.5 | 163.1 | -165.9 | 83.8 | 0 | 0 | 0 | 106.3 | K316 V320 | K316-L318 PolarHBondContact O-N 2.89Å; L318-V320 VanDerWaalsContact C-N 3.33Å; L318-V320 HydrophobicContact CD2-CG2 4Å; L318-V320 PolarHBondContact O-N 3.44Å | ||
| 319 | V | 49.1 | Very low | 53.7 | Low | 103 Ų | 103 | 127.3 Ų | 127.3 | 62% | 0.624 | 71% | 0.705 | S | S | * | * | trans | -67.2 | 96 | 169.9 | -178.6 | 0 | 0 | 0 | 0 | 106.8 | S317 Y321 | S317-V319 PolarHBondContact O-N 3.34Å; V319-Y321 HydrophobicContact CB-CD2 4.45Å; V319-Y321 HydrophobicContact CB-CE2 4.15Å; V319-Y321 HydrophobicContact CG1-CD2 3.72Å; V319-Y321 HydrophobicContact CG1-CE2 3.39Å; V319-Y321 HydrophobicContact CG1-CG 4.46Å; V319-Y321 PolarHBondContact O-N 3.12Å | ||
| 320 | V | 49.3 | Very low | 52.5 | Low | 111 Ų | 111 | 130 Ų | 130 | 67% | 0.673 | 73% | 0.726 | S | S | * | * | trans | -76.6 | 102.3 | 170.2 | 178.8 | 0 | 0 | 0 | 0 | 107 | L318 S322 | L318-V320 VanDerWaalsContact C-N 3.33Å; L318-V320 HydrophobicContact CD2-CG2 4Å; L318-V320 PolarHBondContact O-N 3.44Å; V320-S322 PolarHBondContact O-N 3.01Å | ||
| 321 | Y | 49.1 | Very low | 51.2 | Low | 205 Ų | 205 | 133.5 Ų | 133.5 | 80% | 0.804 | 74% | 0.742 | S | S | * | * | trans | -73 | 106.2 | 164.8 | -74.4 | -92.5 | 0 | 0 | 0 | 107.9 | V319 | V319-Y321 HydrophobicContact CB-CD2 4.45Å; V319-Y321 HydrophobicContact CB-CE2 4.15Å; V319-Y321 HydrophobicContact CG1-CD2 3.72Å; V319-Y321 HydrophobicContact CG1-CE2 3.39Å; V319-Y321 HydrophobicContact CG1-CG 4.46Å; V319-Y321 PolarHBondContact O-N 3.12Å | ||
| 322 | S | 53.6 | Low | 50.2 | Low | 87 Ų | 87 | 138.3 Ų | 138.3 | 61% | 0.608 | 75% | 0.749 | S | S | * | * | trans | -72.8 | 140.3 | 161.1 | -74.2 | 0 | 0 | 0 | 0 | 108.7 | V320 D324 | V320-S322 PolarHBondContact O-N 3.01Å; S322-D324 PolarHBondContact O-N 2.92Å | ||
| 323 | A | 55.9 | Low | 49.4 | Very low | 114 Ų | 114 | 132.5 Ų | 132.5 | 94% | 0.942 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | 5.4 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 324 | D | 56.6 | Low | 49 | Very low | 143 Ų | 143 | 135.9 Ų | 135.9 | 77% | 0.765 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -122.5 | 27.2 | -171.4 | -112.8 | -7.7 | 0 | 0 | 0 | 114.3 | S322 T326 | S322-D324 PolarHBondContact O-N 2.92Å; D324-T326 PolarHBondContact O-N 3.46Å; D324-T326 PolarHBondContact O-OG1 3.42Å; D324-T326 VanDerWaalsContact O-OG1 3.1Å |
| 325 | G | 53.6 | Low | 48.9 | Very low | 77 Ų | 77 | 136.1 Ų | 136.1 | 79% | 0.794 | 74% | 0.736 | S | S | * | * | trans | 64.6 | 2 | 164.9 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 326 | T | 55 | Low | 48.8 | Very low | 120 Ų | 120 | 129.1 Ų | 129.1 | 74% | 0.736 | 71% | 0.705 | S | S | * | * | trans | -92.2 | 115 | -176 | -45.3 | 0 | 0 | 0 | 0 | 110.2 | D324 S328 | D324-T326 PolarHBondContact O-N 3.46Å; D324-T326 PolarHBondContact O-OG1 3.42Å; D324-T326 VanDerWaalsContact O-OG1 3.1Å; T326-S328 PolarHBondContact O-N 3.41Å | ||
| 327 | K | 46.4 | Very low | 49.1 | Very low | 207 Ų | 207 | 126 Ų | 126 | 90% | 0.9 | 69% | 0.688 | S | S | * | * | trans | -63.2 | 104.7 | 178.7 | -63.9 | 178.7 | -178 | 177.3 | 0 | 110.2 | ||||
| 328 | S | 43.1 | Very low | 49.6 | Very low | 113 Ų | 113 | 125.8 Ų | 125.8 | 79% | 0.79 | 68% | 0.678 | S | S | * | * | trans | -93.7 | 103.4 | 170.3 | -162.9 | 0 | 0 | 0 | 0 | 109.9 | T326 T330 | T326-S328 PolarHBondContact O-N 3.41Å; S328-T330 PolarHBondContact O-N 3.38Å | ||
| 329 | Q | 44.2 | Very low | 50 | Low | 186 Ų | 186 | 120.7 Ų | 120.7 | 87% | 0.869 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 118.1 | 169 | -87.4 | -177 | -3.8 | 0 | 0 | 109.1 | M331 | Q329-M331 PolarHBondContact O-N 2.88Š|
| 330 | T | 46.8 | Very low | 50.6 | Low | 138 Ų | 138 | 121.4 Ų | 121.4 | 85% | 0.847 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 119.6 | 172.3 | -32.6 | 0 | 0 | 0 | 0 | 109.3 | S328 R332 | S328-T330 PolarHBondContact O-N 3.38Å; T330-R332 PolarHBondContact O-N 2.98Å |
| 331 | M | 44.2 | Very low | 51.3 | Low | 173 Ų | 173 | 124.2 Ų | 124.2 | 85% | 0.852 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 126.2 | -174.8 | -154.5 | 178 | -173 | 0 | 0 | 111.5 | Q329 | Q329-M331 PolarHBondContact O-N 2.88Š|
| 332 | R | 48.8 | Very low | 52.2 | Low | 173 Ų | 173 | 117.9 Ų | 117.9 | 65% | 0.653 | 63% | 0.629 | S | S | * | * | trans | -45.8 | 135.7 | 172.5 | -168.1 | 174.3 | -174.7 | 162.7 | 1.9 | 110.5 | T330 E334 | T330-R332 PolarHBondContact O-N 2.98Å; R332-E334 PolarHBondContact O-N 2.91Å | ||
| 333 | P | 49.3 | Very low | 53 | Low | 61 Ų | 61 | 114.9 Ų | 114.9 | 40% | 0.396 | 61% | 0.61 | S | S | . | * | trans | -68.3 | 116.1 | -178.2 | -2.6 | 16.5 | 0 | 0 | 0 | 108.8 | Q335 T336 | P333-Q335 PolarHBondContact O-N 3.38Å; P333-Q335 VanDerWaalsContact O-N 3.1Å; P333-T336 PolarHBondContact O-N 3.47Å; P333-T336 PolarHBondContact O-OG1 3Å | ||
| 334 | E | 49.8 | Very low | 53.9 | Low | 152 Ų | 152 | 114.6 Ų | 114.6 | 71% | 0.71 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -52.9 | -27.2 | 168.8 | -76.8 | -122.8 | 131.4 | 0 | 0 | 111.8 | R332 R337 M338 | R332-E334 PolarHBondContact O-N 2.91Å; E334-R337 PolarHBondContact O-N 3.49Å; E334-M338 PolarHBondContact O-N 3.37Å; E334-M338 VanDerWaalsContact O-N 3.14Å |
| 335 | Q | 48.8 | Very low | 54.9 | Low | 100 Ų | 100 | 108.9 Ų | 108.9 | 47% | 0.467 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -62.2 | -44.8 | -178 | -156 | 67.9 | 22 | 0 | 0 | 113.5 | P333 R337 M338 D339 | P333-Q335 PolarHBondContact O-N 3.38Å; P333-Q335 VanDerWaalsContact O-N 3.1Å; Q335-R337 VanDerWaalsContact C-N 3.29Å; Q335-R337 PolarHBondContact O-N 2.95Å; Q335-M338 VanDerWaalsContact NE2-CE 3.32Å; Q335-M338 PolarHBondContact O-N 2.98Å; Q335-D339 PolarHBondContact O-N 3.18Å; Q335-D339 VanDerWaalsContact O-N 3.09Å |
| 336 | T | 46.4 | Very low | 56.2 | Low | 30 Ų | 30 | 105.6 Ų | 105.6 | 18% | 0.184 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -67.2 | -29.7 | 179.7 | 4.8 | 0 | 0 | 0 | 0 | 112.3 | L310 P333 I340 | L310-T336 HydrophobicContact CD2-CG2 4.32Å; L310-T336 HydrophobicContact CG-CG2 4.39Å; P333-T336 PolarHBondContact O-N 3.47Å; P333-T336 PolarHBondContact O-OG1 3Å; T336-I340 WeakPolarHBondContact O-CG1 3.25Å; T336-I340 PolarHBondContact O-N 2.95Å |
| 337 | R | 51.1 | Low | 57.5 | Low | 116 Ų | 116 | 101.8 Ų | 101.8 | 44% | 0.438 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -74.8 | -32.2 | 174.8 | -70.9 | 178.8 | 168.6 | -168.2 | -4 | 112.4 | E334 Q335 R341 | E334-R337 PolarHBondContact O-N 3.49Å; Q335-R337 VanDerWaalsContact C-N 3.29Å; Q335-R337 PolarHBondContact O-N 2.95Å; R337-R341 WeakPolarHBondContact O-CG 3.49Å; R337-R341 PolarHBondContact O-N 2.94Å |
| 338 | M | 52.2 | Low | 59.4 | Low | 90 Ų | 90 | 94 Ų | 94 | 44% | 0.443 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -70.2 | -39.6 | 176 | -170.7 | 165.4 | 62.1 | 0 | 0 | 111.3 | E334 Q335 R341 L342 | E334-M338 PolarHBondContact O-N 3.37Å; E334-M338 VanDerWaalsContact O-N 3.14Å; Q335-M338 VanDerWaalsContact NE2-CE 3.32Å; Q335-M338 PolarHBondContact O-N 2.98Å; M338-R341 PolarHBondContact O-N 3.13Å; M338-L342 HydrophobicContact CG-CD1 4.27Å; M338-L342 WeakPolarHBondContact O-CG 3.31Å; M338-L342 PolarHBondContact O-N 2.66Å; M338-L342 VanDerWaalsContact O-N 3.09Å |
| 339 | D | 56.8 | Low | 61.4 | Low | 35 Ų | 35 | 89.3 Ų | 89.3 | 19% | 0.187 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -65.3 | -40 | 178.8 | -66.7 | -18.6 | 0 | 0 | 0 | 112.5 | Q335 L342 A343 | Q335-D339 PolarHBondContact O-N 3.18Å; Q335-D339 VanDerWaalsContact O-N 3.09Å; D339-L342 PolarHBondContact O-N 3.36Å; D339-A343 WeakPolarHBondContact O-CB 3.22Å; D339-A343 PolarHBondContact O-N 3.41Å |
| 340 | I | 61.1 | Low | 63.4 | Low | 118 Ų | 118 | 81.6 Ų | 81.6 | 61% | 0.605 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -66.9 | -40.9 | 176.2 | -66.4 | 167.6 | 0 | 0 | 0 | 111.9 | T336 L342 A343 K344 | T336-I340 WeakPolarHBondContact O-CG1 3.25Å; T336-I340 PolarHBondContact O-N 2.95Å; I340-L342 VanDerWaalsContact C-N 3.35Å; I340-A343 PolarHBondContact O-N 3.08Å; I340-K344 PolarHBondContact O-N 3.05Å |
| 341 | R | 65.4 | Low | 65.5 | Low | 171 Ų | 171 | 77.6 Ų | 77.6 | 65% | 0.645 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -64.7 | -40.5 | 177.8 | -74.6 | 175.3 | 178.5 | 172.2 | -0.6 | 111.6 | R337 M338 T345 | R337-R341 WeakPolarHBondContact O-CG 3.49Å; R337-R341 PolarHBondContact O-N 2.94Å; M338-R341 PolarHBondContact O-N 3.13Å; R341-T345 PolarHBondContact O-N 2.82Å |
| 342 | L | 66.2 | Low | 67.8 | Low | 71 Ų | 71 | 70.2 Ų | 70.2 | 37% | 0.372 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -64.4 | -45.6 | 174.8 | -70 | 169.9 | 0 | 0 | 0 | 110.8 | M338 D339 I340 K344 T345 L346 | M338-L342 HydrophobicContact CG-CD1 4.27Å; M338-L342 WeakPolarHBondContact O-CG 3.31Å; M338-L342 PolarHBondContact O-N 2.66Å; M338-L342 VanDerWaalsContact O-N 3.09Å; D339-L342 PolarHBondContact O-N 3.36Å; I340-L342 VanDerWaalsContact C-N 3.35Å; L342-K344 PolarHBondContact O-N 3.37Å; L342-T345 PolarHBondContact O-N 3.09Å; L342-T345 PolarHBondContact O-OG1 2.97Å; L342-L346 WeakPolarHBondContact O-CG 3.02Å; L342-L346 PolarHBondContact O-N 3.01Å; L342-L346 VanDerWaalsContact O-N 3.11Å |
| 343 | A | 70.4 | Confident | 69.7 | Low | 25 Ų | 25 | 62.2 Ų | 62.2 | 21% | 0.207 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -58 | -46.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L299 D339 I340 T345 L346 V347 | L299-A343 HydrophobicContact CD2-CB 3.68Å; D339-A343 WeakPolarHBondContact O-CB 3.22Å; D339-A343 PolarHBondContact O-N 3.41Å; I340-A343 PolarHBondContact O-N 3.08Å; A343-T345 VanDerWaalsContact C-N 3.3Å; A343-T345 PolarHBondContact O-N 3.19Å; A343-L346 PolarHBondContact O-N 3.1Å; A343-L346 VanDerWaalsContact O-N 3.08Å; A343-V347 WeakPolarHBondContact O-CG2 3.13Å; A343-V347 PolarHBondContact O-N 3.17Å |
| 344 | K | 75.9 | Confident | 71.7 | Confident | 107 Ų | 107 | 63 Ų | 63 | 47% | 0.465 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -57.3 | -41.7 | 177.4 | -175 | 172.7 | 177.9 | 171 | 0 | 112.5 | D6 I340 L342 L348 | D6-K344 IonicContact OD1-NZ 2.66Å; D6-K344 PolarHBondContact OD1-NZ 3.47Å; I340-K344 PolarHBondContact O-N 3.05Å; L342-K344 PolarHBondContact O-N 3.37Å; K344-L348 PolarHBondContact O-N 3.29Å; K344-L348 VanDerWaalsContact O-N 3.07Å |
| 345 | T | 77.9 | Confident | 73.7 | Confident | 23 Ų | 23 | 60.2 Ų | 60.2 | 14% | 0.141 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -68.7 | -33.2 | 177.3 | 59.6 | 0 | 0 | 0 | 0 | 113.1 | R341 L342 A343 I349 R401 | R341-T345 PolarHBondContact O-N 2.82Å; L342-T345 PolarHBondContact O-N 3.09Å; L342-T345 PolarHBondContact O-OG1 2.97Å; A343-T345 VanDerWaalsContact C-N 3.3Å; A343-T345 PolarHBondContact O-N 3.19Å; T345-I349 WeakPolarHBondContact O-CD1 3.44Å; T345-I349 VanDerWaalsContact O-CG1 3.31Å; T345-I349 WeakPolarHBondContact O-CG1 3.32Å; T345-I349 PolarHBondContact O-N 3.42Å; T345-I349 VanDerWaalsContact O-N 3.1Å; T345-R401 HydrophobicContact CG2-CB 4.4Å |
| 346 | L | 79.8 | Confident | 75.8 | Confident | 8 Ų | 8 | 55.6 Ų | 55.6 | 4% | 0.042 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -72.8 | -38.8 | 177.3 | -65.6 | -179.9 | 0 | 0 | 0 | 112.1 | Y295 I298 L299 L342 A343 L348 I349 L350 | Y295-L346 HydrophobicContact CD1-CD2 3.67Å; Y295-L346 HydrophobicContact CD1-CG 4.5Å; Y295-L346 HydrophobicContact CE1-CD2 3.54Å; I298-L346 HydrophobicContact CB-CD1 4.45Å; I298-L346 HydrophobicContact CG2-CD1 3.42Å; I298-L346 VanDerWaalsContact CG2-CD1 3.42Å; L299-L346 HydrophobicContact CD2-CB 3.96Å; L299-L346 HydrophobicContact CD2-CD1 4.23Å; L299-L346 HydrophobicContact CG-CB 4.3Å; L342-L346 WeakPolarHBondContact O-CG 3.02Å; L342-L346 PolarHBondContact O-N 3.01Å; L342-L346 VanDerWaalsContact O-N 3.11Å; A343-L346 PolarHBondContact O-N 3.1Å; A343-L346 VanDerWaalsContact O-N 3.08Å; L346-L348 VanDerWaalsContact C-N 3.32Å; L346-I349 HydrophobicContact CD2-CD1 4.16Å; L346-I349 PolarHBondContact O-N 3.19Å; L346-L350 PolarHBondContact O-N 2.68Å |
| 347 | V | 83.3 | Confident | 78 | Confident | 40 Ų | 40 | 54.3 Ų | 54.3 | 24% | 0.242 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.2 | -42.6 | 172.4 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | L299 A343 I349 L350 V351 | L299-V347 HydrophobicContact CD1-CG2 3.72Å; L299-V347 HydrophobicContact CD2-CG2 4.18Å; A343-V347 WeakPolarHBondContact O-CG2 3.13Å; A343-V347 PolarHBondContact O-N 3.17Å; V347-I349 PolarHBondContact O-N 3.16Å; V347-L350 WeakPolarHBondContact O-CB 3.44Å; V347-L350 PolarHBondContact O-N 3.04Å; V347-V351 HydrophobicContact CG1-CG2 4.31Å; V347-V351 WeakPolarHBondContact O-CG2 3.49Å; V347-V351 PolarHBondContact O-N 3.23Å |
| 348 | L | 85.2 | Confident | 79.9 | Confident | 43 Ų | 43 | 50.4 Ų | 50.4 | 23% | 0.225 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -58.6 | -46.8 | 175.3 | -178.8 | 67.8 | 0 | 0 | 0 | 111.8 | L5 K344 L346 L350 V351 V352 I397 | L5-L348 HydrophobicContact CD2-CD1 3.87Å; L5-L348 HydrophobicContact CG-CD1 4.47Å; K344-L348 PolarHBondContact O-N 3.29Å; K344-L348 VanDerWaalsContact O-N 3.07Å; L346-L348 VanDerWaalsContact C-N 3.32Å; L348-L350 VanDerWaalsContact C-N 3.3Å; L348-L350 PolarHBondContact O-N 3.28Å; L348-V351 PolarHBondContact O-N 3.14Å; L348-V352 HydrophobicContact CD1-CG2 4.31Å; L348-V352 HydrophobicContact CG-CG2 4.49Å; L348-V352 WeakPolarHBondContact O-CB 3.11Å; L348-V352 VanDerWaalsContact O-CG2 3.23Å; L348-V352 WeakPolarHBondContact O-CG2 3.13Å; L348-V352 PolarHBondContact O-N 3.04Å; L348-I397 HydrophobicContact CD2-CG1 4.2Å |
| 349 | I | 86.1 | Confident | 82 | Confident | 15 Ų | 15 | 48.7 Ų | 48.7 | 8% | 0.077 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -56.8 | -45.5 | 175.9 | -69.9 | 159.8 | 0 | 0 | 0 | 110.8 | Y295 T345 L346 V347 V352 L353 I397 | Y295-I349 HydrophobicContact CD2-CG2 4.34Å; Y295-I349 HydrophobicContact CE2-CG2 3.78Å; T345-I349 WeakPolarHBondContact O-CD1 3.44Å; T345-I349 VanDerWaalsContact O-CG1 3.31Å; T345-I349 WeakPolarHBondContact O-CG1 3.32Å; T345-I349 PolarHBondContact O-N 3.42Å; T345-I349 VanDerWaalsContact O-N 3.1Å; L346-I349 HydrophobicContact CD2-CD1 4.16Å; L346-I349 PolarHBondContact O-N 3.19Å; V347-I349 PolarHBondContact O-N 3.16Å; I349-V352 PolarHBondContact O-N 3.13Å; I349-L353 WeakPolarHBondContact O-CB 2.93Å; I349-L353 PolarHBondContact O-N 3.13Å; I349-I397 HydrophobicContact CD1-CG2 3.72Å; I349-I397 HydrophobicContact CG1-CD1 3.91Å; I349-I397 HydrophobicContact CG1-CG1 4.47Å; I349-I397 HydrophobicContact CG1-CG2 3.5Å; I349-I397 VanDerWaalsContact CG1-CG2 3.5Å |
| 350 | L | 86.8 | Confident | 83.7 | Confident | 25 Ų | 25 | 47.1 Ų | 47.1 | 13% | 0.131 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.7 | -47 | -178.8 | -172.9 | 74.4 | 0 | 0 | 0 | 112.1 | I292 M296 L346 V347 L348 L353 V354 | I292-L350 HydrophobicContact CB-CD1 3.94Å; I292-L350 HydrophobicContact CG1-CD1 3.68Å; I292-L350 HydrophobicContact CG2-CD1 3.91Å; M296-L350 HydrophobicContact CG-CD2 4.25Å; M296-L350 HydrophobicContact SD-CD2 3.58Å; M296-L350 VanDerWaalsContact SD-CD2 3.58Å; L346-L350 PolarHBondContact O-N 2.68Å; V347-L350 WeakPolarHBondContact O-CB 3.44Å; V347-L350 PolarHBondContact O-N 3.04Å; L348-L350 VanDerWaalsContact C-N 3.3Å; L348-L350 PolarHBondContact O-N 3.28Å; L350-L353 PolarHBondContact O-N 3.28Å; L350-V354 WeakPolarHBondContact O-CG2 3.31Å; L350-V354 PolarHBondContact O-N 3.47Å |
| 351 | V | 90.4 | Very high | 85.3 | Confident | 54 Ų | 54 | 42.3 Ų | 42.3 | 33% | 0.327 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.7 | -45.1 | 179.4 | 170.5 | 0 | 0 | 0 | 0 | 110.7 | V347 L348 L353 V354 I355 | V347-V351 HydrophobicContact CG1-CG2 4.31Å; V347-V351 WeakPolarHBondContact O-CG2 3.49Å; V347-V351 PolarHBondContact O-N 3.23Å; L348-V351 PolarHBondContact O-N 3.14Å; V351-L353 VanDerWaalsContact C-N 3.34Å; V351-L353 PolarHBondContact O-N 2.96Å; V351-V354 PolarHBondContact O-N 2.96Å; V351-I355 HydrophobicContact CG1-CD1 3.58Å; V351-I355 HydrophobicContact CG1-CG1 4.36Å; V351-I355 WeakPolarHBondContact O-CB 3.2Å; V351-I355 VanDerWaalsContact O-CG1 3.3Å; V351-I355 WeakPolarHBondContact O-CG1 3.35Å; V351-I355 PolarHBondContact O-N 3.27Å |
| 352 | V | 91.2 | Very high | 86.7 | Confident | 18 Ų | 18 | 37 Ų | 37 | 11% | 0.109 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -61.2 | -44.4 | 177.3 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | L348 I349 V354 I355 C356 V393 | L348-V352 HydrophobicContact CD1-CG2 4.31Å; L348-V352 HydrophobicContact CG-CG2 4.49Å; L348-V352 WeakPolarHBondContact O-CB 3.11Å; L348-V352 VanDerWaalsContact O-CG2 3.23Å; L348-V352 WeakPolarHBondContact O-CG2 3.13Å; L348-V352 PolarHBondContact O-N 3.04Å; I349-V352 PolarHBondContact O-N 3.13Å; V352-V354 PolarHBondContact O-N 3.46Å; V352-I355 PolarHBondContact O-N 2.94Å; V352-C356 WeakPolarHBondContact O-CB 3.43Å; V352-C356 PolarHBondContact O-N 2.91Å; V352-C356 PolarHBondContact O-SG 2.92Å; V352-V393 HydrophobicContact CB-CG1 4.48Å; V352-V393 HydrophobicContact CG1-CB 4.05Å; V352-V393 HydrophobicContact CG1-CG1 3.92Å; V352-V393 HydrophobicContact CG2-CG1 3.8Å |
| 353 | L | 88.8 | Confident | 88.1 | Confident | 4 Ų | 4 | 34.8 Ų | 34.8 | 2% | 0.021 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59.5 | -46.5 | 178.9 | -170.4 | 74.6 | 0 | 0 | 0 | 111.6 | L208 V288 I291 I292 I349 L350 V351 W357 | L208-L353 HydrophobicContact CD1-CD1 4.17Å; V288-L353 HydrophobicContact CG1-CD2 4.1Å; V288-L353 HydrophobicContact CG1-CG 4.33Å; I291-L353 HydrophobicContact CB-CD2 4.19Å; I291-L353 HydrophobicContact CG2-CD2 3.69Å; I292-L353 HydrophobicContact CG1-CD2 4.05Å; I349-L353 WeakPolarHBondContact O-CB 2.93Å; I349-L353 PolarHBondContact O-N 3.13Å; L350-L353 PolarHBondContact O-N 3.28Å; V351-L353 VanDerWaalsContact C-N 3.34Å; V351-L353 PolarHBondContact O-N 2.96Å; L353-W357 WeakPolarHBondContact O-CB 3.49Å; L353-W357 PolarHBondContact O-N 3.32Å |
| 354 | V | 91.3 | Very high | 89.2 | Confident | 77 Ų | 77 | 34.2 Ų | 34.2 | 47% | 0.467 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -66.7 | -43.6 | 179.6 | 173.3 | 0 | 0 | 0 | 0 | 111.6 | I292 L350 V351 V352 C356 G358 | I292-V354 HydrophobicContact CD1-CG2 4.15Å; L350-V354 WeakPolarHBondContact O-CG2 3.31Å; L350-V354 PolarHBondContact O-N 3.47Å; V351-V354 PolarHBondContact O-N 2.96Å; V352-V354 PolarHBondContact O-N 3.46Å; V354-C356 VanDerWaalsContact C-N 3.34Å; V354-C356 PolarHBondContact O-N 3.43Å; V354-G358 VanDerWaalsContact O-CA 3.3Å; V354-G358 WeakPolarHBondContact O-CA 3.15Å; V354-G358 PolarHBondContact O-N 2.83Å |
| 355 | I | 93.3 | Very high | 90.2 | Very high | 94 Ų | 94 | 31.6 Ų | 31.6 | 48% | 0.482 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -65.6 | -39 | 179.6 | -70.1 | 172.5 | 0 | 0 | 0 | 111.1 | V351 V352 P359 | V351-I355 HydrophobicContact CG1-CD1 3.58Å; V351-I355 HydrophobicContact CG1-CG1 4.36Å; V351-I355 WeakPolarHBondContact O-CB 3.2Å; V351-I355 VanDerWaalsContact O-CG1 3.3Å; V351-I355 WeakPolarHBondContact O-CG1 3.35Å; V351-I355 PolarHBondContact O-N 3.27Å; V352-I355 PolarHBondContact O-N 2.94Å; I355-P359 WeakPolarHBondContact O-CD 3.38Å |
| 356 | C | 92.3 | Very high | 91 | Very high | 3 Ų | 3 | 34.5 Ų | 34.5 | 2% | 0.02 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -81 | -39.8 | -175.5 | -60.2 | 0 | 0 | 0 | 0 | 113.1 | V352 V354 L386 N390 | V352-C356 WeakPolarHBondContact O-CB 3.43Å; V352-C356 PolarHBondContact O-N 2.91Å; V352-C356 PolarHBondContact O-SG 2.92Å; V354-C356 VanDerWaalsContact C-N 3.34Å; V354-C356 PolarHBondContact O-N 3.43Å; C356-L386 WeakPolarHBondContact CB-O 3.41Å; C356-N390 HydrophobicContact CB-CB 3.7Å |
| 357 | W | 91.7 | Very high | 91.6 | Very high | 4 Ų | 4 | 34.3 Ų | 34.3 | 2% | 0.015 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -92.1 | -32.2 | -176.8 | -75.1 | 91.9 | 0 | 0 | 0 | 113.8 | F201 V205 W280 T284 V288 L353 V360 L361 | F201-W357 HydrophobicContact CB-CH2 4.24Å; V205-W357 HydrophobicContact CG2-CH2 3.58Å; V205-W357 HydrophobicContact CG2-CZ2 3.1Å; V205-W357 HydrophobicContact CG2-CZ3 4.46Å; W280-W357 HydrophobicContact CH2-CZ3 4.15Å; T284-W357 HydrophobicContact CG2-CE3 4.08Å; T284-W357 HydrophobicContact CG2-CH2 4.3Å; T284-W357 HydrophobicContact CG2-CZ3 3.72Å; V288-W357 HydrophobicContact CG2-CG 4.46Å; L353-W357 WeakPolarHBondContact O-CB 3.49Å; L353-W357 PolarHBondContact O-N 3.32Å; W357-V360 PolarHBondContact O-N 2.87Å; W357-L361 HydrophobicContact CB-CD1 4.21Å; W357-L361 HydrophobicContact CE3-CD1 4.29Å; W357-L361 HydrophobicContact CE3-CD2 4.32Å; W357-L361 HydrophobicContact CE3-CG 4.16Å; W357-L361 WeakPolarHBondContact O-CB 3.27Å; W357-L361 WeakPolarHBondContact O-CG 3.38Å; W357-L361 PolarHBondContact O-N 3.31Å |
| 358 | G | 92.8 | Very high | 92 | Very high | 34 Ų | 34 | 33.6 Ų | 33.6 | 35% | 0.351 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -56 | -57 | -173.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | V354 V360 A362 | V354-G358 VanDerWaalsContact O-CA 3.3Å; V354-G358 WeakPolarHBondContact O-CA 3.15Å; V354-G358 PolarHBondContact O-N 2.83Å; G358-V360 VanDerWaalsContact C-N 3.34Å; G358-V360 PolarHBondContact O-N 2.67Å; G358-A362 VanDerWaalsContact O-CB 3.26Å; G358-A362 WeakPolarHBondContact O-CB 3.35Å; G358-A362 PolarHBondContact O-N 3.1Å |
| 359 | P | 94.8 | Very high | 92.3 | Very high | 53 Ų | 53 | 38.7 Ų | 38.7 | 34% | 0.344 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -61.2 | -41.3 | -179.6 | -24.2 | 35 | 0 | 0 | 0 | 112.9 | I355 A362 I363 L386 | I355-P359 WeakPolarHBondContact O-CD 3.38Å; P359-A362 PolarHBondContact O-N 2.96Å; P359-I363 VanDerWaalsContact O-CG1 3.3Å; P359-I363 WeakPolarHBondContact O-CG1 3.42Å; P359-I363 PolarHBondContact O-N 2.66Å; P359-L386 HydrophobicContact CB-CD1 4.11Å; P359-L386 HydrophobicContact CG-CD1 3.93Å |
| 360 | V | 93.4 | Very high | 92.5 | Very high | 2 Ų | 2 | 46.3 Ų | 46.3 | 1% | 0.012 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -66.4 | -48.9 | -178 | 178.6 | 0 | 0 | 0 | 0 | 110.9 | W357 G358 A362 I363 M364 F380 A383 | W357-V360 PolarHBondContact O-N 2.87Å; G358-V360 VanDerWaalsContact C-N 3.34Å; G358-V360 PolarHBondContact O-N 2.67Å; V360-A362 VanDerWaalsContact C-N 3.32Å; V360-A362 PolarHBondContact O-N 2.7Å; V360-I363 PolarHBondContact O-N 2.92Å; V360-M364 HydrophobicContact CG1-CE 3.6Å; V360-M364 HydrophobicContact CG1-SD 3.92Å; V360-M364 WeakPolarHBondContact O-CB 3.34Å; V360-M364 VanDerWaalsContact O-CG 3.24Å; V360-M364 WeakPolarHBondContact O-CG 3.37Å; V360-M364 PolarHBondContact O-N 3.28Å; V360-F380 HydrophobicContact CG1-CE2 4.27Å; V360-A383 HydrophobicContact CG2-CB 4.26Å; V360-A383 VanDerWaalsContact CG2-O 3.27Å; V360-A383 WeakPolarHBondContact CG2-O 3.44Å |
| 361 | L | 94.3 | Very high | 92.5 | Very high | 17 Ų | 17 | 51.8 Ų | 51.8 | 9% | 0.089 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -64.7 | -37.3 | 177 | -68.5 | 175.3 | 0 | 0 | 0 | 111.7 | T284 W357 M364 V365 | T284-L361 HydrophobicContact CG2-CD2 4.28Å; W357-L361 HydrophobicContact CB-CD1 4.21Å; W357-L361 HydrophobicContact CE3-CD1 4.29Å; W357-L361 HydrophobicContact CE3-CD2 4.32Å; W357-L361 HydrophobicContact CE3-CG 4.16Å; W357-L361 WeakPolarHBondContact O-CB 3.27Å; W357-L361 WeakPolarHBondContact O-CG 3.38Å; W357-L361 PolarHBondContact O-N 3.31Å; L361-M364 PolarHBondContact O-N 2.77Å; L361-V365 WeakPolarHBondContact O-CB 3.34Å; L361-V365 VanDerWaalsContact O-CG2 3.23Å; L361-V365 WeakPolarHBondContact O-CG2 3.48Å; L361-V365 PolarHBondContact O-N 2.93Å |
| 362 | A | 94.9 | Very high | 92.3 | Very high | 61 Ų | 61 | 49.8 Ų | 49.8 | 50% | 0.504 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -62.9 | -44.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | G358 P359 V360 V365 Y366 | G358-A362 VanDerWaalsContact O-CB 3.26Å; G358-A362 WeakPolarHBondContact O-CB 3.35Å; G358-A362 PolarHBondContact O-N 3.1Å; P359-A362 PolarHBondContact O-N 2.96Å; V360-A362 VanDerWaalsContact C-N 3.32Å; V360-A362 PolarHBondContact O-N 2.7Å; A362-V365 PolarHBondContact O-N 2.81Å; A362-Y366 PolarHBondContact O-N 3.4Å |
| 363 | I | 95.2 | Very high | 92.2 | Very high | 24 Ų | 24 | 54 Ų | 54 | 12% | 0.123 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -68.4 | -41.3 | 178 | -62.5 | 164.6 | 0 | 0 | 0 | 110.8 | I268 P359 V360 V365 Y366 D367 M372 I376 V379 F380 A383 | I268-I363 HydrophobicContact CD1-CG2 3.79Å; P359-I363 VanDerWaalsContact O-CG1 3.3Å; P359-I363 WeakPolarHBondContact O-CG1 3.42Å; P359-I363 PolarHBondContact O-N 2.66Å; V360-I363 PolarHBondContact O-N 2.92Å; I363-V365 VanDerWaalsContact C-N 3.28Å; I363-V365 PolarHBondContact O-N 2.71Å; I363-Y366 WeakPolarHBondContact O-CB 3.35Å; I363-Y366 PolarHBondContact O-N 3.02Å; I363-Y366 VanDerWaalsContact O-N 3.12Å; I363-D367 PolarHBondContact O-N 2.95Å; I363-M372 HydrophobicContact CG2-CE 4.16Å; I363-M372 VanDerWaalsContact O-CE 3.32Å; I363-M372 WeakPolarHBondContact O-CE 3.3Å; I363-I376 HydrophobicContact CG2-CG2 4.12Å; I363-V379 HydrophobicContact CD1-CG1 4.03Å; I363-F380 HydrophobicContact CB-CD2 4.11Å; I363-F380 HydrophobicContact CD1-CD2 4.48Å; I363-F380 HydrophobicContact CG2-CB 4.02Å; I363-F380 HydrophobicContact CG2-CD2 3.71Å; I363-F380 HydrophobicContact CG2-CG 4.25Å; I363-A383 HydrophobicContact CD1-CB 3.95Å |
| 364 | M | 94.6 | Very high | 92.2 | Very high | 12 Ų | 12 | 58.2 Ų | 58.2 | 6% | 0.059 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -63.3 | -32.5 | 175 | -71.8 | 172.7 | 171 | 0 | 0 | 113 | F269 W280 I281 V360 L361 D367 F380 | F269-M364 HydrophobicContact CE2-CE 3.76Å; F269-M364 HydrophobicContact CE2-CG 4.39Å; F269-M364 HydrophobicContact CZ-CE 3.65Å; W280-M364 HydrophobicContact CH2-CE 4.42Å; W280-M364 HydrophobicContact CH2-SD 4.43Å; W280-M364 HydrophobicContact CZ3-CE 4.06Å; W280-M364 HydrophobicContact CZ3-SD 3.65Å; I281-M364 HydrophobicContact CD1-CB 3.68Å; I281-M364 WeakPolarHBondContact CD1-O 3.21Å; I281-M364 HydrophobicContact CG1-CB 4.14Å; V360-M364 HydrophobicContact CG1-CE 3.6Å; V360-M364 HydrophobicContact CG1-SD 3.92Å; V360-M364 WeakPolarHBondContact O-CB 3.34Å; V360-M364 VanDerWaalsContact O-CG 3.24Å; V360-M364 WeakPolarHBondContact O-CG 3.37Å; V360-M364 PolarHBondContact O-N 3.28Å; L361-M364 PolarHBondContact O-N 2.77Å; M364-D367 WeakPolarHBondContact O-CB 3.49Å; M364-F380 HydrophobicContact CE-CE2 4.04Å; M364-F380 HydrophobicContact CE-CZ 3.99Å; M364-F380 HydrophobicContact CG-CE2 4.01Å |
| 365 | V | 95.6 | Very high | 92.1 | Very high | 53 Ų | 53 | 60.9 Ų | 60.9 | 32% | 0.321 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -71.4 | -39.4 | 172.3 | 168.3 | 0 | 0 | 0 | 0 | 110.7 | I281 L361 A362 I363 D367 L368 F369 | I281-V365 HydrophobicContact CG2-CG2 3.73Å; L361-V365 WeakPolarHBondContact O-CB 3.34Å; L361-V365 VanDerWaalsContact O-CG2 3.23Å; L361-V365 WeakPolarHBondContact O-CG2 3.48Å; L361-V365 PolarHBondContact O-N 2.93Å; A362-V365 PolarHBondContact O-N 2.81Å; I363-V365 VanDerWaalsContact C-N 3.28Å; I363-V365 PolarHBondContact O-N 2.71Å; V365-D367 PolarHBondContact O-N 3.26Å; V365-L368 PolarHBondContact O-N 2.98Å; V365-L368 VanDerWaalsContact O-N 3.14Å; V365-F369 HydrophobicContact CG1-CD2 3.97Å; V365-F369 HydrophobicContact CG1-CE2 3.78Å; V365-F369 VanDerWaalsContact O-CD2 3.25Å; V365-F369 WeakPolarHBondContact O-CD2 3.42Å |
| 366 | Y | 94.9 | Very high | 92 | Very high | 84 Ų | 84 | 58.4 Ų | 58.4 | 33% | 0.329 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -58.3 | -37.4 | 175.9 | -174.8 | -112.1 | 0 | 0 | 0 | 111.2 | A362 I363 L368 F369 W370 M372 I376 | A362-Y366 PolarHBondContact O-N 3.4Å; I363-Y366 WeakPolarHBondContact O-CB 3.35Å; I363-Y366 PolarHBondContact O-N 3.02Å; I363-Y366 VanDerWaalsContact O-N 3.12Å; Y366-L368 PolarHBondContact O-N 3.36Å; Y366-F369 PolarHBondContact O-N 2.82Å; Y366-W370 HydrophobicContact CD2-CB 4.16Å; Y366-W370 HydrophobicContact CE1-CB 4.28Å; Y366-W370 HydrophobicContact CE2-CB 3.64Å; Y366-W370 HydrophobicContact CE2-CG 4.05Å; Y366-W370 PolarHBondContact O-N 3.1Å; Y366-M372 HydrophobicContact CD1-CE 3.15Å; Y366-M372 HydrophobicContact CD1-SD 3.51Å; Y366-M372 VanDerWaalsContact CD1-SD 3.51Å; Y366-M372 HydrophobicContact CE1-CE 3.96Å; Y366-M372 HydrophobicContact CE1-SD 3.78Å; Y366-M372 HydrophobicContact CG-CE 3.9Å; Y366-I376 HydrophobicContact CD1-CD1 4.12Å; Y366-I376 HydrophobicContact CD1-CG2 4.23Å; Y366-I376 HydrophobicContact CE1-CD1 3.37Å; Y366-I376 HydrophobicContact CE1-CG2 4.45Å |
| 367 | D | 92.6 | Very high | 92 | Very high | 3 Ų | 3 | 60.3 Ų | 60.3 | 2% | 0.016 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -58.8 | -32.3 | 176.7 | -168 | 54.6 | 0 | 0 | 0 | 113.4 | S266 D267 I268 L277 I363 M364 V365 F369 M372 | S266-D367 VanDerWaalsContact CB-OD2 3.3Å; S266-D367 WeakPolarHBondContact CB-OD2 2.99Å; S266-D367 PolarHBondContact OG-OD2 2.99Å; D267-D367 WeakPolarHBondContact CB-OD1 3.47Å; D267-D367 PolarHBondContact N-OD1 3.44Å; D267-D367 VanDerWaalsContact N-OD1 3.15Å; I268-D367 HydrophobicContact CD1-CB 3.79Å; I268-D367 HydrophobicContact CG1-CB 4.28Å; I268-D367 PolarHBondContact N-OD1 3.36Å; L277-D367 WeakPolarHBondContact CD2-OD2 3.49Å; I363-D367 PolarHBondContact O-N 2.95Å; M364-D367 WeakPolarHBondContact O-CB 3.49Å; V365-D367 PolarHBondContact O-N 3.26Å; D367-F369 VanDerWaalsContact C-N 3.34Å; D367-M372 HydrophobicContact CB-CE 3.61Å |
| 368 | L | 92.3 | Very high | 92 | Very high | 25 Ų | 25 | 61 Ų | 61 | 13% | 0.131 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -78.2 | -19.6 | -178 | -62.9 | 177.6 | 0 | 0 | 0 | 113.8 | E274 L277 M278 I281 V365 Y366 | E274-L368 HydrophobicContact CB-CD2 4.16Å; E274-L368 WeakPolarHBondContact O-CD2 2.98Å; L277-L368 HydrophobicContact CB-CD2 4.15Å; L277-L368 HydrophobicContact CD2-CD2 3.99Å; L277-L368 HydrophobicContact CG-CD2 4.08Å; M278-L368 HydrophobicContact CB-CD1 3.79Å; M278-L368 HydrophobicContact CB-CD2 4.24Å; M278-L368 HydrophobicContact CE-CD1 4.49Å; M278-L368 HydrophobicContact CG-CD1 4.05Å; I281-L368 HydrophobicContact CD1-CD1 3.83Å; I281-L368 HydrophobicContact CD1-CG 4.3Å; V365-L368 PolarHBondContact O-N 2.98Å; V365-L368 VanDerWaalsContact O-N 3.14Å; Y366-L368 PolarHBondContact O-N 3.36Å |
| 369 | F | 91.3 | Very high | 92 | Very high | 150 Ų | 150 | 63.4 Ų | 63.4 | 66% | 0.658 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -115.1 | -24.8 | -171.7 | -67.8 | -66 | 0 | 0 | 0 | 112.9 | V365 Y366 D367 | V365-F369 HydrophobicContact CG1-CD2 3.97Å; V365-F369 HydrophobicContact CG1-CE2 3.78Å; V365-F369 VanDerWaalsContact O-CD2 3.25Å; V365-F369 WeakPolarHBondContact O-CD2 3.42Å; Y366-F369 PolarHBondContact O-N 2.82Å; D367-F369 VanDerWaalsContact C-N 3.34Å |
| 370 | W | 90 | Very high | 92 | Very high | 176 Ų | 176 | 62 Ų | 62 | 67% | 0.667 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -140 | 148.7 | -172.2 | -134.5 | -95.6 | 0 | 0 | 0 | 111.6 | Y366 | Y366-W370 HydrophobicContact CD2-CB 4.16Å; Y366-W370 HydrophobicContact CE1-CB 4.28Å; Y366-W370 HydrophobicContact CE2-CB 3.64Å; Y366-W370 HydrophobicContact CE2-CG 4.05Å; Y366-W370 PolarHBondContact O-N 3.1Å |
| 371 | K | 87 | Confident | 91.9 | Very high | 140 Ų | 140 | 62.1 Ų | 62.1 | 61% | 0.609 | 31% | 0.31 | S | S | * | . | P | Polyproline II helix | trans | -67 | 138.9 | 171.9 | -71.7 | -164.5 | 172.6 | -172.2 | 0 | 110.1 | E101 | E101-K371 IonicContact OE1-NZ 3.05Å; E101-K371 PolarHBondContact OE1-NZ 3.35Å |
| 372 | M | 86.6 | Confident | 91.9 | Very high | 12 Ų | 12 | 64.8 Ų | 64.8 | 6% | 0.059 | 32% | 0.321 | C | S | . | . | P | Polyproline II helix | trans | -89.5 | 123.2 | -176.4 | -76.3 | -75.3 | 172.8 | 0 | 0 | 113.2 | D267 I268 I363 Y366 D367 I376 K377 | D267-M372 HydrophobicContact CB-CB 3.79Å; D267-M372 HydrophobicContact CB-CG 3.95Å; D267-M372 PolarHBondContact OD2-N 3.15Å; D267-M372 VanDerWaalsContact OD2-N 3.08Å; I268-M372 HydrophobicContact CD1-CE 3.94Å; I268-M372 HydrophobicContact CG1-CE 4.47Å; I268-M372 HydrophobicContact CG1-CG 4.38Å; I363-M372 HydrophobicContact CG2-CE 4.16Å; I363-M372 VanDerWaalsContact O-CE 3.32Å; I363-M372 WeakPolarHBondContact O-CE 3.3Å; Y366-M372 HydrophobicContact CD1-CE 3.15Å; Y366-M372 HydrophobicContact CD1-SD 3.51Å; Y366-M372 VanDerWaalsContact CD1-SD 3.51Å; Y366-M372 HydrophobicContact CE1-CE 3.96Å; Y366-M372 HydrophobicContact CE1-SD 3.78Å; Y366-M372 HydrophobicContact CG-CE 3.9Å; D367-M372 HydrophobicContact CB-CE 3.61Å; M372-I376 HydrophobicContact CE-CG2 4.34Å; M372-I376 HydrophobicContact SD-CB 3.87Å; M372-I376 HydrophobicContact SD-CG2 3.35Å; M372-I376 WeakPolarHBondContact SD-CG2 3.34Å; M372-K377 HydrophobicContact CB-CD 4.48Å; M372-K377 HydrophobicContact CB-CG 4.02Å |
| 373 | D | 89.3 | Confident | 91.9 | Very high | 106 Ų | 106 | 62.3 Ų | 62.3 | 57% | 0.567 | 30% | 0.3 | S | S | * | . | P | Polyproline II helix | trans | -71.8 | 153.3 | 165.9 | -63.1 | -32.6 | 0 | 0 | 0 | 111.2 | D375 I376 K377 | D373-D375 PolarHBondContact O-N 3.28Å; D373-I376 HydrophobicContact CB-CD1 4.43Å; D373-I376 HydrophobicContact CB-CG1 4.45Å; D373-I376 PolarHBondContact O-N 2.98Å; D373-K377 PolarHBondContact O-N 3.48Å; D373-K377 VanDerWaalsContact O-N 3.11Å |
| 374 | D | 88.1 | Confident | 91.7 | Very high | 93 Ų | 93 | 61.6 Ų | 61.6 | 50% | 0.497 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.7 | -31.1 | -179.4 | -68.3 | -19.4 | 0 | 0 | 0 | 112.7 | I111 I376 K377 T378 | I111-D374 HydrophobicContact CD1-CB 3.99Å; I111-D374 WeakPolarHBondContact CD1-O 3.26Å; D374-I376 VanDerWaalsContact C-N 3.32Å; D374-I376 PolarHBondContact O-N 2.8Å; D374-K377 PolarHBondContact O-N 3.15Å; D374-K377 IonicContact OD1-NZ 2.67Å; D374-T378 WeakPolarHBondContact O-CB 3.21Å; D374-T378 PolarHBondContact O-N 2.83Å; D374-T378 PolarHBondContact O-OG1 2.98Å |
| 375 | D | 90.2 | Very high | 91.6 | Very high | 132 Ų | 132 | 61.7 Ų | 61.7 | 71% | 0.706 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -62 | -40.7 | 173.6 | -73.4 | -26.7 | 0 | 0 | 0 | 111.6 | D373 T378 V379 | D373-D375 PolarHBondContact O-N 3.28Å; D375-T378 WeakPolarHBondContact O-CB 3.16Å; D375-T378 PolarHBondContact O-N 3.35Å; D375-V379 WeakPolarHBondContact O-CG2 3.05Å; D375-V379 PolarHBondContact O-N 3.31Å |
| 376 | I | 91.3 | Very high | 91.4 | Very high | 43 Ų | 43 | 61.2 Ų | 61.2 | 22% | 0.221 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -73.8 | -39.2 | -178.2 | -56.7 | 175.1 | 0 | 0 | 0 | 110.5 | I363 Y366 M372 D373 D374 T378 V379 F380 | I363-I376 HydrophobicContact CG2-CG2 4.12Å; Y366-I376 HydrophobicContact CD1-CD1 4.12Å; Y366-I376 HydrophobicContact CD1-CG2 4.23Å; Y366-I376 HydrophobicContact CE1-CD1 3.37Å; Y366-I376 HydrophobicContact CE1-CG2 4.45Å; M372-I376 HydrophobicContact CE-CG2 4.34Å; M372-I376 HydrophobicContact SD-CB 3.87Å; M372-I376 HydrophobicContact SD-CG2 3.35Å; M372-I376 WeakPolarHBondContact SD-CG2 3.34Å; D373-I376 HydrophobicContact CB-CD1 4.43Å; D373-I376 HydrophobicContact CB-CG1 4.45Å; D373-I376 PolarHBondContact O-N 2.98Å; D374-I376 VanDerWaalsContact C-N 3.32Å; D374-I376 PolarHBondContact O-N 2.8Å; I376-T378 VanDerWaalsContact C-N 3.27Å; I376-T378 PolarHBondContact O-N 3.12Å; I376-V379 PolarHBondContact O-N 3.4Å; I376-F380 PolarHBondContact O-N 3.12Å |
| 377 | K | 90.7 | Very high | 91.1 | Very high | 43 Ų | 43 | 57.7 Ų | 57.7 | 19% | 0.187 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -59.5 | -38.9 | 170.9 | -69.2 | 176 | -172.8 | 167.7 | 0 | 111.6 | I111 D267 M372 D373 D374 F380 A381 | I111-K377 HydrophobicContact CD1-CB 3.36Å; I111-K377 HydrophobicContact CD1-CD 4.24Å; I111-K377 HydrophobicContact CD1-CG 4.44Å; I111-K377 HydrophobicContact CG1-CB 4.43Å; D267-K377 WeakPolarHBondContact O-CE 3.35Å; M372-K377 HydrophobicContact CB-CD 4.48Å; M372-K377 HydrophobicContact CB-CG 4.02Å; D373-K377 PolarHBondContact O-N 3.48Å; D373-K377 VanDerWaalsContact O-N 3.11Å; D374-K377 PolarHBondContact O-N 3.15Å; D374-K377 IonicContact OD1-NZ 2.67Å; K377-F380 WeakPolarHBondContact O-CB 3.5Å; K377-F380 PolarHBondContact O-N 3.44Å; K377-A381 PolarHBondContact O-N 2.7Å |
| 378 | T | 92.1 | Very high | 91 | Very high | 17 Ų | 17 | 57.6 Ų | 57.6 | 10% | 0.104 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -64.4 | -46.6 | 174.7 | -59.6 | 0 | 0 | 0 | 0 | 110.9 | I111 D374 D375 I376 F380 A381 F382 | I111-T378 WeakPolarHBondContact CD1-OG1 3.27Å; D374-T378 WeakPolarHBondContact O-CB 3.21Å; D374-T378 PolarHBondContact O-N 2.83Å; D374-T378 PolarHBondContact O-OG1 2.98Å; D375-T378 WeakPolarHBondContact O-CB 3.16Å; D375-T378 PolarHBondContact O-N 3.35Å; I376-T378 VanDerWaalsContact C-N 3.27Å; I376-T378 PolarHBondContact O-N 3.12Å; T378-F380 VanDerWaalsContact C-N 3.27Å; T378-F380 PolarHBondContact O-N 3.29Å; T378-A381 WeakPolarHBondContact O-CB 3.34Å; T378-A381 PolarHBondContact O-N 3.12Å; T378-A381 VanDerWaalsContact O-N 3.17Å; T378-F382 HydrophobicContact CG2-CD2 4.3Å; T378-F382 HydrophobicContact CG2-CE2 3.99Å; T378-F382 VanDerWaalsContact O-CD2 3.27Å; T378-F382 WeakPolarHBondContact O-CD2 3.38Å; T378-F382 PolarHBondContact O-N 3.08Å |
| 379 | V | 94.2 | Very high | 91 | Very high | 85 Ų | 85 | 59.4 Ų | 59.4 | 52% | 0.515 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -59.5 | -39 | 174.9 | 172.9 | 0 | 0 | 0 | 0 | 111.2 | I363 D375 I376 A381 F382 A383 | I363-V379 HydrophobicContact CD1-CG1 4.03Å; D375-V379 WeakPolarHBondContact O-CG2 3.05Å; D375-V379 PolarHBondContact O-N 3.31Å; I376-V379 PolarHBondContact O-N 3.4Å; V379-A381 PolarHBondContact O-N 2.88Å; V379-F382 PolarHBondContact O-N 3.41Å; V379-A383 WeakPolarHBondContact O-CB 2.96Å; V379-A383 PolarHBondContact O-N 3.05Å |
| 380 | F | 93.5 | Very high | 91 | Very high | 24 Ų | 24 | 52.4 Ų | 52.4 | 11% | 0.105 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.4 | -43.5 | 175.4 | -178.4 | -99.1 | 0 | 0 | 0 | 112.3 | I268 F269 V360 I363 M364 I376 K377 T378 F382 A383 S384 | I268-F380 HydrophobicContact CD1-CD2 4.07Å; I268-F380 HydrophobicContact CD1-CE2 4.39Å; I268-F380 HydrophobicContact CD1-CG 4.23Å; I268-F380 HydrophobicContact CG2-CD1 3.39Å; I268-F380 HydrophobicContact CG2-CD2 4.29Å; I268-F380 HydrophobicContact CG2-CE1 3.18Å; I268-F380 HydrophobicContact CG2-CE2 4.12Å; I268-F380 HydrophobicContact CG2-CG 3.96Å; I268-F380 HydrophobicContact CG2-CZ 3.59Å; F269-F380 HydrophobicContact CE1-CE1 4.36Å; F269-F380 HydrophobicContact CE1-CZ 4.3Å; F269-F380 HydrophobicContact CE2-CZ 4.08Å; F269-F380 HydrophobicContact CZ-CE1 4.05Å; F269-F380 AromaticContact CZ-CZ 3.58Å; F269-F380 HydrophobicContact CZ-CZ 3.58Å; V360-F380 HydrophobicContact CG1-CE2 4.27Å; I363-F380 HydrophobicContact CB-CD2 4.11Å; I363-F380 HydrophobicContact CD1-CD2 4.48Å; I363-F380 HydrophobicContact CG2-CB 4.02Å; I363-F380 HydrophobicContact CG2-CD2 3.71Å; I363-F380 HydrophobicContact CG2-CG 4.25Å; M364-F380 HydrophobicContact CE-CE2 4.04Å; M364-F380 HydrophobicContact CE-CZ 3.99Å; M364-F380 HydrophobicContact CG-CE2 4.01Å; I376-F380 PolarHBondContact O-N 3.12Å; K377-F380 WeakPolarHBondContact O-CB 3.5Å; K377-F380 PolarHBondContact O-N 3.44Å; T378-F380 VanDerWaalsContact C-N 3.27Å; T378-F380 PolarHBondContact O-N 3.29Å; F380-F382 VanDerWaalsContact C-N 3.27Å; F380-F382 PolarHBondContact O-N 2.91Å; F380-A383 PolarHBondContact O-N 3.17Å; F380-A383 VanDerWaalsContact O-N 3.12Å; F380-S384 WeakPolarHBondContact O-CB 3.26Å; F380-S384 PolarHBondContact O-N 2.94Å |
| 381 | A | 92.1 | Very high | 91.1 | Very high | 4 Ų | 4 | 44.1 Ų | 44.1 | 3% | 0.033 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -56.2 | -42.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | L112 F175 K377 T378 V379 S384 | L112-A381 HydrophobicContact CD1-CB 4.22Å; L112-A381 HydrophobicContact CD2-CB 4.22Å; F175-A381 HydrophobicContact CZ-CB 4.32Å; K377-A381 PolarHBondContact O-N 2.7Å; T378-A381 WeakPolarHBondContact O-CB 3.34Å; T378-A381 PolarHBondContact O-N 3.12Å; T378-A381 VanDerWaalsContact O-N 3.17Å; V379-A381 PolarHBondContact O-N 2.88Å; A381-S384 PolarHBondContact O-OG 2.99Å |
| 382 | F | 93.9 | Very high | 91.3 | Very high | 73 Ų | 73 | 37.7 Ų | 37.7 | 32% | 0.32 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -71.8 | -40.8 | 173.8 | -71.7 | -79.1 | 0 | 0 | 0 | 113.1 | Q116 A119 V120 M123 T378 V379 F380 S384 M385 | Q116-F382 HydrophobicContact CB-CE2 4.39Å; Q116-F382 HydrophobicContact CB-CZ 4.05Å; Q116-F382 HydrophobicContact CG-CE2 4.29Å; Q116-F382 HydrophobicContact CG-CZ 4.14Å; A119-F382 HydrophobicContact CB-CE1 4.5Å; V120-F382 HydrophobicContact CG2-CD1 3.84Å; V120-F382 HydrophobicContact CG2-CE1 3.41Å; V120-F382 VanDerWaalsContact CG2-CE1 3.41Å; V120-F382 HydrophobicContact CG2-CE2 4.4Å; V120-F382 HydrophobicContact CG2-CG 4.5Å; V120-F382 HydrophobicContact CG2-CZ 3.72Å; M123-F382 HydrophobicContact CE-CD1 3.62Å; M123-F382 HydrophobicContact CE-CE1 3.55Å; T378-F382 HydrophobicContact CG2-CD2 4.3Å; T378-F382 HydrophobicContact CG2-CE2 3.99Å; T378-F382 VanDerWaalsContact O-CD2 3.27Å; T378-F382 WeakPolarHBondContact O-CD2 3.38Å; T378-F382 PolarHBondContact O-N 3.08Å; V379-F382 PolarHBondContact O-N 3.41Å; F380-F382 VanDerWaalsContact C-N 3.27Å; F380-F382 PolarHBondContact O-N 2.91Å; F382-S384 VanDerWaalsContact C-N 3.25Å; F382-S384 PolarHBondContact O-N 3.5Å; F382-M385 VanDerWaalsContact O-CB 3.24Å; F382-M385 WeakPolarHBondContact O-CB 3.12Å; F382-M385 PolarHBondContact O-N 3.31Å; F382-M385 VanDerWaalsContact O-N 3.12Å |
| 383 | A | 94.2 | Very high | 91.6 | Very high | 10 Ų | 10 | 38.6 Ų | 38.6 | 8% | 0.083 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -63.2 | -32.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | V360 I363 V379 F380 M385 L386 | V360-A383 HydrophobicContact CG2-CB 4.26Å; V360-A383 VanDerWaalsContact CG2-O 3.27Å; V360-A383 WeakPolarHBondContact CG2-O 3.44Å; I363-A383 HydrophobicContact CD1-CB 3.95Å; V379-A383 WeakPolarHBondContact O-CB 2.96Å; V379-A383 PolarHBondContact O-N 3.05Å; F380-A383 PolarHBondContact O-N 3.17Å; F380-A383 VanDerWaalsContact O-N 3.12Å; A383-M385 PolarHBondContact O-N 2.95Å; A383-M385 VanDerWaalsContact O-N 3.17Å; A383-L386 WeakPolarHBondContact O-CB 3.25Å; A383-L386 WeakPolarHBondContact O-CG 3.16Å; A383-L386 PolarHBondContact O-N 3.03Å |
| 384 | S | 91.7 | Very high | 91.6 | Very high | 9 Ų | 9 | 33.8 Ų | 33.8 | 6% | 0.063 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.3 | -26.7 | 175.8 | 78.7 | 0 | 0 | 0 | 0 | 112.9 | F175 F380 A381 F382 L386 C387 | F175-S384 VanDerWaalsContact CE2-OG 3.24Å; F175-S384 WeakPolarHBondContact CE2-OG 3.47Å; F380-S384 WeakPolarHBondContact O-CB 3.26Å; F380-S384 PolarHBondContact O-N 2.94Å; A381-S384 PolarHBondContact O-OG 2.99Å; F382-S384 VanDerWaalsContact C-N 3.25Å; F382-S384 PolarHBondContact O-N 3.5Å; S384-L386 PolarHBondContact O-N 2.67Å; S384-C387 VanDerWaalsContact O-CB 3.3Å; S384-C387 WeakPolarHBondContact O-CB 3.06Å; S384-C387 PolarHBondContact O-N 3.27Å; S384-C387 VanDerWaalsContact O-N 3.12Å |
| 385 | M | 91.9 | Very high | 91.6 | Very high | 13 Ų | 13 | 29.7 Ų | 29.7 | 6% | 0.064 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -66.1 | -22.9 | 174 | -58.7 | -53.1 | -57.1 | 0 | 0 | 112.7 | V120 M123 S124 F171 F382 A383 C387 L388 L389 | V120-M385 HydrophobicContact CG1-CG 4.27Å; V120-M385 HydrophobicContact CG1-SD 3.89Å; M123-M385 HydrophobicContact CB-CE 4.45Å; S124-M385 VanDerWaalsContact CB-CE 3.47Å; F171-M385 HydrophobicContact CE1-CE 4.35Å; F171-M385 HydrophobicContact CE1-SD 3.91Å; F171-M385 HydrophobicContact CZ-SD 4.16Å; F382-M385 VanDerWaalsContact O-CB 3.24Å; F382-M385 WeakPolarHBondContact O-CB 3.12Å; F382-M385 PolarHBondContact O-N 3.31Å; F382-M385 VanDerWaalsContact O-N 3.12Å; A383-M385 PolarHBondContact O-N 2.95Å; A383-M385 VanDerWaalsContact O-N 3.17Å; M385-C387 PolarHBondContact O-N 3.13Å; M385-L388 HydrophobicContact CE-CD2 3.8Å; M385-L388 WeakPolarHBondContact O-CB 3.46Å; M385-L388 PolarHBondContact O-N 3.25Å; M385-L388 VanDerWaalsContact O-N 3.15Å; M385-L389 PolarHBondContact O-N 2.89Å |
| 386 | L | 92.6 | Very high | 91.4 | Very high | 44 Ų | 44 | 26.6 Ų | 26.6 | 23% | 0.23 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -66.2 | -28 | 174.4 | -61.6 | 172.6 | 0 | 0 | 0 | 111.9 | C356 P359 A383 S384 L388 L389 N390 | C356-L386 WeakPolarHBondContact CB-O 3.41Å; P359-L386 HydrophobicContact CB-CD1 4.11Å; P359-L386 HydrophobicContact CG-CD1 3.93Å; A383-L386 WeakPolarHBondContact O-CB 3.25Å; A383-L386 WeakPolarHBondContact O-CG 3.16Å; A383-L386 PolarHBondContact O-N 3.03Å; S384-L386 PolarHBondContact O-N 2.67Å; L386-L388 VanDerWaalsContact C-N 3.31Å; L386-L389 HydrophobicContact CD2-CD2 4.19Å; L386-L389 WeakPolarHBondContact O-CB 3.16Å; L386-L389 PolarHBondContact O-N 3.45Å; L386-N390 PolarHBondContact O-N 3.49Å |
| 387 | C | 88.4 | Confident | 91.1 | Very high | 10 Ų | 10 | 24.7 Ų | 24.7 | 7% | 0.068 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -64.4 | -39.5 | 172.4 | -59.3 | 0 | 0 | 0 | 0 | 111 | F201 S384 M385 N390 S391 | F201-C387 HydrophobicContact CD1-CB 4.29Å; F201-C387 HydrophobicContact CE1-CB 3.51Å; F201-C387 HydrophobicContact CE2-CB 4.08Å; F201-C387 HydrophobicContact CZ-CB 3.39Å; S384-C387 VanDerWaalsContact O-CB 3.3Å; S384-C387 WeakPolarHBondContact O-CB 3.06Å; S384-C387 PolarHBondContact O-N 3.27Å; S384-C387 VanDerWaalsContact O-N 3.12Å; M385-C387 PolarHBondContact O-N 3.13Å; C387-N390 WeakPolarHBondContact O-CB 3.43Å; C387-N390 PolarHBondContact O-N 3.47Å; C387-S391 PolarHBondContact O-N 2.83Å |
| 388 | L | 90.3 | Very high | 90.5 | Very high | 1 Ų | 1 | 23.6 Ų | 23.6 | 1% | 0.005 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -70 | -35.1 | 174.6 | -171.8 | 63 | 0 | 0 | 0 | 111.9 | L127 T131 S168 F171 V172 M385 L386 N390 S391 T392 | L127-L388 HydrophobicContact CB-CD2 3.94Å; L127-L388 HydrophobicContact CB-CG 4.44Å; L127-L388 HydrophobicContact CD2-CB 3.97Å; L127-L388 HydrophobicContact CD2-CD2 3.96Å; L127-L388 HydrophobicContact CD2-CG 3.87Å; L127-L388 HydrophobicContact CG-CD2 3.93Å; L127-L388 HydrophobicContact CG-CG 3.88Å; T131-L388 HydrophobicContact CG2-CD1 4.36Å; S168-L388 VanDerWaalsContact CB-CD1 3.46Å; F171-L388 HydrophobicContact CD1-CB 4.41Å; F171-L388 HydrophobicContact CD1-CD2 4.33Å; F171-L388 HydrophobicContact CE1-CB 4.29Å; F171-L388 HydrophobicContact CE1-CD2 4.37Å; V172-L388 HydrophobicContact CG2-CD1 4.45Å; V172-L388 HydrophobicContact CG2-CD2 3.85Å; M385-L388 HydrophobicContact CE-CD2 3.8Å; M385-L388 WeakPolarHBondContact O-CB 3.46Å; M385-L388 PolarHBondContact O-N 3.25Å; M385-L388 VanDerWaalsContact O-N 3.15Å; L386-L388 VanDerWaalsContact C-N 3.31Å; L388-N390 VanDerWaalsContact C-N 3.32Å; L388-N390 PolarHBondContact O-N 2.66Å; L388-S391 PolarHBondContact O-N 3.49Å; L388-T392 PolarHBondContact O-N 2.78Å; L388-T392 VanDerWaalsContact O-N 3.09Å; L388-T392 PolarHBondContact O-OG1 3.31Å |
| 389 | L | 91.8 | Very high | 89.8 | Confident | 62 Ų | 62 | 24.5 Ų | 24.5 | 33% | 0.325 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -63.1 | -39.6 | 173.9 | -175.2 | 63.4 | 0 | 0 | 0 | 111.4 | L127 M385 L386 S391 T392 V393 | L127-L389 HydrophobicContact CD1-CD1 4.14Å; L127-L389 HydrophobicContact CD2-CB 4.15Å; M385-L389 PolarHBondContact O-N 2.89Å; L386-L389 HydrophobicContact CD2-CD2 4.19Å; L386-L389 WeakPolarHBondContact O-CB 3.16Å; L386-L389 PolarHBondContact O-N 3.45Å; L389-S391 VanDerWaalsContact C-N 3.32Å; L389-S391 PolarHBondContact O-N 2.91Å; L389-T392 WeakPolarHBondContact O-CB 3.24Å; L389-T392 PolarHBondContact O-N 2.78Å; L389-T392 VanDerWaalsContact O-N 3.09Å; L389-V393 HydrophobicContact CD1-CG2 4.13Å; L389-V393 HydrophobicContact CG-CG2 4.25Å; L389-V393 WeakPolarHBondContact O-CG2 3.49Å; L389-V393 PolarHBondContact O-N 2.78Å |
| 390 | N | 91.1 | Very high | 88.9 | Confident | 3 Ų | 3 | 25.4 Ų | 25.4 | 2% | 0.016 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -55.3 | -48.4 | 174.9 | -172.9 | 58.5 | 0 | 0 | 0 | 111.5 | C356 L386 C387 L388 T392 V393 N394 | C356-N390 HydrophobicContact CB-CB 3.7Å; L386-N390 PolarHBondContact O-N 3.49Å; C387-N390 WeakPolarHBondContact O-CB 3.43Å; C387-N390 PolarHBondContact O-N 3.47Å; L388-N390 VanDerWaalsContact C-N 3.32Å; L388-N390 PolarHBondContact O-N 2.66Å; N390-T392 VanDerWaalsContact C-N 3.26Å; N390-T392 PolarHBondContact O-N 3.27Å; N390-V393 PolarHBondContact O-N 3.16Å; N390-N394 PolarHBondContact O-N 2.86Å; N390-N394 PolarHBondContact O-ND2 3.45Å; N390-N394 PolarHBondContact O-OD1 3.26Å |
| 391 | S | 92.1 | Very high | 88 | Confident | 2 Ų | 2 | 26.6 Ų | 26.6 | 1% | 0.014 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -65.8 | -26.5 | 177.8 | -64.6 | 0 | 0 | 0 | 0 | 113.6 | N135 D164 C387 L388 L389 P395 | N135-S391 PolarHBondContact ND2-O 3.47Å; D164-S391 VanDerWaalsContact CG-CB 3.47Å; D164-S391 VanDerWaalsContact CG-OG 3.28Å; D164-S391 WeakPolarHBondContact OD1-CB 3.34Å; D164-S391 PolarHBondContact OD1-OG 3.35Å; C387-S391 PolarHBondContact O-N 2.83Å; L388-S391 PolarHBondContact O-N 3.49Å; L389-S391 VanDerWaalsContact C-N 3.32Å; L389-S391 PolarHBondContact O-N 2.91Å; S391-P395 VanDerWaalsContact O-CD 3.3Å; S391-P395 WeakPolarHBondContact O-CD 3.19Å |
| 392 | T | 92.4 | Very high | 87.4 | Confident | 6 Ų | 6 | 27.3 Ų | 27.3 | 4% | 0.037 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -74.3 | -43.3 | 174.4 | -58.6 | 0 | 0 | 0 | 0 | 111.9 | L127 F130 T131 L388 L389 N390 N394 P395 | L127-T392 HydrophobicContact CD1-CG2 3.98Å; L127-T392 VanDerWaalsContact CD1-OG1 3.31Å; L127-T392 WeakPolarHBondContact CD1-OG1 3.18Å; F130-T392 HydrophobicContact CD1-CG2 3.44Å; F130-T392 VanDerWaalsContact CD1-CG2 3.44Å; F130-T392 HydrophobicContact CE1-CG2 3.62Å; T131-T392 PolarHBondContact OG1-OG1 3.23Å; L388-T392 PolarHBondContact O-N 2.78Å; L388-T392 VanDerWaalsContact O-N 3.09Å; L388-T392 PolarHBondContact O-OG1 3.31Å; L389-T392 WeakPolarHBondContact O-CB 3.24Å; L389-T392 PolarHBondContact O-N 2.78Å; L389-T392 VanDerWaalsContact O-N 3.09Å; N390-T392 VanDerWaalsContact C-N 3.26Å; N390-T392 PolarHBondContact O-N 3.27Å; T392-N394 VanDerWaalsContact C-N 3.28Å; T392-N394 PolarHBondContact O-N 3.39Å; T392-P395 WeakPolarHBondContact O-CD 3.39Å |
| 393 | V | 91.8 | Very high | 86.6 | Confident | 30 Ų | 30 | 30 Ų | 30 | 18% | 0.182 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -74 | -23.1 | -174.5 | 179.9 | 0 | 0 | 0 | 0 | 111.8 | V352 L389 N390 I396 I397 | V352-V393 HydrophobicContact CB-CG1 4.48Å; V352-V393 HydrophobicContact CG1-CB 4.05Å; V352-V393 HydrophobicContact CG1-CG1 3.92Å; V352-V393 HydrophobicContact CG2-CG1 3.8Å; L389-V393 HydrophobicContact CD1-CG2 4.13Å; L389-V393 HydrophobicContact CG-CG2 4.25Å; L389-V393 WeakPolarHBondContact O-CG2 3.49Å; L389-V393 PolarHBondContact O-N 2.78Å; N390-V393 PolarHBondContact O-N 3.16Å; V393-I396 WeakPolarHBondContact O-CB 3.42Å; V393-I396 PolarHBondContact O-N 2.98Å; V393-I397 HydrophobicContact CG1-CD1 3.71Å; V393-I397 HydrophobicContact CG1-CG1 3.96Å; V393-I397 WeakPolarHBondContact O-CG1 3.27Å; V393-I397 PolarHBondContact O-N 3.09Å |
| 394 | N | 89.1 | Confident | 86 | Confident | 6 Ų | 6 | 33.8 Ų | 33.8 | 3% | 0.032 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -54.4 | -59.8 | -180 | -76.5 | -21.1 | 0 | 0 | 0 | 113.6 | L160 D164 N390 T392 I396 I397 Y398 | L160-N394 HydrophobicContact CD2-CB 4.25Å; D164-N394 PolarHBondContact OD2-ND2 2.88Å; N390-N394 PolarHBondContact O-N 2.86Å; N390-N394 PolarHBondContact O-ND2 3.45Å; N390-N394 PolarHBondContact O-OD1 3.26Å; T392-N394 VanDerWaalsContact C-N 3.28Å; T392-N394 PolarHBondContact O-N 3.39Å; N394-I396 VanDerWaalsContact C-N 3.28Å; N394-I396 PolarHBondContact O-N 3.02Å; N394-I397 WeakPolarHBondContact O-CB 3.31Å; N394-I397 PolarHBondContact O-N 3.5Å; N394-I397 VanDerWaalsContact O-N 3.16Å; N394-Y398 HydrophobicContact CB-CE2 4.07Å; N394-Y398 WeakPolarHBondContact O-CD2 3.26Å; N394-Y398 VanDerWaalsContact O-CE2 3.32Å; N394-Y398 WeakPolarHBondContact O-CE2 3.38Å; N394-Y398 PolarHBondContact O-N 2.93Å; N394-Y398 VanDerWaalsContact O-N 3.14Å |
| 395 | P | 88.1 | Confident | 85.4 | Confident | 6 Ų | 6 | 34.1 Ų | 34.1 | 4% | 0.039 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -49.8 | -43.2 | 173.3 | -32.8 | 36.9 | 0 | 0 | 0 | 114.8 | E134 N135 V138 S391 T392 I397 Y398 A399 | E134-P395 HydrophobicContact CB-CB 4Å; E134-P395 HydrophobicContact CB-CG 4.01Å; N135-P395 WeakPolarHBondContact OD1-CG 3.3Å; V138-P395 HydrophobicContact CG2-CB 3.77Å; V138-P395 HydrophobicContact CG2-CG 4.17Å; S391-P395 VanDerWaalsContact O-CD 3.3Å; S391-P395 WeakPolarHBondContact O-CD 3.19Å; T392-P395 WeakPolarHBondContact O-CD 3.39Å; P395-I397 PolarHBondContact O-N 2.95Å; P395-Y398 PolarHBondContact O-N 3.23Å; P395-A399 WeakPolarHBondContact O-CB 3.24Å; P395-A399 PolarHBondContact O-N 3.39Å |
| 396 | I | 85.9 | Confident | 85.1 | Confident | 67 Ų | 67 | 38.9 Ų | 38.9 | 34% | 0.344 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -62.4 | -45.3 | -179.3 | -59.2 | 174.5 | 0 | 0 | 0 | 110.1 | V393 N394 Y398 A399 L400 | V393-I396 WeakPolarHBondContact O-CB 3.42Å; V393-I396 PolarHBondContact O-N 2.98Å; N394-I396 VanDerWaalsContact C-N 3.28Å; N394-I396 PolarHBondContact O-N 3.02Å; I396-Y398 VanDerWaalsContact C-N 3.3Å; I396-Y398 PolarHBondContact O-N 3.04Å; I396-A399 PolarHBondContact O-N 3.08Å; I396-L400 HydrophobicContact CG2-CD1 4.02Å; I396-L400 HydrophobicContact CG2-CG 4.44Å; I396-L400 WeakPolarHBondContact O-CB 3.48Å; I396-L400 VanDerWaalsContact O-CG 3.26Å; I396-L400 WeakPolarHBondContact O-CG 3.34Å; I396-L400 PolarHBondContact O-N 2.98Å |
| 397 | I | 84.8 | Confident | 84.7 | Confident | 4 Ų | 4 | 42 Ų | 42 | 2% | 0.021 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -57.9 | -44.4 | 175.8 | -70.6 | 166.6 | 0 | 0 | 0 | 110.5 | L348 I349 V393 N394 P395 L400 R401 | L348-I397 HydrophobicContact CD2-CG1 4.2Å; I349-I397 HydrophobicContact CD1-CG2 3.72Å; I349-I397 HydrophobicContact CG1-CD1 3.91Å; I349-I397 HydrophobicContact CG1-CG1 4.47Å; I349-I397 HydrophobicContact CG1-CG2 3.5Å; I349-I397 VanDerWaalsContact CG1-CG2 3.5Å; V393-I397 HydrophobicContact CG1-CD1 3.71Å; V393-I397 HydrophobicContact CG1-CG1 3.96Å; V393-I397 WeakPolarHBondContact O-CG1 3.27Å; V393-I397 PolarHBondContact O-N 3.09Å; N394-I397 WeakPolarHBondContact O-CB 3.31Å; N394-I397 PolarHBondContact O-N 3.5Å; N394-I397 VanDerWaalsContact O-N 3.16Å; P395-I397 PolarHBondContact O-N 2.95Å; I397-L400 PolarHBondContact O-N 3.42Å; I397-R401 VanDerWaalsContact O-CB 3.25Å; I397-R401 WeakPolarHBondContact O-CB 2.98Å; I397-R401 PolarHBondContact O-N 2.99Å |
| 398 | Y | 78.9 | Confident | 84.4 | Confident | 19 Ų | 19 | 41.9 Ų | 41.9 | 8% | 0.075 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -67.6 | -41.3 | 179.7 | -59.2 | -51.2 | 0 | 0 | 0 | 112.9 | I157 L160 N394 P395 I396 L400 R401 S402 | I157-Y398 HydrophobicContact CD1-CD1 4.25Å; I157-Y398 HydrophobicContact CG1-CD1 4.38Å; I157-Y398 HydrophobicContact CG1-CE1 4.25Å; I157-Y398 HydrophobicContact CG2-CD2 3.91Å; I157-Y398 HydrophobicContact CG2-CE2 4.13Å; I157-Y398 HydrophobicContact CG2-CG 4.16Å; L160-Y398 HydrophobicContact CD2-CE2 3.68Å; L160-Y398 WeakPolarHBondContact CD2-OH 3Å; N394-Y398 HydrophobicContact CB-CE2 4.07Å; N394-Y398 WeakPolarHBondContact O-CD2 3.26Å; N394-Y398 VanDerWaalsContact O-CE2 3.32Å; N394-Y398 WeakPolarHBondContact O-CE2 3.38Å; N394-Y398 PolarHBondContact O-N 2.93Å; N394-Y398 VanDerWaalsContact O-N 3.14Å; P395-Y398 PolarHBondContact O-N 3.23Å; I396-Y398 VanDerWaalsContact C-N 3.3Å; I396-Y398 PolarHBondContact O-N 3.04Å; Y398-L400 VanDerWaalsContact C-N 3.32Å; Y398-L400 PolarHBondContact O-N 3.26Å; Y398-R401 PolarHBondContact O-N 3.4Å; Y398-S402 WeakPolarHBondContact O-CB 3.3Å; Y398-S402 PolarHBondContact O-N 3.38Å |
| 399 | A | 78.1 | Confident | 84.1 | Confident | 37 Ų | 37 | 46.2 Ų | 46.2 | 31% | 0.306 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -61.4 | -40.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | P395 I396 M405 R406 | P395-A399 WeakPolarHBondContact O-CB 3.24Å; P395-A399 PolarHBondContact O-N 3.39Å; I396-A399 PolarHBondContact O-N 3.08Å; A399-M405 HydrophobicContact CB-CE 4.22Å; A399-R406 WeakPolarHBondContact O-CD 3.36Å; A399-R406 VanDerWaalsContact O-CG 3.32Å; A399-R406 WeakPolarHBondContact O-CG 3.44Å; A399-R406 PolarHBondContact O-NE 3.44Å |
| 400 | L | 74.3 | Confident | 83.7 | Confident | 104 Ų | 104 | 47.7 Ų | 47.7 | 55% | 0.545 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -68.6 | -37.1 | 176.6 | -68.3 | 174.1 | 0 | 0 | 0 | 112.2 | I396 I397 Y398 | I396-L400 HydrophobicContact CG2-CD1 4.02Å; I396-L400 HydrophobicContact CG2-CG 4.44Å; I396-L400 WeakPolarHBondContact O-CB 3.48Å; I396-L400 VanDerWaalsContact O-CG 3.26Å; I396-L400 WeakPolarHBondContact O-CG 3.34Å; I396-L400 PolarHBondContact O-N 2.98Å; I397-L400 PolarHBondContact O-N 3.42Å; Y398-L400 VanDerWaalsContact C-N 3.32Å; Y398-L400 PolarHBondContact O-N 3.26Å |
| 401 | R | 74.6 | Confident | 83.3 | Confident | 48 Ų | 48 | 52.2 Ų | 52.2 | 18% | 0.181 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -82.5 | -43.2 | -174.4 | -171.6 | 179.9 | 178.1 | 175.2 | 4.3 | 113.5 | T345 I397 Y398 | T345-R401 HydrophobicContact CG2-CB 4.4Å; I397-R401 VanDerWaalsContact O-CB 3.25Å; I397-R401 WeakPolarHBondContact O-CB 2.98Å; I397-R401 PolarHBondContact O-N 2.99Å; Y398-R401 PolarHBondContact O-N 3.4Å |
| 402 | S | 79.1 | Confident | 82.6 | Confident | 20 Ų | 20 | 52.7 Ų | 52.7 | 14% | 0.14 | 26% | 0.263 | C | S | . | . | trans | -97 | 113.9 | -170.7 | -176.8 | 0 | 0 | 0 | 0 | 111.9 | Y154 Y398 D404 M405 R406 | Y154-S402 PolarHBondContact OH-OG 3.44Å; Y398-S402 WeakPolarHBondContact O-CB 3.3Å; Y398-S402 PolarHBondContact O-N 3.38Å; S402-D404 VanDerWaalsContact C-N 3.33Å; S402-D404 PolarHBondContact OG-N 2.94Å; S402-M405 WeakPolarHBondContact OG-CB 3.33Å; S402-M405 PolarHBondContact OG-N 3.34Å; S402-M405 VanDerWaalsContact OG-N 3.09Å; S402-R406 PolarHBondContact O-N 3.05Å; S402-R406 PolarHBondContact O-NE 2.74Å | ||
| 403 | K | 78.3 | Confident | 81.9 | Confident | 128 Ų | 128 | 54.8 Ų | 54.8 | 56% | 0.557 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -64.9 | -40.2 | 168.2 | -73.1 | -177.5 | 179.8 | -178.6 | 0 | 110.8 | M405 R406 H407 | K403-M405 VanDerWaalsContact C-N 3.3Å; K403-M405 PolarHBondContact O-N 3.09Å; K403-R406 VanDerWaalsContact CG-NH2 3.35Å; K403-R406 PolarHBondContact O-N 3.09Å; K403-H407 PolarHBondContact O-N 2.84Å; K403-H407 PolarHBondContact O-ND1 3.42Å |
| 404 | D | 80.7 | Confident | 81.2 | Confident | 91 Ų | 91 | 59.5 Ų | 59.5 | 49% | 0.487 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.1 | -39.3 | -178 | -57.9 | -17.8 | 0 | 0 | 0 | 111.4 | L148 Y154 S402 H407 A408 | L148-D404 HydrophobicContact CD2-CB 4.05Å; Y154-D404 WeakPolarHBondContact OH-CB 3.39Å; S402-D404 VanDerWaalsContact C-N 3.33Å; S402-D404 PolarHBondContact OG-N 2.94Å; D404-H407 PolarHBondContact O-N 3.06Å; D404-A408 WeakPolarHBondContact O-CB 3.36Å; D404-A408 PolarHBondContact O-N 2.98Å |
| 405 | M | 80.1 | Confident | 80.1 | Confident | 15 Ų | 15 | 61.5 Ų | 61.5 | 7% | 0.074 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -66.6 | -40.6 | 176.3 | -164.9 | 177.1 | 126.8 | 0 | 0 | 111.7 | V138 A399 S402 K403 A408 F409 | V138-M405 HydrophobicContact CG2-CE 3.86Å; A399-M405 HydrophobicContact CB-CE 4.22Å; S402-M405 WeakPolarHBondContact OG-CB 3.33Å; S402-M405 PolarHBondContact OG-N 3.34Å; S402-M405 VanDerWaalsContact OG-N 3.09Å; K403-M405 VanDerWaalsContact C-N 3.3Å; K403-M405 PolarHBondContact O-N 3.09Å; M405-A408 PolarHBondContact O-N 3.28Å; M405-F409 WeakPolarHBondContact O-CB 3.28Å; M405-F409 PolarHBondContact O-N 3.19Å |
| 406 | R | 84.8 | Confident | 79 | Confident | 113 Ų | 113 | 65 Ų | 65 | 43% | 0.426 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 174.7 | -74.4 | -178.9 | -74.8 | 172.8 | -10.2 | 112.8 | A399 S402 K403 F409 L410 | A399-R406 WeakPolarHBondContact O-CD 3.36Å; A399-R406 VanDerWaalsContact O-CG 3.32Å; A399-R406 WeakPolarHBondContact O-CG 3.44Å; A399-R406 PolarHBondContact O-NE 3.44Å; S402-R406 PolarHBondContact O-N 3.05Å; S402-R406 PolarHBondContact O-NE 2.74Å; K403-R406 VanDerWaalsContact CG-NH2 3.35Å; K403-R406 PolarHBondContact O-N 3.09Å; R406-F409 PolarHBondContact O-N 2.03Å; R406-L410 WeakPolarHBondContact O-CG 3.47Å; R406-L410 PolarHBondContact O-N 3.08Å |
| 407 | H | 84 | Confident | 78 | Confident | 110 Ų | 110 | 71 Ų | 71 | 51% | 0.509 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -65 | -42.2 | 175.8 | -71.9 | 93.2 | 0 | 0 | 0 | 111.3 | K403 D404 F409 L410 N411 | K403-H407 PolarHBondContact O-N 2.84Å; K403-H407 PolarHBondContact O-ND1 3.42Å; D404-H407 PolarHBondContact O-N 3.06Å; H407-F409 VanDerWaalsContact C-N 3.31Å; H407-F409 PolarHBondContact O-N 3.26Å; H407-L410 PolarHBondContact O-N 2.7Å; H407-N411 WeakPolarHBondContact O-CB 3.24Å; H407-N411 PolarHBondContact O-N 3.33Å; H407-N411 PolarHBondContact O-OD1 3.04Å |
| 408 | A | 81.2 | Confident | 76.7 | Confident | 8 Ų | 8 | 72.7 Ų | 72.7 | 7% | 0.066 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -62.6 | -38.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | V141 L148 D404 M405 S412 | V141-A408 HydrophobicContact CG1-CB 3.61Å; L148-A408 HydrophobicContact CD1-CB 3.59Å; L148-A408 HydrophobicContact CG-CB 4.28Å; D404-A408 WeakPolarHBondContact O-CB 3.36Å; D404-A408 PolarHBondContact O-N 2.98Å; M405-A408 PolarHBondContact O-N 3.28Å; A408-S412 WeakPolarHBondContact O-CB 3.08Å; A408-S412 PolarHBondContact O-N 3.1Å; A408-S412 PolarHBondContact O-OG 2.9Å |
| 409 | F | 84.1 | Confident | 75.6 | Confident | 91 Ų | 91 | 75.5 Ų | 75.5 | 40% | 0.399 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -61.7 | -50.6 | 173.3 | 177.5 | -98.2 | 0 | 0 | 0 | 111.6 | I137 V141 M405 R406 H407 N411 S412 C413 | I137-F409 HydrophobicContact CG2-CD2 3.87Å; I137-F409 HydrophobicContact CG2-CE2 3.63Å; V141-F409 HydrophobicContact CG2-CB 4.22Å; V141-F409 HydrophobicContact CG2-CD2 3.93Å; M405-F409 WeakPolarHBondContact O-CB 3.28Å; M405-F409 PolarHBondContact O-N 3.19Å; R406-F409 PolarHBondContact O-N 2.03Å; H407-F409 VanDerWaalsContact C-N 3.31Å; H407-F409 PolarHBondContact O-N 3.26Å; F409-N411 VanDerWaalsContact C-N 3.33Å; F409-N411 PolarHBondContact O-N 3.07Å; F409-S412 PolarHBondContact O-N 3.24Å; F409-S412 VanDerWaalsContact O-N 3.14Å; F409-C413 PolarHBondContact O-N 3.19Å; F409-C413 PolarHBondContact O-SG 3.27Å; F409-C413 VanDerWaalsContact O-SG 3.33Å |
| 410 | L | 83.8 | Confident | 74.5 | Confident | 94 Ų | 94 | 76.3 Ų | 76.3 | 49% | 0.492 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59.3 | -43.5 | 177.8 | -70.5 | 171.7 | 0 | 0 | 0 | 112.1 | R406 H407 S412 C413 Q414 | R406-L410 WeakPolarHBondContact O-CG 3.47Å; R406-L410 PolarHBondContact O-N 3.08Å; H407-L410 PolarHBondContact O-N 2.7Å; L410-S412 VanDerWaalsContact C-N 3.33Å; L410-S412 PolarHBondContact O-N 2.84Å; L410-C413 PolarHBondContact O-N 2.93Å; L410-Q414 WeakPolarHBondContact O-CB 3.42Å; L410-Q414 WeakPolarHBondContact O-CG 3.36Å; L410-Q414 PolarHBondContact O-N 3.28Å |
| 411 | N | 82.6 | Confident | 73.5 | Confident | 97 Ų | 97 | 77.5 Ų | 77.5 | 52% | 0.519 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -64.6 | -38.6 | 177 | -68.4 | -1.3 | 0 | 0 | 0 | 111.6 | H407 F409 Q414 A415 | H407-N411 WeakPolarHBondContact O-CB 3.24Å; H407-N411 PolarHBondContact O-N 3.33Å; H407-N411 PolarHBondContact O-OD1 3.04Å; F409-N411 VanDerWaalsContact C-N 3.33Å; F409-N411 PolarHBondContact O-N 3.07Å; N411-Q414 PolarHBondContact O-N 3.05Å; N411-A415 WeakPolarHBondContact O-CB 3.46Å; N411-A415 PolarHBondContact O-N 3.27Å |
| 412 | S | 78.9 | Confident | 72.2 | Confident | 13 Ų | 13 | 81.8 Ų | 81.8 | 9% | 0.091 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -67 | -41.7 | 176.4 | -54.8 | 0 | 0 | 0 | 0 | 110.9 | Q144 A408 F409 L410 Q414 A415 C416 | Q144-S412 PolarHBondContact OE1-OG 3.37Å; A408-S412 WeakPolarHBondContact O-CB 3.08Å; A408-S412 PolarHBondContact O-N 3.1Å; A408-S412 PolarHBondContact O-OG 2.9Å; F409-S412 PolarHBondContact O-N 3.24Å; F409-S412 VanDerWaalsContact O-N 3.14Å; L410-S412 VanDerWaalsContact C-N 3.33Å; L410-S412 PolarHBondContact O-N 2.84Å; S412-Q414 PolarHBondContact O-N 2.81Å; S412-A415 PolarHBondContact O-N 3.33Å; S412-C416 WeakPolarHBondContact O-CB 3.41Å; S412-C416 PolarHBondContact O-N 3.25Å; S412-C416 PolarHBondContact O-SG 3.01Å |
| 413 | C | 77 | Confident | 70.9 | Confident | 49 Ų | 49 | 86.1 Ų | 86.1 | 33% | 0.331 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -63.2 | -39.9 | 173.7 | -67.2 | 0 | 0 | 0 | 0 | 112.7 | F409 L410 C416 R417 | F409-C413 PolarHBondContact O-N 3.19Å; F409-C413 PolarHBondContact O-SG 3.27Å; F409-C413 VanDerWaalsContact O-SG 3.33Å; L410-C413 PolarHBondContact O-N 2.93Å; C413-C416 PolarHBondContact O-N 3.11Å; C413-R417 WeakPolarHBondContact O-CB 3.39Å; C413-R417 WeakPolarHBondContact O-CG 3.24Å; C413-R417 PolarHBondContact O-N 2.83Å |
| 414 | Q | 76.4 | Confident | 69.6 | Low | 129 Ų | 129 | 85.2 Ų | 85.2 | 60% | 0.603 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -67.6 | -39.5 | 175.4 | -73.2 | 174.8 | 4.8 | 0 | 0 | 111.8 | L410 N411 S412 R417 G418 | L410-Q414 WeakPolarHBondContact O-CB 3.42Å; L410-Q414 WeakPolarHBondContact O-CG 3.36Å; L410-Q414 PolarHBondContact O-N 3.28Å; N411-Q414 PolarHBondContact O-N 3.05Å; S412-Q414 PolarHBondContact O-N 2.81Å; Q414-R417 PolarHBondContact O-N 3.36Å; Q414-G418 PolarHBondContact O-N 3.21Å |
| 415 | A | 67.3 | Low | 68.3 | Low | 49 Ų | 49 | 85.4 Ų | 85.4 | 41% | 0.405 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -64.9 | -41.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | N411 S412 G418 S419 | N411-A415 WeakPolarHBondContact O-CB 3.46Å; N411-A415 PolarHBondContact O-N 3.27Å; S412-A415 PolarHBondContact O-N 3.33Å; A415-G418 PolarHBondContact O-N 3.48Å; A415-S419 WeakPolarHBondContact O-CB 3.39Å; A415-S419 PolarHBondContact O-N 3.17Å |
| 416 | C | 63.4 | Low | 66.9 | Low | 79 Ų | 79 | 87.9 Ų | 87.9 | 53% | 0.534 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -64.5 | -38.5 | 173.4 | -68.5 | 0 | 0 | 0 | 0 | 112 | S412 C413 A420 | S412-C416 WeakPolarHBondContact O-CB 3.41Å; S412-C416 PolarHBondContact O-N 3.25Å; S412-C416 PolarHBondContact O-SG 3.01Å; C413-C416 PolarHBondContact O-N 3.11Å; C416-A420 VanDerWaalsContact O-CB 3.23Å; C416-A420 WeakPolarHBondContact O-CB 3.13Å; C416-A420 PolarHBondContact O-N 3.41Å |
| 417 | R | 65.3 | Low | 65.3 | Low | 194 Ų | 194 | 88 Ų | 88 | 73% | 0.732 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -65.5 | -44.3 | 173.1 | -79.1 | -177.1 | 177.9 | -167.8 | -1.3 | 112.1 | C413 Q414 S419 A420 Q421 | C413-R417 WeakPolarHBondContact O-CB 3.39Å; C413-R417 WeakPolarHBondContact O-CG 3.24Å; C413-R417 PolarHBondContact O-N 2.83Å; Q414-R417 PolarHBondContact O-N 3.36Å; R417-S419 PolarHBondContact O-N 2.96Å; R417-A420 PolarHBondContact O-N 3.31Å; R417-Q421 VanDerWaalsContact O-CB 3.23Å; R417-Q421 WeakPolarHBondContact O-CB 3.31Å; R417-Q421 PolarHBondContact O-N 3.43Å |
| 418 | G | 58.5 | Low | 63.7 | Low | 38 Ų | 38 | 89 Ų | 89 | 39% | 0.392 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q414 A415 Q422 | Q414-G418 PolarHBondContact O-N 3.21Å; A415-G418 PolarHBondContact O-N 3.48Å; G418-Q422 VanDerWaalsContact O-CB 3.3Å; G418-Q422 WeakPolarHBondContact O-CB 3.42Å; G418-Q422 PolarHBondContact O-N 2.97Å |
| 419 | S | 55.4 | Low | 62 | Low | 78 Ų | 78 | 91.5 Ų | 91.5 | 55% | 0.545 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -74.1 | -34.4 | 178 | -151.5 | 0 | 0 | 0 | 0 | 112.9 | A415 R417 L423 | A415-S419 WeakPolarHBondContact O-CB 3.39Å; A415-S419 PolarHBondContact O-N 3.17Å; R417-S419 PolarHBondContact O-N 2.96Å; S419-L423 WeakPolarHBondContact O-CB 2.78Å; S419-L423 PolarHBondContact O-N 3.28Å |
| 420 | A | 54.1 | Low | 60.2 | Low | 54 Ų | 54 | 90.9 Ų | 90.9 | 45% | 0.446 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.1 | -42.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | C416 R417 Q422 L423 D424 | C416-A420 VanDerWaalsContact O-CB 3.23Å; C416-A420 WeakPolarHBondContact O-CB 3.13Å; C416-A420 PolarHBondContact O-N 3.41Å; R417-A420 PolarHBondContact O-N 3.31Å; A420-Q422 VanDerWaalsContact C-N 3.33Å; A420-Q422 PolarHBondContact O-N 2.93Å; A420-L423 PolarHBondContact O-N 3.11Å; A420-D424 PolarHBondContact O-N 3.45Å |
| 421 | Q | 52.8 | Low | 58.3 | Low | 130 Ų | 130 | 90.3 Ų | 90.3 | 61% | 0.607 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -69.6 | -30.7 | 177.8 | -158.6 | 158 | 6.3 | 0 | 0 | 112.3 | R417 N425 | R417-Q421 VanDerWaalsContact O-CB 3.23Å; R417-Q421 WeakPolarHBondContact O-CB 3.31Å; R417-Q421 PolarHBondContact O-N 3.43Å; Q421-N425 WeakPolarHBondContact O-CB 3.25Å; Q421-N425 PolarHBondContact O-N 2.98Å; Q421-N425 PolarHBondContact O-ND2 3.44Å; Q421-N425 PolarHBondContact O-OD1 3.35Å |
| 422 | Q | 49.2 | Very low | 56.6 | Low | 137 Ų | 137 | 91.7 Ų | 91.7 | 64% | 0.64 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -74.6 | -29.9 | 172.9 | -161.4 | 172.6 | -5.3 | 0 | 0 | 112.5 | G418 A420 S426 | G418-Q422 VanDerWaalsContact O-CB 3.3Å; G418-Q422 WeakPolarHBondContact O-CB 3.42Å; G418-Q422 PolarHBondContact O-N 2.97Å; A420-Q422 VanDerWaalsContact C-N 3.33Å; A420-Q422 PolarHBondContact O-N 2.93Å; Q422-S426 WeakPolarHBondContact O-CB 3.49Å; Q422-S426 PolarHBondContact O-N 2.92Å; Q422-S426 PolarHBondContact O-OG 3.05Å |
| 423 | L | 50.1 | Low | 54.9 | Low | 112 Ų | 112 | 95.1 Ų | 95.1 | 59% | 0.586 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -73.4 | -41.1 | 173.8 | -169.3 | 66.9 | 0 | 0 | 0 | 111.8 | S419 A420 S426 L427 | S419-L423 WeakPolarHBondContact O-CB 2.78Å; S419-L423 PolarHBondContact O-N 3.28Å; A420-L423 PolarHBondContact O-N 3.11Å; L423-S426 PolarHBondContact O-N 3.23Å; L423-L427 HydrophobicContact CG-CD1 4.39Å; L423-L427 PolarHBondContact O-N 3.5Å |
| 424 | D | 51.6 | Low | 53.3 | Low | 108 Ų | 108 | 101 Ų | 101 | 58% | 0.578 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63 | -46.2 | 172.3 | -84.9 | -17.2 | 0 | 0 | 0 | 111.4 | A420 S426 L427 E428 | A420-D424 PolarHBondContact O-N 3.45Å; D424-S426 PolarHBondContact O-N 2.9Å; D424-L427 PolarHBondContact O-N 3.21Å; D424-E428 WeakPolarHBondContact O-CB 3.47Å; D424-E428 PolarHBondContact O-N 3.46Å |
| 425 | N | 54 | Low | 51.8 | Low | 95 Ų | 95 | 101.2 Ų | 101.2 | 51% | 0.508 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.5 | -30.2 | 175.9 | -70.7 | -12.2 | 0 | 0 | 0 | 112.6 | Q421 S429 | Q421-N425 WeakPolarHBondContact O-CB 3.25Å; Q421-N425 PolarHBondContact O-N 2.98Å; Q421-N425 PolarHBondContact O-ND2 3.44Å; Q421-N425 PolarHBondContact O-OD1 3.35Å; N425-S429 WeakPolarHBondContact O-CB 3.31Å; N425-S429 PolarHBondContact O-N 3.05Å |
| 426 | S | 51.6 | Low | 51 | Low | 67 Ų | 67 | 102.5 Ų | 102.5 | 47% | 0.469 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -75.2 | -39.5 | 176.4 | -60.5 | 0 | 0 | 0 | 0 | 111.5 | Q422 L423 D424 D430 | Q422-S426 WeakPolarHBondContact O-CB 3.49Å; Q422-S426 PolarHBondContact O-N 2.92Å; Q422-S426 PolarHBondContact O-OG 3.05Å; L423-S426 PolarHBondContact O-N 3.23Å; D424-S426 PolarHBondContact O-N 2.9Å; S426-D430 VanDerWaalsContact O-CB 3.25Å; S426-D430 WeakPolarHBondContact O-CB 3.32Å; S426-D430 PolarHBondContact O-N 2.69Å |
| 427 | L | 50.2 | Low | 50.1 | Low | 117 Ų | 117 | 101.4 Ų | 101.4 | 61% | 0.613 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -68.7 | -36.6 | 175.7 | -85.7 | 157.4 | 0 | 0 | 0 | 112.7 | L423 D424 C431 | L423-L427 HydrophobicContact CG-CD1 4.39Å; L423-L427 PolarHBondContact O-N 3.5Å; D424-L427 PolarHBondContact O-N 3.21Å; L427-C431 PolarHBondContact O-N 3.48Å |
| 428 | E | 50.4 | Low | 49.1 | Very low | 131 Ų | 131 | 94.9 Ų | 94.9 | 61% | 0.612 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -75.4 | -39.3 | 177.3 | -150.8 | 171.6 | -163.7 | 0 | 0 | 111.5 | D424 C431 Q432 | D424-E428 WeakPolarHBondContact O-CB 3.47Å; D424-E428 PolarHBondContact O-N 3.46Å; E428-C431 PolarHBondContact O-N 3.08Å; E428-Q432 PolarHBondContact O-N 3.13Å; E428-Q432 VanDerWaalsContact O-N 3.09Å |
| 429 | S | 46.3 | Very low | 48.5 | Very low | 59 Ų | 59 | 98.4 Ų | 98.4 | 41% | 0.413 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.1 | -36.5 | 173.9 | -179.4 | 0 | 0 | 0 | 0 | 112.7 | N425 N433 | N425-S429 WeakPolarHBondContact O-CB 3.31Å; N425-S429 PolarHBondContact O-N 3.05Å; S429-N433 WeakPolarHBondContact O-CB 3.37Å; S429-N433 PolarHBondContact O-N 2.97Å; S429-N433 PolarHBondContact O-ND2 3Å; S429-N433 VanDerWaalsContact O-ND2 3.13Å; S429-N433 PolarHBondContact OG-ND2 3.47Å; S429-N433 VanDerWaalsContact OG-ND2 3.13Å |
| 430 | D | 45.4 | Very low | 48 | Very low | 78 Ų | 78 | 103.1 Ų | 103.1 | 42% | 0.417 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -75.3 | -27.7 | -179.6 | -140.2 | 37 | 0 | 0 | 0 | 112.1 | S426 R434 | S426-D430 VanDerWaalsContact O-CB 3.25Å; S426-D430 WeakPolarHBondContact O-CB 3.32Å; S426-D430 PolarHBondContact O-N 2.69Å; D430-R434 VanDerWaalsContact O-CB 3.26Å; D430-R434 WeakPolarHBondContact O-CB 3.22Å; D430-R434 WeakPolarHBondContact O-CG 3.25Å; D430-R434 PolarHBondContact O-N 3Å; D430-R434 IonicContact OD2-CZ 2.82Å; D430-R434 IonicContact OD2-NE 2.66Å; D430-R434 PolarHBondContact OD2-NE 3.01Å; D430-R434 IonicContact OD2-NH2 3.19Å; D430-R434 PolarHBondContact OD2-NH2 3.46Å |
| 431 | C | 44.2 | Very low | 47.4 | Very low | 82 Ų | 82 | 103.3 Ų | 103.3 | 55% | 0.554 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -74.5 | -43 | 173 | -161.4 | 0 | 0 | 0 | 0 | 112 | L427 E428 R434 H435 | L427-C431 PolarHBondContact O-N 3.48Å; E428-C431 PolarHBondContact O-N 3.08Å; C431-R434 PolarHBondContact O-N 2.93Å; C431-H435 PolarHBondContact O-N 2.95Å |
| 432 | Q | 47.3 | Very low | 46.8 | Very low | 127 Ų | 127 | 99.9 Ų | 99.9 | 59% | 0.593 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -68.5 | -40.5 | 176.5 | -147.4 | 113 | -21 | 0 | 0 | 111.7 | E428 H435 I436 | E428-Q432 PolarHBondContact O-N 3.13Å; E428-Q432 VanDerWaalsContact O-N 3.09Å; Q432-H435 PolarHBondContact O-N 3.41Å; Q432-I436 HydrophobicContact CG-CD1 4.27Å; Q432-I436 VanDerWaalsContact O-CG1 3.31Å; Q432-I436 WeakPolarHBondContact O-CG1 3.34Å; Q432-I436 PolarHBondContact O-N 2.96Å |
| 433 | N | 43.6 | Very low | 46.6 | Very low | 85 Ų | 85 | 99.8 Ų | 99.8 | 46% | 0.455 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -71.4 | -33.1 | 177.5 | -75.6 | -29.9 | 0 | 0 | 0 | 112.3 | S429 A437 | S429-N433 WeakPolarHBondContact O-CB 3.37Å; S429-N433 PolarHBondContact O-N 2.97Å; S429-N433 PolarHBondContact O-ND2 3Å; S429-N433 VanDerWaalsContact O-ND2 3.13Å; S429-N433 PolarHBondContact OG-ND2 3.47Å; S429-N433 VanDerWaalsContact OG-ND2 3.13Å; N433-A437 WeakPolarHBondContact O-CA 3.45Å; N433-A437 WeakPolarHBondContact O-CB 3.48Å; N433-A437 PolarHBondContact O-N 3.47Å |
| 434 | R | 42.5 | Very low | 46 | Very low | 172 Ų | 172 | 97.6 Ų | 97.6 | 65% | 0.649 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -67.4 | -37.5 | 173.1 | -79.6 | 176.5 | -155.1 | -151.4 | 7.8 | 112.7 | D430 C431 A438 | D430-R434 VanDerWaalsContact O-CB 3.26Å; D430-R434 WeakPolarHBondContact O-CB 3.22Å; D430-R434 WeakPolarHBondContact O-CG 3.25Å; D430-R434 PolarHBondContact O-N 3Å; D430-R434 IonicContact OD2-CZ 2.82Å; D430-R434 IonicContact OD2-NE 2.66Å; D430-R434 PolarHBondContact OD2-NE 3.01Å; D430-R434 IonicContact OD2-NH2 3.19Å; D430-R434 PolarHBondContact OD2-NH2 3.46Å; C431-R434 PolarHBondContact O-N 2.93Å; R434-A438 WeakPolarHBondContact O-CB 3.32Å; R434-A438 PolarHBondContact O-N 3.34Å |
| 435 | H | 45.6 | Very low | 45.2 | Very low | 134 Ų | 134 | 96.4 Ų | 96.4 | 62% | 0.62 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -70.8 | -39.6 | 175.7 | -105.3 | -74.4 | 0 | 0 | 0 | 113 | C431 Q432 N439 | C431-H435 PolarHBondContact O-N 2.95Å; Q432-H435 PolarHBondContact O-N 3.41Å; H435-N439 PolarHBondContact O-N 2.85Å |
| 436 | I | 49.1 | Very low | 44.6 | Very low | 75 Ų | 75 | 96.7 Ų | 96.7 | 39% | 0.385 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -74.7 | -36.9 | 177.5 | -63.8 | 169.5 | 0 | 0 | 0 | 111.2 | Q432 R440 | Q432-I436 HydrophobicContact CG-CD1 4.27Å; Q432-I436 VanDerWaalsContact O-CG1 3.31Å; Q432-I436 WeakPolarHBondContact O-CG1 3.34Å; Q432-I436 PolarHBondContact O-N 2.96Å; I436-R440 HydrophobicContact CG2-CG 4.49Å; I436-R440 WeakPolarHBondContact O-CB 3.02Å; I436-R440 WeakPolarHBondContact O-CG 3.38Å; I436-R440 PolarHBondContact O-N 3.42Å |
| 437 | A | 45.3 | Very low | 44.1 | Very low | 56 Ų | 56 | 100.7 Ų | 100.7 | 46% | 0.463 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -72 | -34.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.4 | N433 A441 | N433-A437 WeakPolarHBondContact O-CA 3.45Å; N433-A437 WeakPolarHBondContact O-CB 3.48Å; N433-A437 PolarHBondContact O-N 3.47Å; A437-A441 WeakPolarHBondContact O-CA 3.27Å; A437-A441 WeakPolarHBondContact O-CB 3.46Å; A437-A441 PolarHBondContact O-N 2.87Å |
| 438 | A | 44.8 | Very low | 43.6 | Very low | 57 Ų | 57 | 98.2 Ų | 98.2 | 47% | 0.471 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.8 | -42.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | R434 A442 | R434-A438 WeakPolarHBondContact O-CB 3.32Å; R434-A438 PolarHBondContact O-N 3.34Å; A438-A442 WeakPolarHBondContact O-CB 3.36Å; A438-A442 PolarHBondContact O-N 2.67Å |
| 439 | N | 45.2 | Very low | 43 | Very low | 112 Ų | 112 | 97.1 Ų | 97.1 | 60% | 0.599 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -70.2 | -38.7 | 175.9 | -79.6 | -7.8 | 0 | 0 | 0 | 112.6 | H435 A442 E443 | H435-N439 PolarHBondContact O-N 2.85Å; N439-A442 PolarHBondContact O-N 3.2Å; N439-E443 PolarHBondContact O-N 2.87Å; N439-E443 VanDerWaalsContact O-N 3.11Å |
| 440 | R | 45.3 | Very low | 42.7 | Very low | 178 Ų | 178 | 99.8 Ų | 99.8 | 67% | 0.672 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -70.7 | -33.5 | 174.1 | -76.8 | -177.8 | -174.6 | 163.1 | 3.3 | 113 | I436 S444 | I436-R440 HydrophobicContact CG2-CG 4.49Å; I436-R440 WeakPolarHBondContact O-CB 3.02Å; I436-R440 WeakPolarHBondContact O-CG 3.38Å; I436-R440 PolarHBondContact O-N 3.42Å; R440-S444 WeakPolarHBondContact O-CB 3.37Å; R440-S444 PolarHBondContact O-N 2.93Å |
| 441 | A | 40.8 | Very low | 42.3 | Very low | 58 Ų | 58 | 104.1 Ų | 104.1 | 48% | 0.479 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -70.9 | -36.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | A437 S444 C445 | A437-A441 WeakPolarHBondContact O-CA 3.27Å; A437-A441 WeakPolarHBondContact O-CB 3.46Å; A437-A441 PolarHBondContact O-N 2.87Å; A441-S444 PolarHBondContact O-N 3.43Å; A441-C445 WeakPolarHBondContact O-CB 3.35Å; A441-C445 PolarHBondContact O-N 3.33Å |
| 442 | A | 41.2 | Very low | 42.1 | Very low | 58 Ų | 58 | 106.6 Ų | 106.6 | 48% | 0.479 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -66 | -43.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A438 N439 V446 | A438-A442 WeakPolarHBondContact O-CB 3.36Å; A438-A442 PolarHBondContact O-N 2.67Å; N439-A442 PolarHBondContact O-N 3.2Å; A442-V446 WeakPolarHBondContact O-CG2 3.21Å; A442-V446 PolarHBondContact O-N 2.81Å |
| 443 | E | 44 | Very low | 41.6 | Very low | 134 Ų | 134 | 104.8 Ų | 104.8 | 63% | 0.626 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -68.6 | -35.3 | 174.6 | -79.4 | -171 | 149.4 | 0 | 0 | 113.3 | N439 K447 | N439-E443 PolarHBondContact O-N 2.87Å; N439-E443 VanDerWaalsContact O-N 3.11Å; E443-K447 PolarHBondContact O-N 3.45Å; E443-K447 VanDerWaalsContact O-N 3.16Å |
| 444 | S | 38.4 | Very low | 41.1 | Very low | 66 Ų | 66 | 109.8 Ų | 109.8 | 46% | 0.462 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -71.5 | -37.7 | 176.8 | -172.7 | 0 | 0 | 0 | 0 | 111.9 | R440 A441 V446 K447 T448 | R440-S444 WeakPolarHBondContact O-CB 3.37Å; R440-S444 PolarHBondContact O-N 2.93Å; A441-S444 PolarHBondContact O-N 3.43Å; S444-V446 PolarHBondContact O-N 3.19Å; S444-K447 PolarHBondContact O-N 2.68Å; S444-T448 WeakPolarHBondContact O-CB 3.5Å; S444-T448 PolarHBondContact O-N 3.06Å; S444-T448 PolarHBondContact O-OG1 3.18Å |
| 445 | C | 33.9 | Very low | 40.6 | Very low | 83 Ų | 83 | 107.1 Ų | 107.1 | 56% | 0.561 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -61.9 | -44.8 | 176.3 | -166.1 | 0 | 0 | 0 | 0 | 110.7 | A441 K447 T448 T449 | A441-C445 WeakPolarHBondContact O-CB 3.35Å; A441-C445 PolarHBondContact O-N 3.33Å; C445-K447 PolarHBondContact O-N 3.3Å; C445-T448 PolarHBondContact O-N 3.46Å; C445-T449 PolarHBondContact O-N 3.02Å; C445-T449 PolarHBondContact O-OG1 2.84Å |
| 446 | V | 42.7 | Very low | 40 | Very low | 102 Ų | 102 | 106 Ų | 106 | 62% | 0.618 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -64.6 | -38.1 | 175.9 | 175.9 | 0 | 0 | 0 | 0 | 112.5 | A442 S444 | A442-V446 WeakPolarHBondContact O-CG2 3.21Å; A442-V446 PolarHBondContact O-N 2.81Å; S444-V446 PolarHBondContact O-N 3.19Å |
| 447 | K | 40.6 | Very low | 39 | Very low | 151 Ų | 151 | 110 Ų | 110 | 66% | 0.657 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -73.4 | -27.5 | 177.3 | -85.6 | 175.8 | 177.3 | 167.6 | 0 | 113.7 | E443 S444 C445 K451 | E443-K447 PolarHBondContact O-N 3.45Å; E443-K447 VanDerWaalsContact O-N 3.16Å; S444-K447 PolarHBondContact O-N 2.68Å; C445-K447 PolarHBondContact O-N 3.3Å; K447-K451 PolarHBondContact O-N 3.14Å |
| 448 | T | 38.5 | Very low | 38.3 | Very low | 65 Ų | 65 | 112.1 Ų | 112.1 | 40% | 0.399 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -81 | -34.6 | -176.7 | -50.6 | 0 | 0 | 0 | 0 | 111.5 | S444 C445 V450 K451 I452 | S444-T448 WeakPolarHBondContact O-CB 3.5Å; S444-T448 PolarHBondContact O-N 3.06Å; S444-T448 PolarHBondContact O-OG1 3.18Å; C445-T448 PolarHBondContact O-N 3.46Å; T448-V450 PolarHBondContact O-N 3.32Å; T448-K451 PolarHBondContact O-N 2.84Å; T448-K451 VanDerWaalsContact O-N 3.13Å; T448-I452 HydrophobicContact CG2-CD1 3.92Å; T448-I452 HydrophobicContact CG2-CG1 4.27Å; T448-I452 WeakPolarHBondContact O-CG1 3.47Å; T448-I452 PolarHBondContact O-N 2.99Å; T448-I452 VanDerWaalsContact O-N 3.16Å |
| 449 | T | 39.3 | Very low | 37.7 | Very low | 107 Ų | 107 | 115.7 Ų | 115.7 | 66% | 0.656 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -62.3 | -30 | 173.7 | -22 | 0 | 0 | 0 | 0 | 112.7 | C445 | C445-T449 PolarHBondContact O-N 3.02Å; C445-T449 PolarHBondContact O-OG1 2.84Å |
| 450 | V | 40 | Very low | 37.1 | Very low | 116 Ų | 116 | 115.4 Ų | 115.4 | 70% | 0.703 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -79.5 | -26.5 | 177 | -179.5 | 0 | 0 | 0 | 0 | 112.4 | T448 | T448-V450 PolarHBondContact O-N 3.32Å |
| 451 | K | 36.4 | Very low | 36.5 | Very low | 168 Ų | 168 | 113.6 Ų | 113.6 | 73% | 0.73 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -90.6 | -20.1 | -177.6 | -89 | -176.3 | 172.8 | -177.5 | 0 | 115.1 | K447 T448 A453 K454 | K447-K451 PolarHBondContact O-N 3.14Å; T448-K451 PolarHBondContact O-N 2.84Å; T448-K451 VanDerWaalsContact O-N 3.13Å; K451-A453 PolarHBondContact O-N 2.94Å; K451-A453 VanDerWaalsContact O-N 3.14Å; K451-K454 PolarHBondContact O-N 3.12Å |
| 452 | I | 39 | Very low | 36.1 | Very low | 134 Ų | 134 | 119.6 Ų | 119.6 | 69% | 0.687 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.3 | -10.6 | 178.6 | -69.1 | 164.6 | 0 | 0 | 0 | 112.7 | T448 K454 | T448-I452 HydrophobicContact CG2-CD1 3.92Å; T448-I452 HydrophobicContact CG2-CG1 4.27Å; T448-I452 WeakPolarHBondContact O-CG1 3.47Å; T448-I452 PolarHBondContact O-N 2.99Å; T448-I452 VanDerWaalsContact O-N 3.16Å; I452-K454 VanDerWaalsContact C-N 3.31Å; I452-K454 PolarHBondContact O-N 3.41Å |
| 453 | A | 37 | Very low | 35.8 | Very low | 89 Ų | 89 | 123.7 Ų | 123.7 | 74% | 0.736 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -0.4 | 172.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | K451 | K451-A453 PolarHBondContact O-N 2.94Å; K451-A453 VanDerWaalsContact O-N 3.14Å |
| 454 | K | 33.2 | Very low | 35.3 | Very low | 191 Ų | 191 | 122.9 Ų | 122.9 | 83% | 0.83 | 71% | 0.708 | S | S | * | * | trans | -130.6 | 78.6 | -177 | -145.3 | 171.8 | -175.9 | 175.2 | 0 | 113.3 | K451 I452 | K451-K454 PolarHBondContact O-N 3.12Å; I452-K454 VanDerWaalsContact C-N 3.31Å; I452-K454 PolarHBondContact O-N 3.41Å | ||
| 455 | V | 33.3 | Very low | 35.1 | Very low | 116 Ų | 116 | 124.6 Ų | 124.6 | 70% | 0.703 | 73% | 0.726 | S | S | * | * | trans | -26.9 | 143.8 | 149.5 | -151 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 456 | T | 32.4 | Very low | 35.1 | Very low | 111 Ų | 111 | 130 Ų | 130 | 68% | 0.681 | 74% | 0.743 | S | S | * | * | 176.6 | 133.1 | 58 | -38.9 | 0 | 0 | 0 | 0 | 109.6 | |||||
| 457 | M | 28.6 | Very low | 34.8 | Very low | 158 Ų | 158 | 129.6 Ų | 129.6 | 78% | 0.778 | 75% | 0.75 | S | S | * | * | trans | 50.9 | 128 | 138.9 | -59.6 | -173.3 | 77.1 | 0 | 0 | 125.4 | ||||
| 458 | S | 29.5 | Very low | 34.6 | Very low | 100 Ų | 100 | 133 Ų | 133 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | 72.1 | 144.8 | 128.4 | 68.1 | 0 | 0 | 0 | 0 | 119.4 | |||||
| 459 | V | 32.8 | Very low | 34.4 | Very low | 133 Ų | 133 | 136.4 Ų | 136.4 | 81% | 0.806 | 80% | 0.802 | S | S | * | * | cis | -159.2 | 147.4 | 1.1 | 130.4 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 460 | S | 32.1 | Very low | 34.2 | Very low | 105 Ų | 105 | 137.9 Ų | 137.9 | 73% | 0.734 | 81% | 0.81 | S | S | * | * | trans | -87.1 | 140.5 | 177 | 41.1 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 461 | T | 32.3 | Very low | 33.9 | Very low | 140 Ų | 140 | 139.2 Ų | 139.2 | 86% | 0.859 | 82% | 0.816 | S | S | * | * | trans | -156.3 | 107.3 | 144.6 | 42.2 | 0 | 0 | 0 | 0 | 110 | ||||
| 462 | E | 33 | Very low | 33.7 | Very low | 185 Ų | 185 | 137.5 Ų | 137.5 | 86% | 0.864 | 82% | 0.821 | S | S | * | * | trans | -86.1 | 139 | 154.7 | -75 | -179.8 | 152.8 | 0 | 0 | 108.4 | ||||
| 463 | T | 35 | Very low | 33.4 | Very low | 143 Ų | 143 | 137.7 Ų | 137.7 | 88% | 0.877 | 83% | 0.83 | S | S | * | * | trans | -142.6 | 117.7 | 147.7 | 37.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 464 | S | 33.3 | Very low | 33.1 | Very low | 117 Ų | 117 | 140.9 Ų | 140.9 | 82% | 0.818 | 84% | 0.836 | S | S | * | * | trans | -64 | 148.3 | 167.6 | -42.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 465 | A | 33.7 | Very low | 33.1 | Very low | 103 Ų | 103 | 137.4 Ų | 137.4 | 85% | 0.851 | 84% | 0.836 | S | S | * | * | 175.9 | 136.4 | 124 | 0 | 0 | 0 | 0 | 0 | 111.3 | |||||
| 466 | E | 35.1 | Very low | 33.1 | Very low | 197 Ų | 197 | 139 Ų | 139 | 92% | 0.921 | 85% | 0.846 | S | S | * | * | trans | -61.2 | 149.4 | 173.8 | -63.3 | 161 | 130.4 | 0 | 0 | 113.4 | ||||
| 467 | A | 36.4 | Very low | 33.2 | Very low | 93 Ų | 93 | 141.3 Ų | 141.3 | 77% | 0.769 | 86% | 0.86 | S | S | * | * | trans | -168.9 | 123.6 | 136.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 468 | V | 36.6 | Very low | 33.6 | Very low | 222 Ų | 222 | 139.8 Ų | 139.8 | 100% | 1.345 | 87% | 0.868 | S | S | * | * | trans | 81.9 | 0 | 167.8 | -167.5 | 0 | 0 | 0 | 0 | 117.9 |
Retrieved 468 of 468 residues in 2376 ms
(Link to these results)