| 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 | 38.5 | Very low | 35.5 | Very low | 146 Ų | 146 | 93.8 Ų | 93.8 | 72% | 0.719 | 47% | 0.469 | S | S | * | . | 0 | 139.6 | 0 | -176.1 | 164.1 | 67.4 | 0 | 0 | 107.7 | D5 F6 | M1-D5 HydrophobicContact CG-CB 3.74Å; M1-D5 HydrophobicContact SD-CB 4.47Å; M1-F6 HydrophobicContact CE-CB 4.46Å; M1-F6 HydrophobicContact CE-CD2 4.06Å | |||
| 2 | S | 32.1 | Very low | 35.5 | Very low | 66 Ų | 66 | 92.7 Ų | 92.7 | 46% | 0.462 | 46% | 0.459 | S | S | . | . | trans | -76.8 | 149.3 | 179.9 | -173.4 | 0 | 0 | 0 | 0 | 110.9 | A4 D5 F6 | S2-A4 PolarHBondContact O-N 2.88Å; S2-A4 PolarHBondContact OG-N 2.94Å; S2-D5 VanDerWaalsContact CB-OD2 3.27Å; S2-D5 WeakPolarHBondContact CB-OD2 3.21Å; S2-D5 PolarHBondContact N-OD2 2.98Å; S2-D5 WeakPolarHBondContact O-CB 3.41Å; S2-D5 PolarHBondContact O-N 3.19Å; S2-F6 PolarHBondContact O-N 3.42Å | ||
| 3 | E | 28.7 | Very low | 36 | Very low | 148 Ų | 148 | 88.8 Ų | 88.8 | 69% | 0.692 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -59.9 | -29.1 | 173.2 | -162.4 | 173 | 161.5 | 0 | 0 | 111.2 | F6 Q7 | E3-F6 PolarHBondContact O-N 2.85Å; E3-Q7 WeakPolarHBondContact O-CG 3.22Å; E3-Q7 PolarHBondContact O-N 3.37Å |
| 4 | A | 33.9 | Very low | 36 | Very low | 55 Ų | 55 | 90.4 Ų | 90.4 | 46% | 0.455 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -70 | -31.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 114 | S2 R8 | S2-A4 PolarHBondContact O-N 2.88Å; S2-A4 PolarHBondContact OG-N 2.94Å; A4-R8 WeakPolarHBondContact O-CB 3.38Å; A4-R8 WeakPolarHBondContact O-CG 3.48Å; A4-R8 PolarHBondContact O-N 2.73Å |
| 5 | D | 36.8 | Very low | 36.3 | Very low | 34 Ų | 34 | 90.3 Ų | 90.3 | 18% | 0.182 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -66.1 | -45.3 | 172.6 | -69.3 | -63.3 | 0 | 0 | 0 | 109.8 | M1 S2 R8 L9 | M1-D5 HydrophobicContact CG-CB 3.74Å; M1-D5 HydrophobicContact SD-CB 4.47Å; S2-D5 VanDerWaalsContact CB-OD2 3.27Å; S2-D5 WeakPolarHBondContact CB-OD2 3.21Å; S2-D5 PolarHBondContact N-OD2 2.98Å; S2-D5 WeakPolarHBondContact O-CB 3.41Å; S2-D5 PolarHBondContact O-N 3.19Å; D5-R8 PolarHBondContact O-N 3.34Å; D5-L9 PolarHBondContact O-N 3.04Å |
| 6 | F | 36.2 | Very low | 36.2 | Very low | 111 Ų | 111 | 91.4 Ų | 91.4 | 49% | 0.487 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -62.7 | -46.9 | 178.8 | -171.2 | -103.4 | 0 | 0 | 0 | 110.9 | M1 S2 E3 R8 L9 E10 | M1-F6 HydrophobicContact CE-CB 4.46Å; M1-F6 HydrophobicContact CE-CD2 4.06Å; S2-F6 PolarHBondContact O-N 3.42Å; E3-F6 PolarHBondContact O-N 2.85Å; F6-R8 VanDerWaalsContact C-N 3.33Å; F6-R8 PolarHBondContact O-N 2.9Å; F6-L9 WeakPolarHBondContact O-CB 3.46Å; F6-L9 PolarHBondContact O-N 3Å; F6-L9 VanDerWaalsContact O-N 3.15Å; F6-E10 WeakPolarHBondContact O-CB 3.46Å; F6-E10 PolarHBondContact O-N 3.07Å |
| 7 | Q | 34.6 | Very low | 36.2 | Very low | 108 Ų | 108 | 94.8 Ų | 94.8 | 51% | 0.505 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -62.6 | -33.6 | 173.9 | -72.6 | -179.7 | 7 | 0 | 0 | 113.5 | E3 M11 | E3-Q7 WeakPolarHBondContact O-CG 3.22Å; E3-Q7 PolarHBondContact O-N 3.37Å; Q7-M11 WeakPolarHBondContact O-CB 3.37Å; Q7-M11 WeakPolarHBondContact O-CG 3.49Å; Q7-M11 PolarHBondContact O-N 2.86Å |
| 8 | R | 38.3 | Very low | 35.9 | Very low | 119 Ų | 119 | 98.2 Ų | 98.2 | 45% | 0.449 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -68.6 | -37.7 | 172.5 | -82 | -173.5 | 176.1 | -115.9 | -3.3 | 112.1 | A4 D5 F6 M11 F12 D201 | A4-R8 WeakPolarHBondContact O-CB 3.38Å; A4-R8 WeakPolarHBondContact O-CG 3.48Å; A4-R8 PolarHBondContact O-N 2.73Å; D5-R8 PolarHBondContact O-N 3.34Å; F6-R8 VanDerWaalsContact C-N 3.33Å; F6-R8 PolarHBondContact O-N 2.9Å; R8-M11 HydrophobicContact CG-CE 4.33Å; R8-F12 PolarHBondContact O-N 2.89Å; R8-F12 VanDerWaalsContact O-N 3.08Å; R8-D201 IonicContact CZ-OD2 3.28Å; R8-D201 VanDerWaalsContact CZ-OD2 3.28Å; R8-D201 IonicContact NH1-OD2 2.82Å; R8-D201 PolarHBondContact NH1-OD2 3.2Å; R8-D201 IonicContact NH2-OD2 2.78Å; R8-D201 PolarHBondContact NH2-OD2 2.93Å |
| 9 | L | 37.5 | Very low | 35.7 | Very low | 77 Ų | 77 | 100.7 Ų | 100.7 | 40% | 0.403 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.5 | -47.1 | 173.6 | -136.5 | 79.7 | 0 | 0 | 0 | 111.2 | D5 F6 M11 F12 F13 Y301 | D5-L9 PolarHBondContact O-N 3.04Å; F6-L9 WeakPolarHBondContact O-CB 3.46Å; F6-L9 PolarHBondContact O-N 3Å; F6-L9 VanDerWaalsContact O-N 3.15Å; L9-M11 VanDerWaalsContact C-N 3.34Å; L9-M11 PolarHBondContact O-N 2.95Å; L9-F12 WeakPolarHBondContact O-CA 3.48Å; L9-F12 WeakPolarHBondContact O-CB 3.2Å; L9-F12 PolarHBondContact O-N 2.94Å; L9-F13 PolarHBondContact O-N 3.34Å; L9-Y301 HydrophobicContact CD2-CD1 3.98Å; L9-Y301 HydrophobicContact CD2-CE1 4.3Å |
| 10 | E | 37.8 | Very low | 35.9 | Very low | 89 Ų | 89 | 101.7 Ų | 101.7 | 42% | 0.416 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.2 | -38.8 | 179.1 | -161.2 | 64.7 | -161.3 | 0 | 0 | 111.4 | F6 F12 F13 Q14 | F6-E10 WeakPolarHBondContact O-CB 3.46Å; F6-E10 PolarHBondContact O-N 3.07Å; E10-F12 VanDerWaalsContact C-N 3.34Å; E10-F12 PolarHBondContact O-N 3.4Å; E10-F13 PolarHBondContact O-N 2.93Å; E10-Q14 WeakPolarHBondContact O-CB 3.43Å; E10-Q14 WeakPolarHBondContact O-CG 3.44Å; E10-Q14 PolarHBondContact O-N 3.38Å |
| 11 | M | 35.9 | Very low | 35.7 | Very low | 79 Ų | 79 | 101.7 Ų | 101.7 | 39% | 0.389 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.3 | -36.4 | 169.8 | -82.7 | -168.7 | -74.9 | 0 | 0 | 112.8 | Q7 R8 L9 F13 Q14 I15 | Q7-M11 WeakPolarHBondContact O-CB 3.37Å; Q7-M11 WeakPolarHBondContact O-CG 3.49Å; Q7-M11 PolarHBondContact O-N 2.86Å; R8-M11 HydrophobicContact CG-CE 4.33Å; L9-M11 VanDerWaalsContact C-N 3.34Å; L9-M11 PolarHBondContact O-N 2.95Å; M11-F13 VanDerWaalsContact C-N 3.32Å; M11-Q14 PolarHBondContact O-N 3.2Å; M11-I15 WeakPolarHBondContact O-CB 3.2Å; M11-I15 WeakPolarHBondContact O-CD1 3.39Å; M11-I15 VanDerWaalsContact O-CG1 3.22Å; M11-I15 WeakPolarHBondContact O-CG1 3.45Å; M11-I15 PolarHBondContact O-N 3.17Å |
| 12 | F | 36.3 | Very low | 35.2 | Very low | 80 Ų | 80 | 101.2 Ų | 101.2 | 35% | 0.351 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.9 | -41.6 | 174.1 | -126.8 | -89.2 | 0 | 0 | 0 | 111.2 | R8 L9 E10 I15 L16 V196 L205 | R8-F12 PolarHBondContact O-N 2.89Å; R8-F12 VanDerWaalsContact O-N 3.08Å; L9-F12 WeakPolarHBondContact O-CA 3.48Å; L9-F12 WeakPolarHBondContact O-CB 3.2Å; L9-F12 PolarHBondContact O-N 2.94Å; E10-F12 VanDerWaalsContact C-N 3.34Å; E10-F12 PolarHBondContact O-N 3.4Å; F12-I15 PolarHBondContact O-N 3.17Å; F12-L16 WeakPolarHBondContact O-CG 3.49Å; F12-L16 PolarHBondContact O-N 3.34Å; F12-V196 HydrophobicContact CD2-CG1 4.18Å; F12-V196 HydrophobicContact CE2-CG1 4.17Å; F12-V196 HydrophobicContact CE2-CG2 4.49Å; F12-L205 HydrophobicContact CE1-CD1 4.31Å; F12-L205 HydrophobicContact CZ-CD1 3.99Å |
| 13 | F | 41.5 | Very low | 35 | Very low | 43 Ų | 43 | 105.7 Ų | 105.7 | 19% | 0.189 | 55% | 0.546 | C | S | . | . | H | α-helix | trans | -69.4 | -42 | 174.2 | -87.2 | -89.3 | 0 | 0 | 0 | 112.8 | L9 E10 M11 I15 L16 H17 I296 Y301 | L9-F13 PolarHBondContact O-N 3.34Å; E10-F13 PolarHBondContact O-N 2.93Å; M11-F13 VanDerWaalsContact C-N 3.32Å; F13-I15 VanDerWaalsContact C-N 3.3Å; F13-I15 PolarHBondContact O-N 3.12Å; F13-L16 CarbonylContact O-C 3.56Å; F13-L16 WeakPolarHBondContact O-CB 3.22Å; F13-L16 PolarHBondContact O-N 3.19Å; F13-L16 VanDerWaalsContact O-N 3.1Å; F13-H17 VanDerWaalsContact O-CB 3.29Å; F13-H17 WeakPolarHBondContact O-CB 3.36Å; F13-H17 PolarHBondContact O-N 3.13Å; F13-I296 HydrophobicContact CE1-CD1 3.97Å; F13-I296 HydrophobicContact CE1-CG2 4.39Å; F13-Y301 HydrophobicContact CD2-CE1 4.19Å; F13-Y301 HydrophobicContact CE2-CD1 4.23Å; F13-Y301 AromaticContact CE2-CE1 3.39Å; F13-Y301 HydrophobicContact CE2-CE1 3.39Å; F13-Y301 HydrophobicContact CZ-CD1 4.46Å; F13-Y301 AromaticContact CZ-CE1 3.59Å; F13-Y301 HydrophobicContact CZ-CE1 3.59Å; F13-Y301 AromaticContact CZ-CZ 3.84Å |
| 14 | Q | 36.2 | Very low | 35.3 | Very low | 110 Ų | 110 | 106.8 Ų | 106.8 | 51% | 0.514 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -59.7 | -38.3 | 172.8 | -74.7 | -73.5 | -29.5 | 0 | 0 | 112.3 | E10 M11 L16 H17 K18 | E10-Q14 WeakPolarHBondContact O-CB 3.43Å; E10-Q14 WeakPolarHBondContact O-CG 3.44Å; E10-Q14 PolarHBondContact O-N 3.38Å; M11-Q14 PolarHBondContact O-N 3.2Å; Q14-L16 VanDerWaalsContact C-N 3.31Å; Q14-L16 PolarHBondContact O-N 3.4Å; Q14-H17 PolarHBondContact O-N 3.23Å; Q14-K18 WeakPolarHBondContact O-CB 3.48Å; Q14-K18 PolarHBondContact O-N 2.99Å; Q14-K18 VanDerWaalsContact O-N 3.08Å |
| 15 | I | 40.2 | Very low | 35 | Very low | 89 Ų | 89 | 109.8 Ų | 109.8 | 46% | 0.456 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -66.3 | -33.8 | 175.7 | -71.9 | 164.7 | 0 | 0 | 0 | 111.7 | M11 F12 F13 V196 | M11-I15 WeakPolarHBondContact O-CB 3.2Å; M11-I15 WeakPolarHBondContact O-CD1 3.39Å; M11-I15 VanDerWaalsContact O-CG1 3.22Å; M11-I15 WeakPolarHBondContact O-CG1 3.45Å; M11-I15 PolarHBondContact O-N 3.17Å; F12-I15 PolarHBondContact O-N 3.17Å; F13-I15 VanDerWaalsContact C-N 3.3Å; F13-I15 PolarHBondContact O-N 3.12Å; I15-V196 HydrophobicContact CD1-CG1 4.31Å |
| 16 | L | 34.5 | Very low | 34.9 | Very low | 108 Ų | 108 | 115.6 Ų | 115.6 | 57% | 0.565 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -74 | -37.8 | 174.4 | -72.1 | 167.2 | 0 | 0 | 0 | 112.9 | F12 F13 Q14 | F12-L16 WeakPolarHBondContact O-CG 3.49Å; F12-L16 PolarHBondContact O-N 3.34Å; F13-L16 CarbonylContact O-C 3.56Å; F13-L16 WeakPolarHBondContact O-CB 3.22Å; F13-L16 PolarHBondContact O-N 3.19Å; F13-L16 VanDerWaalsContact O-N 3.1Å; Q14-L16 VanDerWaalsContact C-N 3.31Å; Q14-L16 PolarHBondContact O-N 3.4Å |
| 17 | H | 36.5 | Very low | 34.4 | Very low | 150 Ų | 150 | 117.6 Ų | 117.6 | 69% | 0.694 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -117.1 | 11.4 | -161 | -149.5 | -95.2 | 0 | 0 | 0 | 115.3 | F13 Q14 D19 | F13-H17 VanDerWaalsContact O-CB 3.29Å; F13-H17 WeakPolarHBondContact O-CB 3.36Å; F13-H17 PolarHBondContact O-N 3.13Å; Q14-H17 PolarHBondContact O-N 3.23Å; H17-D19 PolarHBondContact O-N 3.33Å |
| 18 | K | 31.3 | Very low | 34 | Very low | 156 Ų | 156 | 117.7 Ų | 117.7 | 68% | 0.678 | 62% | 0.617 | S | S | * | * | trans | -76.7 | 91.1 | 179.3 | -173.4 | 166.1 | -170.7 | 167.5 | 0 | 112.6 | Q14 | Q14-K18 WeakPolarHBondContact O-CB 3.48Å; Q14-K18 PolarHBondContact O-N 2.99Å; Q14-K18 VanDerWaalsContact O-N 3.08Å | ||
| 19 | D | 31.6 | Very low | 33.4 | Very low | 145 Ų | 145 | 121.1 Ų | 121.1 | 78% | 0.775 | 64% | 0.636 | S | S | * | * | trans | -112.1 | 129.3 | 166 | -136.5 | -4.6 | 0 | 0 | 0 | 110 | H17 S21 | H17-D19 PolarHBondContact O-N 3.33Å; D19-S21 PolarHBondContact O-N 2.83Å | ||
| 20 | P | 39.8 | Very low | 32.9 | Very low | 120 Ų | 120 | 125.8 Ų | 125.8 | 78% | 0.779 | 66% | 0.655 | S | S | * | * | trans | -96.2 | 37.7 | -166.5 | 38.9 | -37.1 | 0 | 0 | 0 | 114.8 | ||||
| 21 | S | 31.3 | Very low | 32.3 | Very low | 102 Ų | 102 | 126.5 Ų | 126.5 | 71% | 0.713 | 66% | 0.662 | S | S | * | * | trans | -160.8 | 113.7 | 169.7 | 60.3 | 0 | 0 | 0 | 0 | 115 | D19 | D19-S21 PolarHBondContact O-N 2.83Š| ||
| 22 | C | 28.6 | Very low | 31.9 | Very low | 136 Ų | 136 | 128.3 Ų | 128.3 | 92% | 0.919 | 68% | 0.678 | S | S | * | * | trans | -162.6 | 134.5 | 135.3 | -130.5 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 23 | N | 28.2 | Very low | 31.4 | Very low | 161 Ų | 161 | 127.6 Ų | 127.6 | 86% | 0.861 | 68% | 0.682 | S | S | * | * | trans | -91.3 | 122.2 | -179.8 | -94.2 | -22.1 | 0 | 0 | 0 | 111.7 | ||||
| 24 | H | 34.9 | Very low | 30.7 | Very low | 171 Ų | 171 | 133.7 Ų | 133.7 | 79% | 0.792 | 71% | 0.713 | S | S | * | * | trans | 51.7 | 83.9 | 137.4 | -151.6 | -60.2 | 0 | 0 | 0 | 118.8 | ||||
| 25 | S | 26.8 | Very low | 30.5 | Very low | 118 Ų | 118 | 134.7 Ų | 134.7 | 83% | 0.825 | 73% | 0.727 | S | S | * | * | trans | -138.8 | 142.3 | 152.7 | 57.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 26 | H | 35.2 | Very low | 30 | Very low | 156 Ų | 156 | 139.1 Ų | 139.1 | 72% | 0.722 | 74% | 0.739 | S | S | * | * | trans | -73 | 123.1 | -165.3 | -132.8 | -112.1 | 0 | 0 | 0 | 112.1 | ||||
| 27 | L | 24.9 | Very low | 29.5 | Very low | 153 Ų | 153 | 141.1 Ų | 141.1 | 80% | 0.801 | 75% | 0.75 | S | S | * | * | trans | -141.9 | 75.2 | 167.8 | -113.2 | 164.6 | 0 | 0 | 0 | 110.7 | F29 | L27-F29 PolarHBondContact O-N 2.96Š| ||
| 28 | T | 27.7 | Very low | 29.3 | Very low | 109 Ų | 109 | 140.5 Ų | 140.5 | 67% | 0.669 | 75% | 0.751 | S | S | * | * | trans | -70 | 94.6 | 176.9 | 39.7 | 0 | 0 | 0 | 0 | 111.4 | H30 | T28-H30 PolarHBondContact O-N 3.44Š| ||
| 29 | F | 25.1 | Very low | 29.3 | Very low | 191 Ų | 191 | 140.9 Ų | 140.9 | 84% | 0.838 | 76% | 0.761 | S | S | * | * | trans | -84.8 | 88.6 | 172.6 | -126.3 | -82.2 | 0 | 0 | 0 | 111.4 | L27 N31 | L27-F29 PolarHBondContact O-N 2.96Å; F29-N31 PolarHBondContact O-N 3.42Å | ||
| 30 | H | 26 | Very low | 29.8 | Very low | 176 Ų | 176 | 141.1 Ų | 141.1 | 82% | 0.815 | 76% | 0.755 | S | S | * | * | trans | -69.7 | 114.8 | 168 | -117.1 | -91 | 0 | 0 | 0 | 109.6 | T28 | T28-H30 PolarHBondContact O-N 3.44Š| ||
| 31 | N | 25.1 | Very low | 29.6 | Very low | 103 Ų | 103 | 140.2 Ų | 140.2 | 55% | 0.551 | 75% | 0.75 | S | S | * | * | 160.4 | 64.5 | 120.3 | -167.4 | 13.2 | 0 | 0 | 0 | 112.6 | F29 S33 | F29-N31 PolarHBondContact O-N 3.42Å; N31-S33 PolarHBondContact O-N 3Å; N31-S33 WeakPolarHBondContact OD1-CB 3.45Å; N31-S33 PolarHBondContact OD1-OG 2.73Å | |||
| 32 | T | 28.5 | Very low | 30.1 | Very low | 118 Ų | 118 | 137.3 Ų | 137.3 | 72% | 0.724 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | 31.8 | -177.4 | -27.5 | 0 | 0 | 0 | 0 | 114.3 | Y36 | T32-Y36 WeakPolarHBondContact O-CE2 3.28Š|
| 33 | S | 26 | Very low | 30.9 | Very low | 64 Ų | 64 | 135.8 Ų | 135.8 | 45% | 0.448 | 72% | 0.718 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -103.9 | -24.4 | -167.9 | 66.2 | 0 | 0 | 0 | 0 | 115.7 | N31 V35 | N31-S33 PolarHBondContact O-N 3Å; N31-S33 WeakPolarHBondContact OD1-CB 3.45Å; N31-S33 PolarHBondContact OD1-OG 2.73Å; S33-V35 PolarHBondContact O-N 3.11Å |
| 34 | M | 26.2 | Very low | 32.1 | Very low | 171 Ų | 171 | 129.9 Ų | 129.9 | 84% | 0.842 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | 4.4 | -173.5 | -73.5 | -158.6 | 178.2 | 0 | 0 | 115.8 | ||
| 35 | V | 33.2 | Very low | 33.7 | Very low | 131 Ų | 131 | 123 Ų | 123 | 79% | 0.794 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.9 | 1.5 | -176.5 | -164.3 | 0 | 0 | 0 | 0 | 112.7 | S33 N37 | S33-V35 PolarHBondContact O-N 3.11Å; V35-N37 PolarHBondContact O-N 3.43Å |
| 36 | Y | 28 | Very low | 35.9 | Very low | 183 Ų | 183 | 122.1 Ų | 122.1 | 72% | 0.718 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -88.1 | 8.3 | -173.4 | -78.8 | -74 | 0 | 0 | 0 | 116.4 | T32 | T32-Y36 WeakPolarHBondContact O-CE2 3.28Š|
| 37 | N | 25.1 | Very low | 37.9 | Very low | 150 Ų | 150 | 123 Ų | 123 | 80% | 0.802 | 65% | 0.646 | S | S | * | * | trans | -129.5 | 43.1 | -174.8 | -76.7 | -78.3 | 0 | 0 | 0 | 113.9 | V35 | V35-N37 PolarHBondContact O-N 3.43Š| ||
| 38 | L | 32.7 | Very low | 40.3 | Very low | 136 Ų | 136 | 117.6 Ų | 117.6 | 71% | 0.712 | 62% | 0.618 | S | S | * | * | trans | -132.7 | 74 | 164.8 | -83.1 | 172.4 | 0 | 0 | 0 | 110 | F40 | L38-F40 HydrophobicContact CB-CD2 4.15Å; L38-F40 HydrophobicContact CB-CE2 3.98Å; L38-F40 HydrophobicContact CD1-CE2 4.33Å; L38-F40 HydrophobicContact CD2-CE2 3.9Å; L38-F40 HydrophobicContact CD2-CZ 4.26Å; L38-F40 HydrophobicContact CG-CE2 4.3Å; L38-F40 PolarHBondContact O-N 2.99Å | ||
| 39 | D | 30.7 | Very low | 42.8 | Very low | 165 Ų | 165 | 114.5 Ų | 114.5 | 88% | 0.882 | 59% | 0.594 | S | S | * | * | trans | -63.4 | 92.7 | 169.7 | -87.1 | -40.9 | 0 | 0 | 0 | 110.7 | ||||
| 40 | F | 42.3 | Very low | 45.5 | Very low | 149 Ų | 149 | 107.5 Ų | 107.5 | 65% | 0.654 | 57% | 0.571 | S | S | * | * | trans | -96.3 | 127.5 | 164.8 | -74.2 | -72.8 | 0 | 0 | 0 | 109.7 | L38 | L38-F40 HydrophobicContact CB-CD2 4.15Å; L38-F40 HydrophobicContact CB-CE2 3.98Å; L38-F40 HydrophobicContact CD1-CE2 4.33Å; L38-F40 HydrophobicContact CD2-CE2 3.9Å; L38-F40 HydrophobicContact CD2-CZ 4.26Å; L38-F40 HydrophobicContact CG-CE2 4.3Å; L38-F40 PolarHBondContact O-N 2.99Å | ||
| 41 | P | 35.1 | Very low | 48.3 | Very low | 102 Ų | 102 | 104.2 Ų | 104.2 | 66% | 0.662 | 56% | 0.558 | S | S | * | * | trans | -61.8 | 145.3 | -170.5 | 24.1 | -34.3 | 0 | 0 | 0 | 112.5 | D43 G44 | P41-D43 PolarHBondContact O-N 2.63Å; P41-D43 VanDerWaalsContact O-N 3.1Å; P41-G44 PolarHBondContact O-N 2.88Å | ||
| 42 | G | 41.9 | Very low | 51 | Low | 40 Ų | 40 | 99.5 Ų | 99.5 | 41% | 0.412 | 53% | 0.533 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.6 | -31 | -171.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | G44 | G42-G44 VanDerWaalsContact C-N 3.29Å; G42-G44 PolarHBondContact O-N 3.5Å |
| 43 | D | 45 | Very low | 53.7 | Low | 105 Ų | 105 | 94.7 Ų | 94.7 | 56% | 0.561 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.1 | -13.1 | -172.4 | -47.5 | -38.3 | 0 | 0 | 0 | 114.2 | P41 S45 H46 W47 | P41-D43 PolarHBondContact O-N 2.63Å; P41-D43 VanDerWaalsContact O-N 3.1Å; D43-S45 PolarHBondContact O-N 2.95Å; D43-S45 VanDerWaalsContact O-N 3.1Å; D43-H46 PolarHBondContact O-N 2.83Å; D43-H46 VanDerWaalsContact O-N 3.16Å; D43-W47 VanDerWaalsContact O-CD1 3.23Å; D43-W47 PolarHBondContact O-N 3.26Å |
| 44 | G | 53 | Low | 56.7 | Low | 36 Ų | 36 | 96.6 Ų | 96.6 | 37% | 0.371 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.6 | -28 | -170.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | P41 G42 L48 | P41-G44 PolarHBondContact O-N 2.88Å; G42-G44 VanDerWaalsContact C-N 3.29Å; G42-G44 PolarHBondContact O-N 3.5Å; G44-L48 WeakPolarHBondContact O-CB 3.49Å; G44-L48 PolarHBondContact O-N 2.89Å |
| 45 | S | 68.6 | Low | 59.6 | Low | 27 Ų | 27 | 91 Ų | 91 | 19% | 0.189 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -65.7 | -50.6 | 175.9 | 50.9 | 0 | 0 | 0 | 0 | 112.3 | D43 L48 R49 | D43-S45 PolarHBondContact O-N 2.95Å; D43-S45 VanDerWaalsContact O-N 3.1Å; S45-L48 PolarHBondContact O-N 3.18Å; S45-R49 WeakPolarHBondContact O-CG 3.38Å; S45-R49 PolarHBondContact O-N 3.25Å |
| 46 | H | 72.8 | Confident | 62.3 | Low | 99 Ų | 99 | 84.8 Ų | 84.8 | 46% | 0.458 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -71.7 | -41.4 | -175.8 | -64.9 | -72.7 | 0 | 0 | 0 | 112.1 | D43 L48 R49 A50 D113 | D43-H46 PolarHBondContact O-N 2.83Å; D43-H46 VanDerWaalsContact O-N 3.16Å; H46-L48 VanDerWaalsContact C-N 3.32Å; H46-L48 PolarHBondContact O-N 3.19Å; H46-R49 PolarHBondContact O-N 2.91Å; H46-A50 WeakPolarHBondContact O-CB 3.3Å; H46-A50 PolarHBondContact O-N 2.88Å; H46-D113 IonicContact CE1-OD2 3.78Å |
| 47 | W | 77.3 | Confident | 65.2 | Low | 176 Ų | 176 | 78.8 Ų | 78.8 | 67% | 0.667 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -61.8 | -39.8 | 174.5 | -69 | 113.2 | 0 | 0 | 0 | 112 | D43 A50 I51 | D43-W47 VanDerWaalsContact O-CD1 3.23Å; D43-W47 PolarHBondContact O-N 3.26Å; W47-A50 PolarHBondContact O-N 3.06Å; W47-I51 WeakPolarHBondContact O-CD1 3.44Å; W47-I51 VanDerWaalsContact O-CG1 3.26Å; W47-I51 WeakPolarHBondContact O-CG1 3.36Å; W47-I51 PolarHBondContact O-N 2.96Å |
| 48 | L | 77.1 | Confident | 68.3 | Low | 39 Ų | 39 | 74.5 Ų | 74.5 | 20% | 0.204 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -63.9 | -47.6 | 175.5 | -179.8 | 64.4 | 0 | 0 | 0 | 111.9 | G44 S45 H46 A50 I51 I52 Y306 | G44-L48 WeakPolarHBondContact O-CB 3.49Å; G44-L48 PolarHBondContact O-N 2.89Å; S45-L48 PolarHBondContact O-N 3.18Å; H46-L48 VanDerWaalsContact C-N 3.32Å; H46-L48 PolarHBondContact O-N 3.19Å; L48-A50 VanDerWaalsContact C-N 3.31Å; L48-A50 PolarHBondContact O-N 2.92Å; L48-I51 PolarHBondContact O-N 2.88Å; L48-I52 HydrophobicContact CD1-CD1 4.06Å; L48-I52 HydrophobicContact CD1-CG1 4.43Å; L48-I52 HydrophobicContact CG-CD1 3.82Å; L48-I52 WeakPolarHBondContact O-CD1 3.25Å; L48-I52 VanDerWaalsContact O-CG1 3.29Å; L48-I52 WeakPolarHBondContact O-CG1 3.47Å; L48-I52 PolarHBondContact O-N 3.42Å; L48-Y306 HydrophobicContact CD2-CD1 3.51Å; L48-Y306 HydrophobicContact CD2-CE1 3.74Å |
| 49 | R | 78.5 | Confident | 71 | Confident | 44 Ų | 44 | 68.7 Ų | 68.7 | 17% | 0.166 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -57.6 | -43.3 | 176 | -70.9 | 172.4 | -167.1 | 148.6 | 5.1 | 111.4 | S45 H46 I52 S53 I110 D113 | S45-R49 WeakPolarHBondContact O-CG 3.38Å; S45-R49 PolarHBondContact O-N 3.25Å; H46-R49 PolarHBondContact O-N 2.91Å; R49-I52 PolarHBondContact O-N 3.49Å; R49-S53 WeakPolarHBondContact O-CB 3.45Å; R49-S53 PolarHBondContact O-N 2.69Å; R49-I110 HydrophobicContact CB-CG2 4.12Å; R49-I110 HydrophobicContact CG-CG2 4.28Å; R49-D113 WeakPolarHBondContact CD-OD1 3.35Å; R49-D113 IonicContact CZ-OD1 3.28Å; R49-D113 VanDerWaalsContact CZ-OD1 3.28Å; R49-D113 IonicContact CZ-OD2 3.96Å; R49-D113 IonicContact NE-OD1 3.39Å; R49-D113 PolarHBondContact NE-OD1 3.4Å; R49-D113 IonicContact NH1-OD1 2.7Å; R49-D113 PolarHBondContact NH1-OD1 2.93Å; R49-D113 IonicContact NH1-OD2 3Å; R49-D113 PolarHBondContact NH1-OD2 2.96Å |
| 50 | A | 82.1 | Confident | 73.8 | Confident | 44 Ų | 44 | 61.2 Ų | 61.2 | 36% | 0.364 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | H46 W47 L48 I52 S53 V54 | H46-A50 WeakPolarHBondContact O-CB 3.3Å; H46-A50 PolarHBondContact O-N 2.88Å; W47-A50 PolarHBondContact O-N 3.06Å; L48-A50 VanDerWaalsContact C-N 3.31Å; L48-A50 PolarHBondContact O-N 2.92Å; A50-I52 PolarHBondContact O-N 3.41Å; A50-S53 PolarHBondContact O-N 2.91Å; A50-V54 WeakPolarHBondContact O-CG2 3.21Å; A50-V54 PolarHBondContact O-N 3.48Å |
| 51 | I | 84.6 | Confident | 76.2 | Confident | 106 Ų | 106 | 57.9 Ų | 57.9 | 54% | 0.544 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.4 | -44.2 | 176.9 | -70.6 | 163.6 | 0 | 0 | 0 | 111.1 | W47 L48 S53 V54 V55 | W47-I51 WeakPolarHBondContact O-CD1 3.44Å; W47-I51 VanDerWaalsContact O-CG1 3.26Å; W47-I51 WeakPolarHBondContact O-CG1 3.36Å; W47-I51 PolarHBondContact O-N 2.96Å; L48-I51 PolarHBondContact O-N 2.88Å; I51-S53 PolarHBondContact O-N 3.02Å; I51-V54 PolarHBondContact O-N 3.1Å; I51-V55 WeakPolarHBondContact O-CG2 3.36Å; I51-V55 PolarHBondContact O-N 3.01Å |
| 52 | I | 82.3 | Confident | 78.8 | Confident | 5 Ų | 5 | 54.6 Ų | 54.6 | 3% | 0.026 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -62.3 | -43.8 | 177.9 | -66.1 | 156.6 | 0 | 0 | 0 | 111 | L48 R49 A50 V55 Y56 I110 P309 | L48-I52 HydrophobicContact CD1-CD1 4.06Å; L48-I52 HydrophobicContact CD1-CG1 4.43Å; L48-I52 HydrophobicContact CG-CD1 3.82Å; L48-I52 WeakPolarHBondContact O-CD1 3.25Å; L48-I52 VanDerWaalsContact O-CG1 3.29Å; L48-I52 WeakPolarHBondContact O-CG1 3.47Å; L48-I52 PolarHBondContact O-N 3.42Å; R49-I52 PolarHBondContact O-N 3.49Å; A50-I52 PolarHBondContact O-N 3.41Å; I52-V55 WeakPolarHBondContact O-CB 3.23Å; I52-V55 PolarHBondContact O-N 3.35Å; I52-Y56 HydrophobicContact CG2-CD1 4.24Å; I52-Y56 HydrophobicContact CG2-CE1 3.79Å; I52-Y56 HydrophobicContact CG2-CE2 4.42Å; I52-Y56 WeakPolarHBondContact O-CD1 3.4Å; I52-Y56 PolarHBondContact O-N 3.19Å; I52-I110 HydrophobicContact CB-CG2 4.28Å; I52-I110 HydrophobicContact CG2-CD1 3.67Å; I52-I110 HydrophobicContact CG2-CG2 4.12Å; I52-P309 HydrophobicContact CD1-CB 3.53Å; I52-P309 HydrophobicContact CD1-CG 4.3Å; I52-P309 HydrophobicContact CG1-CB 4.32Å |
| 53 | S | 85.2 | Confident | 81 | Confident | 17 Ų | 17 | 52.7 Ų | 52.7 | 12% | 0.119 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -63.8 | -42.6 | 177.7 | -169.6 | 0 | 0 | 0 | 0 | 112.4 | R49 A50 I51 V55 Y56 C57 A107 T111 | R49-S53 WeakPolarHBondContact O-CB 3.45Å; R49-S53 PolarHBondContact O-N 2.69Å; A50-S53 PolarHBondContact O-N 2.91Å; I51-S53 PolarHBondContact O-N 3.02Å; S53-V55 VanDerWaalsContact C-N 3.32Å; S53-V55 PolarHBondContact O-N 3.31Å; S53-Y56 PolarHBondContact O-N 2.87Å; S53-C57 PolarHBondContact O-N 3.21Å; S53-C57 PolarHBondContact O-SG 3.12Å; S53-A107 PolarHBondContact OG-O 3.43Å; S53-T111 VanDerWaalsContact CB-CG2 3.44Å; S53-T111 VanDerWaalsContact OG-CG2 3.29Å; S53-T111 WeakPolarHBondContact OG-CG2 3.31Å |
| 54 | V | 88.6 | Confident | 83.2 | Confident | 103 Ų | 103 | 50.6 Ų | 50.6 | 62% | 0.624 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -59.6 | -41.9 | 172.4 | 169 | 0 | 0 | 0 | 0 | 111.3 | A50 I51 C57 A58 | A50-V54 WeakPolarHBondContact O-CG2 3.21Å; A50-V54 PolarHBondContact O-N 3.48Å; I51-V54 PolarHBondContact O-N 3.1Å; V54-C57 PolarHBondContact O-N 3.22Å; V54-A58 WeakPolarHBondContact O-CB 3.26Å; V54-A58 PolarHBondContact O-N 2.99Å |
| 55 | V | 88.6 | Confident | 85 | Confident | 53 Ų | 53 | 54.3 Ų | 54.3 | 32% | 0.321 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -63.2 | -42.8 | 174.6 | 168.9 | 0 | 0 | 0 | 0 | 111.4 | I51 I52 S53 A58 V59 C313 | I51-V55 WeakPolarHBondContact O-CG2 3.36Å; I51-V55 PolarHBondContact O-N 3.01Å; I52-V55 WeakPolarHBondContact O-CB 3.23Å; I52-V55 PolarHBondContact O-N 3.35Å; S53-V55 VanDerWaalsContact C-N 3.32Å; S53-V55 PolarHBondContact O-N 3.31Å; V55-A58 PolarHBondContact O-N 3.45Å; V55-V59 HydrophobicContact CG1-CG2 4.31Å; V55-V59 WeakPolarHBondContact O-CB 3.46Å; V55-V59 VanDerWaalsContact O-CG2 3.3Å; V55-V59 WeakPolarHBondContact O-CG2 3.23Å; V55-V59 PolarHBondContact O-N 2.88Å; V55-C313 HydrophobicContact CG1-CB 4.02Å |
| 56 | Y | 87.9 | Confident | 86 | Confident | 2 Ų | 2 | 53.7 Ų | 53.7 | 1% | 0.008 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 177.5 | -76.1 | 15.1 | 0 | 0 | 0 | 111.7 | I52 S53 V59 A60 W106 A107 I110 N312 C313 F316 | I52-Y56 HydrophobicContact CG2-CD1 4.24Å; I52-Y56 HydrophobicContact CG2-CE1 3.79Å; I52-Y56 HydrophobicContact CG2-CE2 4.42Å; I52-Y56 WeakPolarHBondContact O-CD1 3.4Å; I52-Y56 PolarHBondContact O-N 3.19Å; S53-Y56 PolarHBondContact O-N 2.87Å; Y56-V59 PolarHBondContact O-N 3.43Å; Y56-A60 WeakPolarHBondContact O-CB 3.24Å; Y56-A60 PolarHBondContact O-N 3.33Å; Y56-W106 HydrophobicContact CD2-CB 3.88Å; Y56-W106 HydrophobicContact CE2-CB 3.83Å; Y56-A107 HydrophobicContact CD2-CB 4.33Å; Y56-I110 HydrophobicContact CD2-CD1 4.26Å; Y56-I110 HydrophobicContact CE2-CD1 3.4Å; Y56-I110 VanDerWaalsContact CE2-CD1 3.4Å; Y56-N312 PolarHBondContact OH-ND2 2.97Å; Y56-C313 HydrophobicContact CE1-CB 4.24Å; Y56-C313 VanDerWaalsContact CE1-SG 3.53Å; Y56-F316 HydrophobicContact CD1-CD2 4.21Å; Y56-F316 HydrophobicContact CD2-CD2 4.47Å; Y56-F316 HydrophobicContact CD2-CE2 4.36Å; Y56-F316 AromaticContact CE1-CD2 3.81Å; Y56-F316 HydrophobicContact CE1-CD2 3.81Å; Y56-F316 HydrophobicContact CE1-CE2 4.19Å; Y56-F316 HydrophobicContact CE2-CD2 4.09Å; Y56-F316 AromaticContact CE2-CE2 3.73Å; Y56-F316 HydrophobicContact CE2-CE2 3.73Å; Y56-F316 AromaticContact CZ-CD2 3.78Å; Y56-F316 AromaticContact CZ-CE2 3.67Å |
| 57 | C | 89.3 | Confident | 86.8 | Confident | 57 Ų | 57 | 49 Ų | 49 | 39% | 0.385 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -64.8 | -37.6 | 175.1 | -72 | 0 | 0 | 0 | 0 | 112.7 | S53 V54 T61 | S53-C57 PolarHBondContact O-N 3.21Å; S53-C57 PolarHBondContact O-SG 3.12Å; V54-C57 PolarHBondContact O-N 3.22Å; C57-T61 WeakPolarHBondContact O-CB 3.07Å; C57-T61 PolarHBondContact O-N 3.5Å; C57-T61 PolarHBondContact O-OG1 2.99Å |
| 58 | A | 90.3 | Very high | 87.4 | Confident | 60 Ų | 60 | 44.7 Ų | 44.7 | 50% | 0.496 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -67.4 | -44.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | V54 V55 T61 G62 | V54-A58 WeakPolarHBondContact O-CB 3.26Å; V54-A58 PolarHBondContact O-N 2.99Å; V55-A58 PolarHBondContact O-N 3.45Å; A58-T61 PolarHBondContact O-N 3.45Å; A58-G62 PolarHBondContact O-N 3.41Å |
| 59 | V | 90.1 | Very high | 87.9 | Confident | 13 Ų | 13 | 45.3 Ų | 45.3 | 8% | 0.079 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.4 | -41.5 | 175.7 | 172.6 | 0 | 0 | 0 | 0 | 111 | V55 Y56 T61 G62 G63 L103 F316 | V55-V59 HydrophobicContact CG1-CG2 4.31Å; V55-V59 WeakPolarHBondContact O-CB 3.46Å; V55-V59 VanDerWaalsContact O-CG2 3.3Å; V55-V59 WeakPolarHBondContact O-CG2 3.23Å; V55-V59 PolarHBondContact O-N 2.88Å; Y56-V59 PolarHBondContact O-N 3.43Å; V59-T61 PolarHBondContact O-N 3.25Å; V59-G62 PolarHBondContact O-N 2.93Å; V59-G63 PolarHBondContact O-N 3.09Å; V59-L103 HydrophobicContact CB-CD1 4.29Å; V59-L103 HydrophobicContact CG1-CD1 3.71Å; V59-F316 HydrophobicContact CG1-CB 4.4Å; V59-F316 WeakPolarHBondContact CG1-O 3.37Å |
| 60 | A | 90.3 | Very high | 88.3 | Confident | 8 Ų | 8 | 43.2 Ų | 43.2 | 7% | 0.066 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -58.9 | -46.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | Y56 G63 L64 L103 P104 | Y56-A60 WeakPolarHBondContact O-CB 3.24Å; Y56-A60 PolarHBondContact O-N 3.33Å; A60-G63 PolarHBondContact O-N 3.45Å; A60-L64 WeakPolarHBondContact O-CB 3.48Å; A60-L64 PolarHBondContact O-N 3.25Å; A60-L103 HydrophobicContact CB-CB 3.88Å; A60-L103 HydrophobicContact CB-CD1 4.19Å; A60-P104 HydrophobicContact CB-CG 4.33Å |
| 61 | T | 91.2 | Very high | 88.6 | Confident | 80 Ų | 80 | 42.1 Ų | 42.1 | 49% | 0.491 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -65.1 | -46 | 178.8 | -56.5 | 0 | 0 | 0 | 0 | 111.6 | C57 A58 V59 L64 L65 | C57-T61 WeakPolarHBondContact O-CB 3.07Å; C57-T61 PolarHBondContact O-N 3.5Å; C57-T61 PolarHBondContact O-OG1 2.99Å; A58-T61 PolarHBondContact O-N 3.45Å; V59-T61 PolarHBondContact O-N 3.25Å; T61-L64 PolarHBondContact O-N 3.42Å; T61-L65 HydrophobicContact CG2-CD1 3.95Å; T61-L65 WeakPolarHBondContact O-CB 3.37Å; T61-L65 VanDerWaalsContact O-CG 3.31Å; T61-L65 WeakPolarHBondContact O-CG 3.23Å; T61-L65 PolarHBondContact O-N 3.02Å |
| 62 | G | 89.4 | Confident | 88.6 | Confident | 32 Ų | 32 | 43.2 Ų | 43.2 | 33% | 0.33 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -65.7 | -38.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | A58 V59 G66 | A58-G62 PolarHBondContact O-N 3.41Å; V59-G62 PolarHBondContact O-N 2.93Å; G62-G66 WeakPolarHBondContact O-CA 3.44Å; G62-G66 PolarHBondContact O-N 3.4Å |
| 63 | G | 89.6 | Confident | 88.7 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -66.6 | -45.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | V59 A60 N67 S100 | V59-G63 PolarHBondContact O-N 3.09Å; A60-G63 PolarHBondContact O-N 3.45Å; G63-N67 VanDerWaalsContact O-CB 3.26Å; G63-N67 WeakPolarHBondContact O-CB 3.35Å; G63-N67 PolarHBondContact O-N 3.33Å; G63-N67 PolarHBondContact O-ND2 2.97Å; G63-S100 VanDerWaalsContact C-OG 3.32Å; G63-S100 WeakPolarHBondContact CA-OG 3.24Å |
| 64 | L | 91.5 | Very high | 88.6 | Confident | 62 Ų | 62 | 42.5 Ų | 42.5 | 33% | 0.325 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -59.2 | -57.3 | 175.6 | -172.8 | 80.5 | 0 | 0 | 0 | 110.9 | A60 T61 G66 L68 L97 L101 | A60-L64 WeakPolarHBondContact O-CB 3.48Å; A60-L64 PolarHBondContact O-N 3.25Å; T61-L64 PolarHBondContact O-N 3.42Å; L64-G66 PolarHBondContact O-N 3.12Å; L64-L68 HydrophobicContact CD1-CD1 4.22Å; L64-L68 HydrophobicContact CG-CD1 3.97Å; L64-L68 VanDerWaalsContact O-CB 3.26Å; L64-L68 WeakPolarHBondContact O-CB 3.4Å; L64-L68 WeakPolarHBondContact O-CG 3.19Å; L64-L68 PolarHBondContact O-N 3.01Å; L64-L97 HydrophobicContact CD1-CD1 3.78Å; L64-L101 HydrophobicContact CD1-CD2 4.07Å |
| 65 | L | 90.5 | Very high | 88.4 | Confident | 113 Ų | 113 | 40.9 Ų | 40.9 | 59% | 0.592 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -63 | -43.2 | -178.6 | -67.4 | 174 | 0 | 0 | 0 | 112.2 | T61 L69 | T61-L65 HydrophobicContact CG2-CD1 3.95Å; T61-L65 WeakPolarHBondContact O-CB 3.37Å; T61-L65 VanDerWaalsContact O-CG 3.31Å; T61-L65 WeakPolarHBondContact O-CG 3.23Å; T61-L65 PolarHBondContact O-N 3.02Å; L65-L69 VanDerWaalsContact O-CB 3.26Å; L65-L69 WeakPolarHBondContact O-CB 3.38Å; L65-L69 PolarHBondContact O-N 2.99Å |
| 66 | G | 88 | Confident | 87.9 | Confident | 15 Ų | 15 | 41.9 Ų | 41.9 | 16% | 0.155 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65 | -48.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | G62 L64 L69 V70 P323 | G62-G66 WeakPolarHBondContact O-CA 3.44Å; G62-G66 PolarHBondContact O-N 3.4Å; L64-G66 PolarHBondContact O-N 3.12Å; G66-L69 PolarHBondContact O-N 2.85Å; G66-V70 WeakPolarHBondContact O-CG2 3.37Å; G66-V70 PolarHBondContact O-N 3.07Å; G66-P323 VanDerWaalsContact C-CG 3.42Å |
| 67 | N | 90.9 | Very high | 87.4 | Confident | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.005 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -73.5 | -39.2 | -178.1 | -71.8 | -67.2 | 0 | 0 | 0 | 112 | G63 L69 V70 L71 A93 D96 L97 C319 P323 | G63-N67 VanDerWaalsContact O-CB 3.26Å; G63-N67 WeakPolarHBondContact O-CB 3.35Å; G63-N67 PolarHBondContact O-N 3.33Å; G63-N67 PolarHBondContact O-ND2 2.97Å; N67-L69 VanDerWaalsContact C-N 3.28Å; N67-L69 PolarHBondContact O-N 2.9Å; N67-V70 PolarHBondContact O-N 2.81Å; N67-V70 VanDerWaalsContact O-N 3.16Å; N67-L71 WeakPolarHBondContact O-CB 3.48Å; N67-L71 VanDerWaalsContact O-CG 3.23Å; N67-L71 WeakPolarHBondContact O-CG 3.32Å; N67-L71 PolarHBondContact O-N 2.84Å; N67-A93 HydrophobicContact CB-CB 4.29Å; N67-A93 WeakPolarHBondContact CB-O 3.5Å; N67-A93 WeakPolarHBondContact OD1-CA 3.36Å; N67-D96 WeakPolarHBondContact ND2-CB 3.26Å; N67-L97 HydrophobicContact CB-CB 4.38Å; N67-L97 HydrophobicContact CB-CD1 4.4Å; N67-C319 PolarHBondContact ND2-O 3.37Å; N67-P323 HydrophobicContact CB-CG 4.37Å; N67-P323 VanDerWaalsContact CG-CG 3.49Å; N67-P323 WeakPolarHBondContact OD1-CG 3.43Å |
| 68 | L | 90.4 | Very high | 86.8 | Confident | 84 Ų | 84 | 51.2 Ų | 51.2 | 44% | 0.44 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -58.3 | -40 | 171.1 | -71.3 | 175.6 | 0 | 0 | 0 | 111.9 | L64 L71 Y72 L97 | L64-L68 HydrophobicContact CD1-CD1 4.22Å; L64-L68 HydrophobicContact CG-CD1 3.97Å; L64-L68 VanDerWaalsContact O-CB 3.26Å; L64-L68 WeakPolarHBondContact O-CB 3.4Å; L64-L68 WeakPolarHBondContact O-CG 3.19Å; L64-L68 PolarHBondContact O-N 3.01Å; L68-L71 PolarHBondContact O-N 3.42Å; L68-Y72 VanDerWaalsContact O-CB 3.24Å; L68-Y72 WeakPolarHBondContact O-CB 3.44Å; L68-Y72 PolarHBondContact O-N 3.35Å; L68-L97 HydrophobicContact CD2-CD1 3.86Å; L68-L97 HydrophobicContact CD2-CD2 4.09Å; L68-L97 HydrophobicContact CG-CD1 3.77Å |
| 69 | L | 87.1 | Confident | 86.1 | Confident | 52 Ų | 52 | 49.6 Ų | 49.6 | 27% | 0.272 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -64.4 | -41.4 | 174.9 | 177.6 | 62 | 0 | 0 | 0 | 112.4 | L65 G66 N67 L73 L337 L340 | L65-L69 VanDerWaalsContact O-CB 3.26Å; L65-L69 WeakPolarHBondContact O-CB 3.38Å; L65-L69 PolarHBondContact O-N 2.99Å; G66-L69 PolarHBondContact O-N 2.85Å; N67-L69 VanDerWaalsContact C-N 3.28Å; N67-L69 PolarHBondContact O-N 2.9Å; L69-L73 HydrophobicContact CD1-CD1 4.1Å; L69-L73 HydrophobicContact CD1-CG 4.18Å; L69-L73 HydrophobicContact CG-CD1 4.13Å; L69-L73 WeakPolarHBondContact O-CB 3.35Å; L69-L73 VanDerWaalsContact O-CG 3.24Å; L69-L73 WeakPolarHBondContact O-CG 3.23Å; L69-L73 PolarHBondContact O-N 3.48Å; L69-L337 HydrophobicContact CD2-CD1 4.16Å; L69-L340 HydrophobicContact CD1-CD1 4.22Å |
| 70 | V | 86.5 | Confident | 85.4 | Confident | 1 Ų | 1 | 50.6 Ų | 50.6 | 1% | 0.006 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.2 | -45.5 | 175.9 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | G66 N67 L73 L74 V89 A93 P323 | G66-V70 WeakPolarHBondContact O-CG2 3.37Å; G66-V70 PolarHBondContact O-N 3.07Å; N67-V70 PolarHBondContact O-N 2.81Å; N67-V70 VanDerWaalsContact O-N 3.16Å; V70-L73 PolarHBondContact O-N 3.48Å; V70-L74 HydrophobicContact CG1-CD1 3.83Å; V70-L74 WeakPolarHBondContact O-CB 3.28Å; V70-L74 WeakPolarHBondContact O-CG 3.06Å; V70-L74 PolarHBondContact O-N 2.92Å; V70-V89 HydrophobicContact CG1-CG1 4.04Å; V70-A93 HydrophobicContact CB-CB 4.4Å; V70-A93 HydrophobicContact CG1-CB 4.01Å; V70-P323 HydrophobicContact CG2-CB 3.89Å; V70-P323 HydrophobicContact CG2-CG 4.27Å |
| 71 | L | 87.9 | Confident | 84.6 | Confident | 21 Ų | 21 | 56.1 Ų | 56.1 | 11% | 0.11 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.3 | -49 | 176.5 | -66.3 | 167.7 | 0 | 0 | 0 | 110.8 | N67 L68 L73 L74 C75 F90 A93 L97 | N67-L71 WeakPolarHBondContact O-CB 3.48Å; N67-L71 VanDerWaalsContact O-CG 3.23Å; N67-L71 WeakPolarHBondContact O-CG 3.32Å; N67-L71 PolarHBondContact O-N 2.84Å; L68-L71 PolarHBondContact O-N 3.42Å; L71-L73 PolarHBondContact O-N 3.28Å; L71-L74 PolarHBondContact O-N 3.29Å; L71-C75 WeakPolarHBondContact O-CB 3.39Å; L71-C75 PolarHBondContact O-N 2.98Å; L71-C75 PolarHBondContact O-SG 3.43Å; L71-F90 HydrophobicContact CD2-CD1 4.48Å; L71-F90 HydrophobicContact CD2-CD2 3.41Å; L71-F90 VanDerWaalsContact CD2-CD2 3.41Å; L71-F90 HydrophobicContact CD2-CE1 4.49Å; L71-F90 HydrophobicContact CD2-CE2 3.45Å; L71-F90 VanDerWaalsContact CD2-CE2 3.45Å; L71-F90 HydrophobicContact CD2-CG 3.97Å; L71-F90 HydrophobicContact CD2-CZ 4.02Å; L71-A93 HydrophobicContact CD2-CB 3.95Å; L71-A93 HydrophobicContact CG-CB 4.04Å; L71-L97 HydrophobicContact CD1-CD2 4.08Å |
| 72 | Y | 86.3 | Confident | 83.6 | Confident | 128 Ų | 128 | 59.1 Ų | 59.1 | 50% | 0.502 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -57.2 | -46.7 | 176.1 | 173.9 | -104.2 | 0 | 0 | 0 | 112.2 | L68 L74 C75 S76 L340 | L68-Y72 VanDerWaalsContact O-CB 3.24Å; L68-Y72 WeakPolarHBondContact O-CB 3.44Å; L68-Y72 PolarHBondContact O-N 3.35Å; Y72-L74 PolarHBondContact O-N 2.91Å; Y72-C75 PolarHBondContact O-N 3.5Å; Y72-S76 WeakPolarHBondContact O-CB 3.37Å; Y72-S76 PolarHBondContact O-N 2.83Å; Y72-L340 HydrophobicContact CE1-CD1 4.17Å; Y72-L340 HydrophobicContact CE1-CD2 4.24Å |
| 73 | L | 82.5 | Confident | 83 | Confident | 8 Ų | 8 | 59.7 Ų | 59.7 | 4% | 0.042 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.7 | -42.4 | 177.8 | -76 | 172.9 | 0 | 0 | 0 | 112.3 | L69 V70 L71 T77 Y333 A336 L340 | L69-L73 HydrophobicContact CD1-CD1 4.1Å; L69-L73 HydrophobicContact CD1-CG 4.18Å; L69-L73 HydrophobicContact CG-CD1 4.13Å; L69-L73 WeakPolarHBondContact O-CB 3.35Å; L69-L73 VanDerWaalsContact O-CG 3.24Å; L69-L73 WeakPolarHBondContact O-CG 3.23Å; L69-L73 PolarHBondContact O-N 3.48Å; V70-L73 PolarHBondContact O-N 3.48Å; L71-L73 PolarHBondContact O-N 3.28Å; L73-T77 WeakPolarHBondContact O-CB 3.33Å; L73-T77 WeakPolarHBondContact O-CG2 3.42Å; L73-T77 PolarHBondContact O-N 2.88Å; L73-T77 VanDerWaalsContact O-N 3.13Å; L73-T77 PolarHBondContact O-OG1 3.34Å; L73-Y333 HydrophobicContact CB-CE1 4.26Å; L73-Y333 HydrophobicContact CD1-CD1 3.81Å; L73-Y333 HydrophobicContact CD1-CE1 4.3Å; L73-A336 HydrophobicContact CD2-CB 3.67Å; L73-L340 HydrophobicContact CD2-CD1 3.78Å |
| 74 | L | 83.7 | Confident | 82.5 | Confident | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.2 | -43.6 | 178 | -80.9 | 163.6 | 0 | 0 | 0 | 112.7 | V70 L71 Y72 R78 T79 I80 N86 V89 F90 Y333 | V70-L74 HydrophobicContact CG1-CD1 3.83Å; V70-L74 WeakPolarHBondContact O-CB 3.28Å; V70-L74 WeakPolarHBondContact O-CG 3.06Å; V70-L74 PolarHBondContact O-N 2.92Å; L71-L74 PolarHBondContact O-N 3.29Å; Y72-L74 PolarHBondContact O-N 2.91Å; L74-R78 PolarHBondContact O-N 3.46Å; L74-T79 PolarHBondContact O-N 3.48Å; L74-T79 PolarHBondContact O-OG1 3.24Å; L74-I80 PolarHBondContact O-N 2.85Å; L74-N86 HydrophobicContact CD2-CB 3.89Å; L74-V89 HydrophobicContact CD1-CG1 4.17Å; L74-F90 HydrophobicContact CD1-CB 3.98Å; L74-F90 HydrophobicContact CD1-CD2 4.36Å; L74-Y333 WeakPolarHBondContact CD2-OH 3.35Å; L74-Y333 WeakPolarHBondContact CG-OH 3.29Å |
| 75 | C | 83.8 | Confident | 81.9 | Confident | 68 Ų | 68 | 58.6 Ų | 58.6 | 46% | 0.459 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -71.9 | -51.8 | 178.5 | -69.9 | 0 | 0 | 0 | 0 | 112 | L71 Y72 T77 R78 | L71-C75 WeakPolarHBondContact O-CB 3.39Å; L71-C75 PolarHBondContact O-N 2.98Å; L71-C75 PolarHBondContact O-SG 3.43Å; Y72-C75 PolarHBondContact O-N 3.5Å; C75-T77 PolarHBondContact O-N 2.95Å; C75-R78 WeakPolarHBondContact O-CA 3.03Å; C75-R78 PolarHBondContact O-N 3.41Å |
| 76 | S | 79.7 | Confident | 81.5 | Confident | 75 Ų | 75 | 54 Ų | 54 | 52% | 0.524 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -59.8 | -43 | -177.1 | -177.3 | 0 | 0 | 0 | 0 | 112.4 | Y72 R78 | Y72-S76 WeakPolarHBondContact O-CB 3.37Å; Y72-S76 PolarHBondContact O-N 2.83Å; S76-R78 PolarHBondContact O-N 3.39Å |
| 77 | T | 75.7 | Confident | 81.5 | Confident | 61 Ų | 61 | 55.4 Ų | 55.4 | 37% | 0.374 | 29% | 0.289 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.5 | -0.2 | 176.5 | 62.9 | 0 | 0 | 0 | 0 | 114 | L73 C75 T79 K82 | L73-T77 WeakPolarHBondContact O-CB 3.33Å; L73-T77 WeakPolarHBondContact O-CG2 3.42Å; L73-T77 PolarHBondContact O-N 2.88Å; L73-T77 VanDerWaalsContact O-N 3.13Å; L73-T77 PolarHBondContact O-OG1 3.34Å; C75-T77 PolarHBondContact O-N 2.95Å; T77-T79 PolarHBondContact O-N 3.03Å; T77-T79 VanDerWaalsContact O-N 3.11Å; T77-T79 WeakPolarHBondContact OG1-CB 3.41Å; T77-T79 WeakPolarHBondContact OG1-CG2 3.41Å; T77-T79 PolarHBondContact OG1-OG1 3.14Å; T77-K82 PolarHBondContact O-NZ 3.21Å |
| 78 | R | 77.4 | Confident | 81.3 | Confident | 193 Ų | 193 | 55.5 Ų | 55.5 | 73% | 0.728 | 29% | 0.29 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.8 | 38.9 | -169.1 | -62.7 | -177.5 | 177.2 | 173.9 | -1.4 | 112.2 | L74 C75 S76 K82 | L74-R78 PolarHBondContact O-N 3.46Å; C75-R78 WeakPolarHBondContact O-CA 3.03Å; C75-R78 PolarHBondContact O-N 3.41Å; S76-R78 PolarHBondContact O-N 3.39Å; R78-K82 WeakPolarHBondContact O-CE 3.33Å |
| 79 | T | 74.9 | Confident | 81.1 | Confident | 27 Ų | 27 | 51.5 Ų | 51.5 | 17% | 0.166 | 27% | 0.269 | C | S | . | . | trans | -86.1 | -17.5 | -177.9 | 46 | 0 | 0 | 0 | 0 | 113.2 | L74 T77 V81 K82 N86 | L74-T79 PolarHBondContact O-N 3.48Å; L74-T79 PolarHBondContact O-OG1 3.24Å; T77-T79 PolarHBondContact O-N 3.03Å; T77-T79 VanDerWaalsContact O-N 3.11Å; T77-T79 WeakPolarHBondContact OG1-CB 3.41Å; T77-T79 WeakPolarHBondContact OG1-CG2 3.41Å; T77-T79 PolarHBondContact OG1-OG1 3.14Å; T79-V81 VanDerWaalsContact C-N 3.33Å; T79-V81 PolarHBondContact O-N 3.46Å; T79-K82 HydrophobicContact CG2-CD 4.18Å; T79-K82 PolarHBondContact O-N 3.48Å; T79-N86 WeakPolarHBondContact O-CB 3.48Å; T79-N86 PolarHBondContact O-ND2 3.5Å | ||
| 80 | I | 76.8 | Confident | 81.3 | Confident | 33 Ų | 33 | 51.4 Ų | 51.4 | 17% | 0.169 | 27% | 0.266 | C | S | . | . | G | 310 helix | trans | -52.5 | -45.7 | 174.5 | -170.8 | 177.3 | 0 | 0 | 0 | 112.8 | L74 K82 F87 F90 | L74-I80 PolarHBondContact O-N 2.85Å; I80-K82 VanDerWaalsContact C-N 3.32Å; I80-K82 PolarHBondContact O-N 3.33Å; I80-F87 HydrophobicContact CD1-CD2 4.01Å; I80-F87 HydrophobicContact CD1-CE2 4.5Å; I80-F87 HydrophobicContact CG1-CB 4.5Å; I80-F87 HydrophobicContact CG1-CD2 3.9Å; I80-F90 HydrophobicContact CD1-CB 3.89Å; I80-F90 HydrophobicContact CD1-CD1 3.93Å; I80-F90 HydrophobicContact CD1-CD2 3.56Å; I80-F90 HydrophobicContact CD1-CE1 4.36Å; I80-F90 HydrophobicContact CD1-CE2 4.01Å; I80-F90 HydrophobicContact CD1-CG 3.51Å; I80-F90 HydrophobicContact CD1-CZ 4.39Å; I80-F90 HydrophobicContact CG1-CB 4.21Å; I80-F90 HydrophobicContact CG1-CG 4.36Å |
| 81 | V | 72.5 | Confident | 81.5 | Confident | 125 Ų | 125 | 52 Ų | 52 | 76% | 0.758 | 27% | 0.269 | S | S | * | . | G | 310 helix | trans | -78 | -10.2 | 179.2 | -62.8 | 0 | 0 | 0 | 0 | 114.3 | T79 | T79-V81 VanDerWaalsContact C-N 3.33Å; T79-V81 PolarHBondContact O-N 3.46Å |
| 82 | K | 70.6 | Confident | 81.6 | Confident | 142 Ų | 142 | 51 Ų | 51 | 62% | 0.617 | 26% | 0.264 | S | S | * | . | G | 310 helix | trans | -85.2 | -9.8 | -173.4 | -62.6 | 177.8 | -174.2 | 156.6 | 0 | 113.6 | T77 R78 T79 I80 | T77-K82 PolarHBondContact O-NZ 3.21Å; R78-K82 WeakPolarHBondContact O-CE 3.33Å; T79-K82 HydrophobicContact CG2-CD 4.18Å; T79-K82 PolarHBondContact O-N 3.48Å; I80-K82 VanDerWaalsContact C-N 3.32Å; I80-K82 PolarHBondContact O-N 3.33Å |
| 83 | S | 75.8 | Confident | 81.9 | Confident | 44 Ų | 44 | 45 Ų | 45 | 31% | 0.308 | 24% | 0.241 | S | C | . | . | trans | -167.3 | 137.9 | 175.4 | -174 | 0 | 0 | 0 | 0 | 111.1 | I85 N86 F87 | S83-I85 PolarHBondContact O-N 3.27Å; S83-N86 WeakPolarHBondContact O-CB 3.33Å; S83-N86 PolarHBondContact O-N 3.05Å; S83-F87 PolarHBondContact O-N 2.96Å | ||
| 84 | A | 79.3 | Confident | 82.4 | Confident | 34 Ų | 34 | 47.6 Ų | 47.6 | 28% | 0.281 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -50.5 | -32.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | N86 F87 F88 | A84-N86 PolarHBondContact O-N 2.89Å; A84-F87 CarbonylContact O-C 3.59Å; A84-F87 WeakPolarHBondContact O-CB 3.23Å; A84-F87 PolarHBondContact O-N 3.47Å; A84-F88 HydrophobicContact CB-CE2 4.24Å; A84-F88 VanDerWaalsContact O-CD2 3.3Å; A84-F88 WeakPolarHBondContact O-CD2 3.42Å; A84-F88 WeakPolarHBondContact O-CG 3.43Å; A84-F88 PolarHBondContact O-N 3.3Å |
| 85 | I | 80.4 | Confident | 82.8 | Confident | 6 Ų | 6 | 47.7 Ų | 47.7 | 3% | 0.031 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -72.9 | -27 | 178.9 | -69.2 | 165.7 | 0 | 0 | 0 | 112.2 | S83 F88 V89 M144 T147 R148 | S83-I85 PolarHBondContact O-N 3.27Å; I85-F88 HydrophobicContact CG1-CD2 4.48Å; I85-V89 VanDerWaalsContact O-CG2 3.32Å; I85-V89 WeakPolarHBondContact O-CG2 3.34Å; I85-V89 PolarHBondContact O-N 2.97Å; I85-M144 HydrophobicContact CG2-CG 4.19Å; I85-M144 HydrophobicContact CG2-SD 4.16Å; I85-T147 HydrophobicContact CD1-CG2 3.91Å; I85-T147 HydrophobicContact CG1-CG2 3.91Å; I85-R148 HydrophobicContact CD1-CG 3.66Å; I85-R148 VanDerWaalsContact CD1-CZ 3.41Å; I85-R148 VanDerWaalsContact CD1-NE 3.31Å |
| 86 | N | 82.4 | Confident | 83.2 | Confident | 17 Ų | 17 | 44.4 Ų | 44.4 | 9% | 0.091 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -75 | -30.2 | 170.6 | -65 | -15 | 0 | 0 | 0 | 111.1 | L74 T79 S83 A84 F90 R330 | L74-N86 HydrophobicContact CD2-CB 3.89Å; T79-N86 WeakPolarHBondContact O-CB 3.48Å; T79-N86 PolarHBondContact O-ND2 3.5Å; S83-N86 WeakPolarHBondContact O-CB 3.33Å; S83-N86 PolarHBondContact O-N 3.05Å; A84-N86 PolarHBondContact O-N 2.89Å; N86-F90 PolarHBondContact O-N 3.26Å; N86-R330 PolarHBondContact OD1-NH1 3.1Å |
| 87 | F | 86.4 | Confident | 83.8 | Confident | 44 Ų | 44 | 42 Ų | 42 | 19% | 0.193 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -69.4 | -38.6 | 171.4 | -171.1 | -109.9 | 0 | 0 | 0 | 112.4 | I80 S83 A84 F90 N91 S169 R170 T173 | I80-F87 HydrophobicContact CD1-CD2 4.01Å; I80-F87 HydrophobicContact CD1-CE2 4.5Å; I80-F87 HydrophobicContact CG1-CB 4.5Å; I80-F87 HydrophobicContact CG1-CD2 3.9Å; S83-F87 PolarHBondContact O-N 2.96Å; A84-F87 CarbonylContact O-C 3.59Å; A84-F87 WeakPolarHBondContact O-CB 3.23Å; A84-F87 PolarHBondContact O-N 3.47Å; F87-F90 WeakPolarHBondContact O-CB 3.17Å; F87-F90 PolarHBondContact O-N 3.44Å; F87-N91 PolarHBondContact O-N 2.93Å; F87-N91 VanDerWaalsContact O-N 3.12Å; F87-N91 PolarHBondContact O-ND2 3.07Å; F87-S169 WeakPolarHBondContact CE1-O 3.4Å; F87-R170 HydrophobicContact CE1-CG 4.4Å; F87-R170 HydrophobicContact CZ-CG 4.28Å; F87-T173 HydrophobicContact CE1-CG2 3.9Å; F87-T173 VanDerWaalsContact CE1-OG1 3.28Å; F87-T173 WeakPolarHBondContact CE1-OG1 3.29Å; F87-T173 HydrophobicContact CZ-CG2 4.39Å |
| 88 | F | 87.7 | Confident | 84.6 | Confident | 3 Ų | 3 | 41.7 Ų | 41.7 | 1% | 0.013 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -67.6 | -39.9 | 172.1 | -58.9 | -38.7 | 0 | 0 | 0 | 112.6 | A84 I85 F90 N91 L92 F140 A143 M144 T147 T172 T173 | A84-F88 HydrophobicContact CB-CE2 4.24Å; A84-F88 VanDerWaalsContact O-CD2 3.3Å; A84-F88 WeakPolarHBondContact O-CD2 3.42Å; A84-F88 WeakPolarHBondContact O-CG 3.43Å; A84-F88 PolarHBondContact O-N 3.3Å; I85-F88 HydrophobicContact CG1-CD2 4.48Å; F88-F90 VanDerWaalsContact C-N 3.3Å; F88-F90 PolarHBondContact O-N 3.49Å; F88-N91 PolarHBondContact O-N 3.3Å; F88-L92 WeakPolarHBondContact O-CB 3.41Å; F88-L92 PolarHBondContact O-N 3.39Å; F88-F140 HydrophobicContact CB-CD1 4.2Å; F88-F140 HydrophobicContact CD1-CD1 4Å; F88-F140 HydrophobicContact CD1-CE1 4.21Å; F88-F140 HydrophobicContact CG-CD1 4.41Å; F88-A143 HydrophobicContact CD2-CB 4.39Å; F88-A143 HydrophobicContact CE2-CB 4.25Å; F88-A143 HydrophobicContact CZ-CB 4.41Å; F88-M144 HydrophobicContact CB-CE 4.43Å; F88-M144 HydrophobicContact CB-CG 3.7Å; F88-M144 HydrophobicContact CB-SD 4.21Å; F88-M144 HydrophobicContact CD2-CG 4Å; F88-M144 HydrophobicContact CG-CG 4.32Å; F88-T147 WeakPolarHBondContact CE2-OG1 3.47Å; F88-T172 HydrophobicContact CE1-CG2 4.11Å; F88-T172 HydrophobicContact CZ-CG2 3.91Å; F88-T173 WeakPolarHBondContact CD1-OG1 3.35Å; F88-T173 WeakPolarHBondContact CE1-OG1 3.45Å |
| 89 | V | 86.8 | Confident | 85.4 | Confident | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.9 | -35.5 | 172.6 | 173.3 | 0 | 0 | 0 | 0 | 112 | V70 L74 I85 A93 M144 Y326 | V70-V89 HydrophobicContact CG1-CG1 4.04Å; L74-V89 HydrophobicContact CD1-CG1 4.17Å; I85-V89 VanDerWaalsContact O-CG2 3.32Å; I85-V89 WeakPolarHBondContact O-CG2 3.34Å; I85-V89 PolarHBondContact O-N 2.97Å; V89-A93 WeakPolarHBondContact O-CB 3.46Å; V89-A93 PolarHBondContact O-N 3.37Å; V89-M144 HydrophobicContact CG2-CE 4.27Å; V89-M144 HydrophobicContact CG2-SD 3.57Å; V89-M144 VanDerWaalsContact CG2-SD 3.57Å; V89-Y326 HydrophobicContact CG1-CD2 3.92Å; V89-Y326 HydrophobicContact CG1-CE2 3.74Å; V89-Y326 HydrophobicContact CG2-CE1 4.15Å; V89-Y326 HydrophobicContact CG2-CE2 4.18Å |
| 90 | F | 89.3 | Confident | 86.2 | Confident | 49 Ų | 49 | 31.4 Ų | 31.4 | 22% | 0.215 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -61.2 | -46.8 | 173.2 | -179.7 | -89.6 | 0 | 0 | 0 | 112 | L71 L74 I80 N86 F87 F88 A93 L94 | L71-F90 HydrophobicContact CD2-CD1 4.48Å; L71-F90 HydrophobicContact CD2-CD2 3.41Å; L71-F90 VanDerWaalsContact CD2-CD2 3.41Å; L71-F90 HydrophobicContact CD2-CE1 4.49Å; L71-F90 HydrophobicContact CD2-CE2 3.45Å; L71-F90 VanDerWaalsContact CD2-CE2 3.45Å; L71-F90 HydrophobicContact CD2-CG 3.97Å; L71-F90 HydrophobicContact CD2-CZ 4.02Å; L74-F90 HydrophobicContact CD1-CB 3.98Å; L74-F90 HydrophobicContact CD1-CD2 4.36Å; I80-F90 HydrophobicContact CD1-CB 3.89Å; I80-F90 HydrophobicContact CD1-CD1 3.93Å; I80-F90 HydrophobicContact CD1-CD2 3.56Å; I80-F90 HydrophobicContact CD1-CE1 4.36Å; I80-F90 HydrophobicContact CD1-CE2 4.01Å; I80-F90 HydrophobicContact CD1-CG 3.51Å; I80-F90 HydrophobicContact CD1-CZ 4.39Å; I80-F90 HydrophobicContact CG1-CB 4.21Å; I80-F90 HydrophobicContact CG1-CG 4.36Å; N86-F90 PolarHBondContact O-N 3.26Å; F87-F90 WeakPolarHBondContact O-CB 3.17Å; F87-F90 PolarHBondContact O-N 3.44Å; F88-F90 VanDerWaalsContact C-N 3.3Å; F88-F90 PolarHBondContact O-N 3.49Å; F90-A93 PolarHBondContact O-N 3.46Å; F90-L94 PolarHBondContact O-N 3.08Å |
| 91 | N | 91.8 | Very high | 86.9 | Confident | 13 Ų | 13 | 34.3 Ų | 34.3 | 7% | 0.07 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -71.6 | -33.5 | -179.3 | -75.3 | -94.5 | 0 | 0 | 0 | 112.6 | F87 F88 L94 A95 F140 T173 W177 | F87-N91 PolarHBondContact O-N 2.93Å; F87-N91 VanDerWaalsContact O-N 3.12Å; F87-N91 PolarHBondContact O-ND2 3.07Å; F88-N91 PolarHBondContact O-N 3.3Å; N91-L94 WeakPolarHBondContact O-CB 3.3Å; N91-L94 PolarHBondContact O-N 3.49Å; N91-A95 PolarHBondContact O-N 3.16Å; N91-F140 HydrophobicContact CB-CD1 4.33Å; N91-F140 HydrophobicContact CB-CD2 4.32Å; N91-F140 HydrophobicContact CB-CE1 3.69Å; N91-F140 HydrophobicContact CB-CE2 3.67Å; N91-F140 HydrophobicContact CB-CZ 3.34Å; N91-T173 HydrophobicContact CB-CG2 4.39Å; N91-T173 WeakPolarHBondContact OD1-CG2 3.34Å; N91-W177 HydrophobicContact CB-CZ2 4.45Å; N91-W177 PolarHBondContact OD1-NE1 3.06Å |
| 92 | L | 90.3 | Very high | 87.7 | Confident | 1 Ų | 1 | 28.4 Ų | 28.4 | 1% | 0.005 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61 | -49.9 | 170.3 | -179.3 | 65.4 | 0 | 0 | 0 | 111 | F88 L94 A95 D96 S137 F140 M144 Y326 | F88-L92 WeakPolarHBondContact O-CB 3.41Å; F88-L92 PolarHBondContact O-N 3.39Å; L92-L94 PolarHBondContact O-N 3.36Å; L92-A95 WeakPolarHBondContact O-CB 3.29Å; L92-A95 PolarHBondContact O-N 2.86Å; L92-D96 PolarHBondContact O-N 2.8Å; L92-S137 VanDerWaalsContact CD1-OG 3.31Å; L92-S137 WeakPolarHBondContact CD1-OG 3.43Å; L92-F140 HydrophobicContact CB-CB 4.4Å; L92-M144 HydrophobicContact CD2-CE 3.95Å; L92-Y326 HydrophobicContact CD2-CE2 4.1Å; L92-Y326 VanDerWaalsContact CD2-OH 3.26Å; L92-Y326 WeakPolarHBondContact CD2-OH 3.41Å |
| 93 | A | 91.4 | Very high | 88.6 | Confident | 3 Ų | 3 | 21.7 Ų | 21.7 | 3% | 0.025 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -62.1 | -29.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | N67 V70 L71 V89 F90 L97 | N67-A93 HydrophobicContact CB-CB 4.29Å; N67-A93 WeakPolarHBondContact CB-O 3.5Å; N67-A93 WeakPolarHBondContact OD1-CA 3.36Å; V70-A93 HydrophobicContact CB-CB 4.4Å; V70-A93 HydrophobicContact CG1-CB 4.01Å; L71-A93 HydrophobicContact CD2-CB 3.95Å; L71-A93 HydrophobicContact CG-CB 4.04Å; V89-A93 WeakPolarHBondContact O-CB 3.46Å; V89-A93 PolarHBondContact O-N 3.37Å; F90-A93 PolarHBondContact O-N 3.46Å; A93-L97 VanDerWaalsContact O-CB 3.26Å; A93-L97 WeakPolarHBondContact O-CB 3.26Å; A93-L97 PolarHBondContact O-N 3.2Å |
| 94 | L | 92.8 | Very high | 89.3 | Confident | 61 Ų | 61 | 22.2 Ų | 22.2 | 32% | 0.319 | 12% | 0.122 | S | C | . | . | H | α-helix | trans | -69.8 | -41.7 | 171.3 | -178.1 | 61.7 | 0 | 0 | 0 | 112.2 | F90 N91 L92 L97 L98 W177 | F90-L94 PolarHBondContact O-N 3.08Å; N91-L94 WeakPolarHBondContact O-CB 3.3Å; N91-L94 PolarHBondContact O-N 3.49Å; L92-L94 PolarHBondContact O-N 3.36Å; L94-L97 PolarHBondContact O-N 3.47Å; L94-L98 WeakPolarHBondContact O-CG 3.42Å; L94-L98 PolarHBondContact O-N 3.42Å; L94-W177 HydrophobicContact CD2-CZ2 4.27Å |
| 95 | A | 93.4 | Very high | 89.7 | Confident | 2 Ų | 2 | 23.5 Ų | 23.5 | 2% | 0.017 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -64.9 | -38.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | N91 L92 L98 L99 N133 A136 W177 | N91-A95 PolarHBondContact O-N 3.16Å; L92-A95 WeakPolarHBondContact O-CB 3.29Å; L92-A95 PolarHBondContact O-N 2.86Å; A95-L98 PolarHBondContact O-N 3.26Å; A95-L99 PolarHBondContact O-N 2.88Å; A95-L99 VanDerWaalsContact O-N 3.13Å; A95-N133 PolarHBondContact O-ND2 3.19Å; A95-A136 HydrophobicContact CB-CB 4.03Å; A95-W177 HydrophobicContact CB-CH2 3.83Å; A95-W177 HydrophobicContact CB-CZ3 4.5Å |
| 96 | D | 92.4 | Very high | 90 | Very high | 0 Ų | 0 | 25 Ų | 25 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -71.7 | -33.8 | 175.8 | -72.1 | -31 | 0 | 0 | 0 | 112.5 | N67 L92 L99 S100 N133 C319 N322 | N67-D96 WeakPolarHBondContact ND2-CB 3.26Å; L92-D96 PolarHBondContact O-N 2.8Å; D96-L99 PolarHBondContact O-N 3.11Å; D96-S100 WeakPolarHBondContact O-CB 3.26Å; D96-S100 PolarHBondContact O-N 2.89Å; D96-S100 PolarHBondContact O-OG 3.16Å; D96-N133 WeakPolarHBondContact CA-ND2 3.19Å; D96-N133 PolarHBondContact N-ND2 3.42Å; D96-N133 PolarHBondContact OD1-ND2 3.43Å; D96-C319 HydrophobicContact CB-CB 3.89Å; D96-C319 WeakPolarHBondContact OD1-CB 3.35Å; D96-N322 PolarHBondContact OD2-ND2 3.23Å |
| 97 | L | 92.2 | Very high | 90.2 | Very high | 24 Ų | 24 | 24.3 Ų | 24.3 | 13% | 0.126 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -63.1 | -43.7 | 170.7 | -170.1 | 74.6 | 0 | 0 | 0 | 111.4 | L64 N67 L68 L71 A93 L94 S100 L101 | L64-L97 HydrophobicContact CD1-CD1 3.78Å; N67-L97 HydrophobicContact CB-CB 4.38Å; N67-L97 HydrophobicContact CB-CD1 4.4Å; L68-L97 HydrophobicContact CD2-CD1 3.86Å; L68-L97 HydrophobicContact CD2-CD2 4.09Å; L68-L97 HydrophobicContact CG-CD1 3.77Å; L71-L97 HydrophobicContact CD1-CD2 4.08Å; A93-L97 VanDerWaalsContact O-CB 3.26Å; A93-L97 WeakPolarHBondContact O-CB 3.26Å; A93-L97 PolarHBondContact O-N 3.2Å; L94-L97 PolarHBondContact O-N 3.47Å; L97-S100 WeakPolarHBondContact O-CB 3.48Å; L97-S100 PolarHBondContact O-N 2.97Å; L97-L101 WeakPolarHBondContact O-CG 3.3Å; L97-L101 PolarHBondContact O-N 3.05Å |
| 98 | L | 93.1 | Very high | 90.1 | Very high | 54 Ų | 54 | 24.6 Ų | 24.6 | 28% | 0.283 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -63.6 | -39.1 | 177.3 | -74.4 | 170.9 | 0 | 0 | 0 | 112.6 | L94 A95 L101 A102 L129 W177 | L94-L98 WeakPolarHBondContact O-CG 3.42Å; L94-L98 PolarHBondContact O-N 3.42Å; A95-L98 PolarHBondContact O-N 3.26Å; L98-L101 PolarHBondContact O-N 2.98Å; L98-A102 PolarHBondContact O-N 3.5Å; L98-L129 HydrophobicContact CB-CD2 4.34Å; L98-L129 HydrophobicContact CD2-CD2 4.36Å; L98-W177 HydrophobicContact CD1-CH2 4.35Å |
| 99 | L | 92.4 | Very high | 89.8 | Confident | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -65.9 | -43.4 | 170.6 | 176.9 | 56.3 | 0 | 0 | 0 | 111.3 | A95 D96 L101 A102 L103 T130 N133 F316 C319 | A95-L99 PolarHBondContact O-N 2.88Å; A95-L99 VanDerWaalsContact O-N 3.13Å; D96-L99 PolarHBondContact O-N 3.11Å; L99-L101 PolarHBondContact O-N 3Å; L99-L101 VanDerWaalsContact O-N 3.16Å; L99-A102 WeakPolarHBondContact O-CA 3.35Å; L99-A102 WeakPolarHBondContact O-CB 3.36Å; L99-A102 PolarHBondContact O-N 3.21Å; L99-L103 HydrophobicContact CD1-CD2 4.04Å; L99-L103 HydrophobicContact CD1-CG 4.29Å; L99-L103 HydrophobicContact CG-CD2 4.46Å; L99-L103 HydrophobicContact CG-CG 4.38Å; L99-L103 WeakPolarHBondContact O-CG 3.26Å; L99-L103 PolarHBondContact O-N 3.31Å; L99-T130 HydrophobicContact CD1-CG2 4.42Å; L99-N133 HydrophobicContact CB-CB 3.88Å; L99-N133 HydrophobicContact CD2-CB 4.08Å; L99-N133 HydrophobicContact CG-CB 4.49Å; L99-F316 HydrophobicContact CD1-CD1 4.39Å; L99-F316 HydrophobicContact CD1-CE1 4.41Å; L99-F316 HydrophobicContact CD2-CD1 4.35Å; L99-C319 HydrophobicContact CD2-CB 4.05Å |
| 100 | S | 92.3 | Very high | 89.4 | Confident | 4 Ų | 4 | 25.2 Ų | 25.2 | 3% | 0.028 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -57.5 | -31.4 | 179 | -55.6 | 0 | 0 | 0 | 0 | 112.8 | G63 D96 L97 P104 | G63-S100 VanDerWaalsContact C-OG 3.32Å; G63-S100 WeakPolarHBondContact CA-OG 3.24Å; D96-S100 WeakPolarHBondContact O-CB 3.26Å; D96-S100 PolarHBondContact O-N 2.89Å; D96-S100 PolarHBondContact O-OG 3.16Å; L97-S100 WeakPolarHBondContact O-CB 3.48Å; L97-S100 PolarHBondContact O-N 2.97Å; S100-P104 WeakPolarHBondContact O-CD 3.47Å |
| 101 | L | 91.4 | Very high | 88.9 | Confident | 95 Ų | 95 | 25.9 Ų | 25.9 | 50% | 0.497 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -78.2 | -21.6 | 173.5 | -67 | 171 | 0 | 0 | 0 | 113.9 | L64 L97 L98 L99 F105 | L64-L101 HydrophobicContact CD1-CD2 4.07Å; L97-L101 WeakPolarHBondContact O-CG 3.3Å; L97-L101 PolarHBondContact O-N 3.05Å; L98-L101 PolarHBondContact O-N 2.98Å; L99-L101 PolarHBondContact O-N 3Å; L99-L101 VanDerWaalsContact O-N 3.16Å; L101-F105 WeakPolarHBondContact O-CE2 3.27Å |
| 102 | A | 90.5 | Very high | 88.2 | Confident | 1 Ų | 1 | 29.1 Ų | 29.1 | 1% | 0.008 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -86.7 | -27.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | L98 L99 F105 V126 L129 | L98-A102 PolarHBondContact O-N 3.5Å; L99-A102 WeakPolarHBondContact O-CA 3.35Å; L99-A102 WeakPolarHBondContact O-CB 3.36Å; L99-A102 PolarHBondContact O-N 3.21Å; A102-F105 PolarHBondContact O-N 3.05Å; A102-V126 HydrophobicContact CB-CG1 4.32Å; A102-L129 HydrophobicContact CB-CB 4.18Å; A102-L129 HydrophobicContact CB-CD1 4.28Å |
| 103 | L | 88.4 | Confident | 87.4 | Confident | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -56.9 | -38.3 | -178.9 | -70.3 | 179.6 | 0 | 0 | 0 | 115.6 | V59 A60 L99 F105 W106 A107 F316 | V59-L103 HydrophobicContact CB-CD1 4.29Å; V59-L103 HydrophobicContact CG1-CD1 3.71Å; A60-L103 HydrophobicContact CB-CB 3.88Å; A60-L103 HydrophobicContact CB-CD1 4.19Å; L99-L103 HydrophobicContact CD1-CD2 4.04Å; L99-L103 HydrophobicContact CD1-CG 4.29Å; L99-L103 HydrophobicContact CG-CD2 4.46Å; L99-L103 HydrophobicContact CG-CG 4.38Å; L99-L103 WeakPolarHBondContact O-CG 3.26Å; L99-L103 PolarHBondContact O-N 3.31Å; L103-F105 PolarHBondContact O-N 3.44Å; L103-W106 PolarHBondContact O-N 2.92Å; L103-A107 PolarHBondContact O-N 2.95Å; L103-F316 HydrophobicContact CD1-CB 4.39Å; L103-F316 HydrophobicContact CD2-CB 3.83Å; L103-F316 HydrophobicContact CD2-CD1 3.93Å; L103-F316 HydrophobicContact CD2-CD2 3.27Å; L103-F316 HydrophobicContact CD2-CE1 4.27Å; L103-F316 HydrophobicContact CD2-CE2 3.64Å; L103-F316 HydrophobicContact CD2-CG 3.42Å; L103-F316 VanDerWaalsContact CD2-CG 3.42Å; L103-F316 HydrophobicContact CD2-CZ 4.13Å |
| 104 | P | 90.3 | Very high | 86.4 | Confident | 55 Ų | 55 | 36.6 Ų | 36.6 | 36% | 0.357 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -60.9 | -30.6 | 177.3 | -26.3 | 36.5 | 0 | 0 | 0 | 113.9 | A60 S100 A107 V108 | A60-P104 HydrophobicContact CB-CG 4.33Å; S100-P104 WeakPolarHBondContact O-CD 3.47Å; P104-A107 WeakPolarHBondContact O-CB 3.16Å; P104-A107 PolarHBondContact O-N 2.89Å; P104-V108 WeakPolarHBondContact O-CG2 3.2Å; P104-V108 PolarHBondContact O-N 3.25Å |
| 105 | F | 89.1 | Confident | 85.7 | Confident | 62 Ų | 62 | 35.7 Ų | 35.7 | 27% | 0.272 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -69.7 | -41.4 | 176.8 | -61.5 | -89.4 | 0 | 0 | 0 | 111.3 | L101 A102 L103 A107 V108 D109 W116 F118 V126 | L101-F105 WeakPolarHBondContact O-CE2 3.27Å; A102-F105 PolarHBondContact O-N 3.05Å; L103-F105 PolarHBondContact O-N 3.44Å; F105-A107 VanDerWaalsContact C-N 3.29Å; F105-A107 PolarHBondContact O-N 3.02Å; F105-V108 PolarHBondContact O-N 3.13Å; F105-D109 WeakPolarHBondContact O-CB 3.22Å; F105-D109 PolarHBondContact O-N 3.13Å; F105-W116 HydrophobicContact CB-CH2 3.79Å; F105-W116 HydrophobicContact CB-CZ3 4.31Å; F105-F118 HydrophobicContact CB-CE2 4.26Å; F105-F118 AromaticContact CD1-CD1 3.94Å; F105-F118 HydrophobicContact CD1-CD1 3.94Å; F105-F118 AromaticContact CD1-CD2 3.85Å; F105-F118 HydrophobicContact CD1-CD2 3.85Å; F105-F118 AromaticContact CD1-CE1 3.9Å; F105-F118 HydrophobicContact CD1-CE1 3.9Å; F105-F118 AromaticContact CD1-CE2 3.81Å; F105-F118 HydrophobicContact CD1-CE2 3.81Å; F105-F118 AromaticContact CD1-CG 3.9Å; F105-F118 HydrophobicContact CD1-CG 3.9Å; F105-F118 AromaticContact CD1-CZ 3.83Å; F105-F118 HydrophobicContact CD1-CZ 3.83Å; F105-F118 HydrophobicContact CE1-CD1 4.05Å; F105-F118 HydrophobicContact CE1-CE1 4.12Å; F105-F118 HydrophobicContact CE1-CG 4.35Å; F105-F118 HydrophobicContact CE1-CZ 4.47Å; F105-V126 HydrophobicContact CB-CG1 4.35Å; F105-V126 HydrophobicContact CB-CG2 3.9Å; F105-V126 HydrophobicContact CD2-CG2 3.95Å; F105-V126 HydrophobicContact CG-CG2 3.89Å |
| 106 | W | 86.1 | Confident | 85.1 | Confident | 38 Ų | 38 | 35.7 Ų | 35.7 | 14% | 0.144 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -65.3 | -31.5 | 170.5 | -68 | 122.7 | 0 | 0 | 0 | 112.7 | Y56 L103 I110 W116 V126 T130 | Y56-W106 HydrophobicContact CD2-CB 3.88Å; Y56-W106 HydrophobicContact CE2-CB 3.83Å; L103-W106 PolarHBondContact O-N 2.92Å; W106-I110 WeakPolarHBondContact O-CG1 3.38Å; W106-I110 PolarHBondContact O-N 3.04Å; W106-W116 HydrophobicContact CE3-CZ3 4.39Å; W106-V126 HydrophobicContact CD2-CG1 4.12Å; W106-V126 HydrophobicContact CG-CG1 4.31Å; W106-V126 HydrophobicContact CZ2-CG1 3.89Å; W106-V126 VanDerWaalsContact NE1-CG1 3.34Å; W106-T130 PolarHBondContact NE1-OG1 3.39Å |
| 107 | A | 85.7 | Confident | 84.6 | Confident | 2 Ų | 2 | 39.4 Ų | 39.4 | 2% | 0.017 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -68.1 | -36 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | S53 Y56 L103 P104 F105 T111 | S53-A107 PolarHBondContact OG-O 3.43Å; Y56-A107 HydrophobicContact CD2-CB 4.33Å; L103-A107 PolarHBondContact O-N 2.95Å; P104-A107 WeakPolarHBondContact O-CB 3.16Å; P104-A107 PolarHBondContact O-N 2.89Å; F105-A107 VanDerWaalsContact C-N 3.29Å; F105-A107 PolarHBondContact O-N 3.02Å; A107-T111 WeakPolarHBondContact O-CG2 3.26Å; A107-T111 PolarHBondContact O-N 3Å; A107-T111 PolarHBondContact O-OG1 2.78Å |
| 108 | V | 85.7 | Confident | 84.2 | Confident | 50 Ų | 50 | 41.8 Ų | 41.8 | 30% | 0.303 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -72.5 | -45.6 | 174.7 | 171.2 | 0 | 0 | 0 | 0 | 111.7 | P104 F105 I110 T111 L112 P117 F118 | P104-V108 WeakPolarHBondContact O-CG2 3.2Å; P104-V108 PolarHBondContact O-N 3.25Å; F105-V108 PolarHBondContact O-N 3.13Å; V108-I110 VanDerWaalsContact C-N 3.29Å; V108-I110 PolarHBondContact O-N 2.98Å; V108-T111 WeakPolarHBondContact CA-OG1 3.1Å; V108-T111 PolarHBondContact O-N 3.22Å; V108-T111 PolarHBondContact O-OG1 2.86Å; V108-L112 HydrophobicContact CG1-CD1 3.61Å; V108-L112 HydrophobicContact CG1-CG 4.17Å; V108-L112 WeakPolarHBondContact O-CG 3.37Å; V108-L112 PolarHBondContact O-N 3.43Å; V108-P117 HydrophobicContact CG1-CG 4.28Å; V108-F118 HydrophobicContact CB-CE2 3.95Å; V108-F118 HydrophobicContact CB-CZ 3.82Å; V108-F118 HydrophobicContact CG1-CE2 3.81Å; V108-F118 HydrophobicContact CG1-CZ 3.64Å; V108-F118 HydrophobicContact CG2-CZ 4.14Å |
| 109 | D | 81.3 | Confident | 83.8 | Confident | 8 Ų | 8 | 40.6 Ų | 40.6 | 4% | 0.043 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -50.3 | -48.1 | 175.1 | -179.8 | 77.3 | 0 | 0 | 0 | 111.7 | F105 T111 L112 Y114 W116 | F105-D109 WeakPolarHBondContact O-CB 3.22Å; F105-D109 PolarHBondContact O-N 3.13Å; D109-T111 PolarHBondContact O-N 3.46Å; D109-L112 PolarHBondContact O-N 3.4Å; D109-Y114 VanDerWaalsContact O-CA 3.25Å; D109-Y114 WeakPolarHBondContact O-CA 3.41Å; D109-Y114 PolarHBondContact O-N 3.39Å; D109-W116 HydrophobicContact CB-CE3 3.97Å; D109-W116 HydrophobicContact CB-CZ3 4.21Å |
| 110 | I | 77.1 | Confident | 83.5 | Confident | 7 Ų | 7 | 44 Ų | 44 | 4% | 0.036 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -68.4 | -32.2 | 178.6 | -67.5 | 176.3 | 0 | 0 | 0 | 113 | R49 I52 Y56 W106 V108 Y114 | R49-I110 HydrophobicContact CB-CG2 4.12Å; R49-I110 HydrophobicContact CG-CG2 4.28Å; I52-I110 HydrophobicContact CB-CG2 4.28Å; I52-I110 HydrophobicContact CG2-CD1 3.67Å; I52-I110 HydrophobicContact CG2-CG2 4.12Å; Y56-I110 HydrophobicContact CD2-CD1 4.26Å; Y56-I110 HydrophobicContact CE2-CD1 3.4Å; Y56-I110 VanDerWaalsContact CE2-CD1 3.4Å; W106-I110 WeakPolarHBondContact O-CG1 3.38Å; W106-I110 PolarHBondContact O-N 3.04Å; V108-I110 VanDerWaalsContact C-N 3.29Å; V108-I110 PolarHBondContact O-N 2.98Å; I110-Y114 HydrophobicContact CG1-CD1 4.44Å; I110-Y114 HydrophobicContact CG1-CE1 3.92Å |
| 111 | T | 80.2 | Confident | 83.2 | Confident | 64 Ų | 64 | 47.6 Ų | 47.6 | 39% | 0.393 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -77.2 | -21.1 | 175.8 | 50 | 0 | 0 | 0 | 0 | 114.3 | S53 A107 V108 D109 D113 | S53-T111 VanDerWaalsContact CB-CG2 3.44Å; S53-T111 VanDerWaalsContact OG-CG2 3.29Å; S53-T111 WeakPolarHBondContact OG-CG2 3.31Å; A107-T111 WeakPolarHBondContact O-CG2 3.26Å; A107-T111 PolarHBondContact O-N 3Å; A107-T111 PolarHBondContact O-OG1 2.78Å; V108-T111 WeakPolarHBondContact CA-OG1 3.1Å; V108-T111 PolarHBondContact O-N 3.22Å; V108-T111 PolarHBondContact O-OG1 2.86Å; D109-T111 PolarHBondContact O-N 3.46Å; T111-D113 VanDerWaalsContact C-N 3.31Å |
| 112 | L | 76.9 | Confident | 83 | Confident | 80 Ų | 80 | 47.2 Ų | 47.2 | 42% | 0.419 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.3 | 27.6 | 177 | -61.1 | 178.1 | 0 | 0 | 0 | 111.2 | V108 D109 Y114 N115 P117 | V108-L112 HydrophobicContact CG1-CD1 3.61Å; V108-L112 HydrophobicContact CG1-CG 4.17Å; V108-L112 WeakPolarHBondContact O-CG 3.37Å; V108-L112 PolarHBondContact O-N 3.43Å; D109-L112 PolarHBondContact O-N 3.4Å; L112-Y114 VanDerWaalsContact C-N 3.3Å; L112-Y114 PolarHBondContact O-N 3.01Å; L112-N115 HydrophobicContact CB-CB 4.1Å; L112-N115 WeakPolarHBondContact CB-O 3.09Å; L112-N115 WeakPolarHBondContact O-CB 3.2Å; L112-N115 PolarHBondContact O-N 3.03Å; L112-P117 HydrophobicContact CD1-CG 3.83Å |
| 113 | D | 73.4 | Confident | 82.8 | Confident | 63 Ų | 63 | 47.1 Ų | 47.1 | 34% | 0.337 | 26% | 0.263 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.7 | 41.7 | 177.9 | -62.3 | -10.9 | 0 | 0 | 0 | 113.8 | H46 R49 T111 N115 | H46-D113 IonicContact CE1-OD2 3.78Å; R49-D113 WeakPolarHBondContact CD-OD1 3.35Å; R49-D113 IonicContact CZ-OD1 3.28Å; R49-D113 VanDerWaalsContact CZ-OD1 3.28Å; R49-D113 IonicContact CZ-OD2 3.96Å; R49-D113 IonicContact NE-OD1 3.39Å; R49-D113 PolarHBondContact NE-OD1 3.4Å; R49-D113 IonicContact NH1-OD1 2.7Å; R49-D113 PolarHBondContact NH1-OD1 2.93Å; R49-D113 IonicContact NH1-OD2 3Å; R49-D113 PolarHBondContact NH1-OD2 2.96Å; T111-D113 VanDerWaalsContact C-N 3.31Å; D113-N115 VanDerWaalsContact C-N 3.31Å |
| 114 | Y | 70.9 | Confident | 82.9 | Confident | 98 Ų | 98 | 50.8 Ų | 50.8 | 38% | 0.384 | 28% | 0.279 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67 | 24.1 | -175 | -49.9 | -79.1 | 0 | 0 | 0 | 114.6 | D109 I110 L112 A203 | D109-Y114 VanDerWaalsContact O-CA 3.25Å; D109-Y114 WeakPolarHBondContact O-CA 3.41Å; D109-Y114 PolarHBondContact O-N 3.39Å; I110-Y114 HydrophobicContact CG1-CD1 4.44Å; I110-Y114 HydrophobicContact CG1-CE1 3.92Å; L112-Y114 VanDerWaalsContact C-N 3.3Å; L112-Y114 PolarHBondContact O-N 3.01Å; Y114-A203 WeakPolarHBondContact O-CA 3.41Å; Y114-A203 WeakPolarHBondContact O-CB 3.16Å |
| 115 | N | 76.1 | Confident | 82.8 | Confident | 43 Ų | 43 | 50 Ų | 50 | 23% | 0.23 | 28% | 0.277 | C | S | . | . | trans | -89.5 | 126.5 | 168.6 | -161.5 | 1.1 | 0 | 0 | 0 | 110.1 | L112 D113 P117 D201 T202 | L112-N115 HydrophobicContact CB-CB 4.1Å; L112-N115 WeakPolarHBondContact CB-O 3.09Å; L112-N115 WeakPolarHBondContact O-CB 3.2Å; L112-N115 PolarHBondContact O-N 3.03Å; D113-N115 VanDerWaalsContact C-N 3.31Å; N115-P117 VanDerWaalsContact O-CD 3.25Å; N115-P117 WeakPolarHBondContact O-CD 3.32Å; N115-D201 PolarHBondContact ND2-OD1 3.35Å; N115-T202 PolarHBondContact OD1-N 2.87Å; N115-T202 PolarHBondContact OD1-O 3.3Å | ||
| 116 | W | 80.9 | Confident | 82.9 | Confident | 1 Ų | 1 | 47.2 Ų | 47.2 | 0% | 0.004 | 27% | 0.265 | C | S | . | . | trans | -105.8 | 98 | -171.9 | -177.6 | -86.3 | 0 | 0 | 0 | 111.2 | F105 W106 D109 F118 G119 M122 C123 V126 L193 T202 C204 | F105-W116 HydrophobicContact CB-CH2 3.79Å; F105-W116 HydrophobicContact CB-CZ3 4.31Å; W106-W116 HydrophobicContact CE3-CZ3 4.39Å; D109-W116 HydrophobicContact CB-CE3 3.97Å; D109-W116 HydrophobicContact CB-CZ3 4.21Å; W116-F118 VanDerWaalsContact C-N 3.32Å; W116-F118 HydrophobicContact CD2-CD2 4.08Å; W116-F118 AromaticContact CE2-CD2 3.81Å; W116-F118 HydrophobicContact CE3-CD2 4.39Å; W116-F118 HydrophobicContact CH2-CD2 4.19Å; W116-F118 HydrophobicContact CZ2-CB 4.07Å; W116-F118 AromaticContact CZ2-CD2 3.86Å; W116-F118 HydrophobicContact CZ2-CD2 3.86Å; W116-F118 HydrophobicContact CZ2-CG 4.39Å; W116-F118 HydrophobicContact CZ3-CD2 4.45Å; W116-F118 PolarHBondContact O-N 3.49Å; W116-G119 PolarHBondContact NE1-O 2.91Å; W116-M122 VanDerWaalsContact CZ2-C 3.5Å; W116-M122 HydrophobicContact CZ2-CB 3.91Å; W116-C123 HydrophobicContact CD2-CB 4.43Å; W116-C123 HydrophobicContact CZ2-CB 4.25Å; W116-V126 HydrophobicContact CH2-CB 3.89Å; W116-V126 HydrophobicContact CH2-CG1 3.96Å; W116-V126 HydrophobicContact CH2-CG2 3.98Å; W116-V126 HydrophobicContact CZ2-CB 4.43Å; W116-V126 HydrophobicContact CZ2-CG2 4.36Å; W116-L193 HydrophobicContact CB-CD2 4Å; W116-L193 HydrophobicContact CG-CD2 4Å; W116-T202 WeakPolarHBondContact CA-O 3.01Å; W116-T202 WeakPolarHBondContact CB-O 3.33Å; W116-T202 PolarHBondContact N-O 3.41Å; W116-T202 PolarHBondContact O-OG1 3.41Å; W116-C204 HydrophobicContact CB-CB 3.9Å; W116-C204 HydrophobicContact CD2-CB 3.59Å; W116-C204 HydrophobicContact CE3-CB 3.68Å; W116-C204 HydrophobicContact CG-CB 3.68Å; W116-C204 HydrophobicContact CZ3-CB 4.46Å | ||
| 117 | P | 83.2 | Confident | 82.9 | Confident | 78 Ų | 78 | 45.6 Ų | 45.6 | 51% | 0.506 | 26% | 0.26 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.6 | -15.9 | -176.3 | 31 | -37.2 | 0 | 0 | 0 | 113.7 | V108 L112 N115 G119 | V108-P117 HydrophobicContact CG1-CG 4.28Å; L112-P117 HydrophobicContact CD1-CG 3.83Å; N115-P117 VanDerWaalsContact O-CD 3.25Å; N115-P117 WeakPolarHBondContact O-CD 3.32Å; P117-G119 VanDerWaalsContact C-N 3.29Å; P117-G119 PolarHBondContact O-N 3.02Å |
| 118 | F | 83.6 | Confident | 83.1 | Confident | 74 Ų | 74 | 47.8 Ų | 47.8 | 33% | 0.325 | 27% | 0.271 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.3 | 3.6 | -166.2 | -48.3 | -77.5 | 0 | 0 | 0 | 115.1 | F105 V108 W116 M122 | F105-F118 HydrophobicContact CB-CE2 4.26Å; F105-F118 AromaticContact CD1-CD1 3.94Å; F105-F118 HydrophobicContact CD1-CD1 3.94Å; F105-F118 AromaticContact CD1-CD2 3.85Å; F105-F118 HydrophobicContact CD1-CD2 3.85Å; F105-F118 AromaticContact CD1-CE1 3.9Å; F105-F118 HydrophobicContact CD1-CE1 3.9Å; F105-F118 AromaticContact CD1-CE2 3.81Å; F105-F118 HydrophobicContact CD1-CE2 3.81Å; F105-F118 AromaticContact CD1-CG 3.9Å; F105-F118 HydrophobicContact CD1-CG 3.9Å; F105-F118 AromaticContact CD1-CZ 3.83Å; F105-F118 HydrophobicContact CD1-CZ 3.83Å; F105-F118 HydrophobicContact CE1-CD1 4.05Å; F105-F118 HydrophobicContact CE1-CE1 4.12Å; F105-F118 HydrophobicContact CE1-CG 4.35Å; F105-F118 HydrophobicContact CE1-CZ 4.47Å; V108-F118 HydrophobicContact CB-CE2 3.95Å; V108-F118 HydrophobicContact CB-CZ 3.82Å; V108-F118 HydrophobicContact CG1-CE2 3.81Å; V108-F118 HydrophobicContact CG1-CZ 3.64Å; V108-F118 HydrophobicContact CG2-CZ 4.14Å; W116-F118 VanDerWaalsContact C-N 3.32Å; W116-F118 HydrophobicContact CD2-CD2 4.08Å; W116-F118 AromaticContact CE2-CD2 3.81Å; W116-F118 HydrophobicContact CE3-CD2 4.39Å; W116-F118 HydrophobicContact CH2-CD2 4.19Å; W116-F118 HydrophobicContact CZ2-CB 4.07Å; W116-F118 AromaticContact CZ2-CD2 3.86Å; W116-F118 HydrophobicContact CZ2-CD2 3.86Å; W116-F118 HydrophobicContact CZ2-CG 4.39Å; W116-F118 HydrophobicContact CZ3-CD2 4.45Å; W116-F118 PolarHBondContact O-N 3.49Å; F118-M122 HydrophobicContact CB-CB 3.61Å; F118-M122 HydrophobicContact CB-CG 3.97Å; F118-M122 WeakPolarHBondContact O-CB 3.39Å; F118-M122 WeakPolarHBondContact O-CG 3.43Å |
| 119 | G | 85.3 | Confident | 83.4 | Confident | 29 Ų | 29 | 47.7 Ų | 47.7 | 30% | 0.299 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | 71.3 | 172.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | W116 P117 A121 M122 C123 | W116-G119 PolarHBondContact NE1-O 2.91Å; P117-G119 VanDerWaalsContact C-N 3.29Å; P117-G119 PolarHBondContact O-N 3.02Å; G119-A121 PolarHBondContact O-N 3.42Å; G119-M122 PolarHBondContact O-N 2.9Å; G119-C123 PolarHBondContact O-N 3.22Å; G119-C123 VanDerWaalsContact O-N 3.1Å |
| 120 | L | 84.3 | Confident | 83.7 | Confident | 72 Ų | 72 | 47.5 Ų | 47.5 | 38% | 0.377 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64 | -38.4 | -168 | -177.8 | 62.3 | 0 | 0 | 0 | 113.2 | M122 C123 K124 L193 | L120-M122 PolarHBondContact O-N 3.37Å; L120-C123 PolarHBondContact O-N 3.5Å; L120-K124 HydrophobicContact CD1-CD 4.45Å; L120-K124 HydrophobicContact CD1-CG 4.32Å; L120-K124 HydrophobicContact CG-CD 4.48Å; L120-K124 PolarHBondContact O-N 3.4Å; L120-L193 HydrophobicContact CB-CD1 4.11Å; L120-L193 HydrophobicContact CB-CG 4.44Å; L120-L193 HydrophobicContact CD1-CB 4.49Å; L120-L193 HydrophobicContact CD1-CG 4.27Å; L120-L193 VanDerWaalsContact N-CD1 3.34Å |
| 121 | A | 87.3 | Confident | 84.2 | Confident | 79 Ų | 79 | 47.1 Ų | 47.1 | 65% | 0.653 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -60.7 | -44.2 | 180 | 0 | 0 | 0 | 0 | 0 | 111.6 | G119 A125 | G119-A121 PolarHBondContact O-N 3.42Å; A121-A125 VanDerWaalsContact O-CB 3.29Å; A121-A125 WeakPolarHBondContact O-CB 3.22Å; A121-A125 PolarHBondContact O-N 3.2Å |
| 122 | M | 87.5 | Confident | 84.7 | Confident | 87 Ų | 87 | 45 Ų | 45 | 43% | 0.429 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -72 | -37.5 | 176.8 | -67 | -61.7 | -174.6 | 0 | 0 | 112 | W116 F118 G119 L120 K124 A125 V126 | W116-M122 VanDerWaalsContact CZ2-C 3.5Å; W116-M122 HydrophobicContact CZ2-CB 3.91Å; F118-M122 HydrophobicContact CB-CB 3.61Å; F118-M122 HydrophobicContact CB-CG 3.97Å; F118-M122 WeakPolarHBondContact O-CB 3.39Å; F118-M122 WeakPolarHBondContact O-CG 3.43Å; G119-M122 PolarHBondContact O-N 2.9Å; L120-M122 PolarHBondContact O-N 3.37Å; M122-K124 VanDerWaalsContact C-N 3.32Å; M122-K124 PolarHBondContact O-N 3.36Å; M122-A125 PolarHBondContact O-N 3.37Å; M122-V126 WeakPolarHBondContact O-CB 3.13Å; M122-V126 WeakPolarHBondContact O-CG2 3.42Å; M122-V126 PolarHBondContact O-N 3.3Å |
| 123 | C | 86.4 | Confident | 85.4 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57.3 | -46.3 | 175.1 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | W116 G119 L120 S127 L193 C204 | W116-C123 HydrophobicContact CD2-CB 4.43Å; W116-C123 HydrophobicContact CZ2-CB 4.25Å; G119-C123 PolarHBondContact O-N 3.22Å; G119-C123 VanDerWaalsContact O-N 3.1Å; L120-C123 PolarHBondContact O-N 3.5Å; C123-S127 WeakPolarHBondContact O-CB 3.31Å; C123-S127 PolarHBondContact O-N 2.98Å; C123-S127 VanDerWaalsContact O-N 3.13Å; C123-S127 PolarHBondContact O-OG 3.48Å; C123-L193 HydrophobicContact CB-CD2 4.31Å; C123-C204 WeakPolarHBondContact CA-SG 3.47Å; C123-C204 HydrophobicContact CB-CB 3.85Å; C123-C204 WeakPolarHBondContact CB-SG 3.46Å; C123-C204 VanDerWaalsContact SG-CA 3.53Å; C123-C204 WeakPolarHBondContact SG-CB 3.21Å; C123-C204 CovalentContact SG-SG 2.04Å; C123-C204 PolarHBondContact SG-SG 2.93Å |
| 124 | K | 88.6 | Confident | 86 | Confident | 76 Ų | 76 | 38.9 Ų | 38.9 | 33% | 0.33 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -66.1 | -44.5 | 174.3 | -71 | -169 | 165.5 | -174.7 | 0 | 112.6 | L120 M122 L128 A188 A191 | L120-K124 HydrophobicContact CD1-CD 4.45Å; L120-K124 HydrophobicContact CD1-CG 4.32Å; L120-K124 HydrophobicContact CG-CD 4.48Å; L120-K124 PolarHBondContact O-N 3.4Å; M122-K124 VanDerWaalsContact C-N 3.32Å; M122-K124 PolarHBondContact O-N 3.36Å; K124-L128 VanDerWaalsContact O-CB 3.29Å; K124-L128 WeakPolarHBondContact O-CB 3.36Å; K124-L128 PolarHBondContact O-N 3.04Å; K124-A188 WeakPolarHBondContact CD-O 3.41Å; K124-A188 WeakPolarHBondContact CE-O 3.17Å; K124-A188 WeakPolarHBondContact CG-O 3.45Å; K124-A191 WeakPolarHBondContact CE-O 3.25Å; K124-A191 HydrophobicContact CG-CB 4.17Å; K124-A191 WeakPolarHBondContact CG-O 3.29Å |
| 125 | A | 90 | Very high | 86.9 | Confident | 39 Ų | 39 | 34.5 Ų | 34.5 | 32% | 0.322 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -64.5 | -47 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | A121 M122 L128 L129 | A121-A125 VanDerWaalsContact O-CB 3.29Å; A121-A125 WeakPolarHBondContact O-CB 3.22Å; A121-A125 PolarHBondContact O-N 3.2Å; M122-A125 PolarHBondContact O-N 3.37Å; A125-L128 WeakPolarHBondContact O-CB 3.26Å; A125-L128 PolarHBondContact O-N 3.1Å; A125-L129 VanDerWaalsContact O-CG 3.3Å; A125-L129 WeakPolarHBondContact O-CG 3.36Å; A125-L129 PolarHBondContact O-N 3.24Å |
| 126 | V | 90.4 | Very high | 87.6 | Confident | 4 Ų | 4 | 32.5 Ų | 32.5 | 2% | 0.024 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -67.3 | -39 | -179.9 | 168.1 | 0 | 0 | 0 | 0 | 111.1 | A102 F105 W106 W116 M122 L129 T130 | A102-V126 HydrophobicContact CB-CG1 4.32Å; F105-V126 HydrophobicContact CB-CG1 4.35Å; F105-V126 HydrophobicContact CB-CG2 3.9Å; F105-V126 HydrophobicContact CD2-CG2 3.95Å; F105-V126 HydrophobicContact CG-CG2 3.89Å; W106-V126 HydrophobicContact CD2-CG1 4.12Å; W106-V126 HydrophobicContact CG-CG1 4.31Å; W106-V126 HydrophobicContact CZ2-CG1 3.89Å; W106-V126 VanDerWaalsContact NE1-CG1 3.34Å; W116-V126 HydrophobicContact CH2-CB 3.89Å; W116-V126 HydrophobicContact CH2-CG1 3.96Å; W116-V126 HydrophobicContact CH2-CG2 3.98Å; W116-V126 HydrophobicContact CZ2-CB 4.43Å; W116-V126 HydrophobicContact CZ2-CG2 4.36Å; M122-V126 WeakPolarHBondContact O-CB 3.13Å; M122-V126 WeakPolarHBondContact O-CG2 3.42Å; M122-V126 PolarHBondContact O-N 3.3Å; V126-L129 PolarHBondContact O-N 3.11Å; V126-T130 WeakPolarHBondContact O-CB 3.35Å; V126-T130 PolarHBondContact O-N 3.45Å; V126-T130 PolarHBondContact O-OG1 3.18Å |
| 127 | S | 86.7 | Confident | 88 | Confident | 4 Ų | 4 | 32.4 Ų | 32.4 | 3% | 0.028 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -65.6 | -37.7 | 173.2 | -69.8 | 0 | 0 | 0 | 0 | 112.4 | C123 G131 | C123-S127 WeakPolarHBondContact O-CB 3.31Å; C123-S127 PolarHBondContact O-N 2.98Å; C123-S127 VanDerWaalsContact O-N 3.13Å; C123-S127 PolarHBondContact O-OG 3.48Å; S127-G131 PolarHBondContact O-N 2.98Å; S127-G131 VanDerWaalsContact O-N 3.1Å |
| 128 | L | 89.7 | Confident | 88.1 | Confident | 48 Ų | 48 | 28.8 Ų | 28.8 | 25% | 0.251 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -65 | -51.4 | 172.5 | -175.5 | 61.9 | 0 | 0 | 0 | 111.6 | K124 A125 T130 G131 L132 L181 A184 A188 | K124-L128 VanDerWaalsContact O-CB 3.29Å; K124-L128 WeakPolarHBondContact O-CB 3.36Å; K124-L128 PolarHBondContact O-N 3.04Å; A125-L128 WeakPolarHBondContact O-CB 3.26Å; A125-L128 PolarHBondContact O-N 3.1Å; L128-T130 VanDerWaalsContact C-N 3.31Å; L128-T130 PolarHBondContact O-N 2.77Å; L128-G131 PolarHBondContact O-N 3.4Å; L128-L132 WeakPolarHBondContact O-CB 3.25Å; L128-L132 PolarHBondContact O-N 3.39Å; L128-L181 HydrophobicContact CD1-CD1 4.11Å; L128-L181 HydrophobicContact CD2-CD1 4.39Å; L128-A184 HydrophobicContact CD1-CB 3.87Å; L128-A188 HydrophobicContact CB-CB 3.7Å; L128-A188 HydrophobicContact CD1-CB 3.69Å; L128-A188 HydrophobicContact CG-CB 4.15Å |
| 129 | L | 91.6 | Very high | 88.4 | Confident | 48 Ų | 48 | 27.2 Ų | 27.2 | 25% | 0.251 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -60.5 | -41.1 | -179.1 | -70.5 | 175.3 | 0 | 0 | 0 | 111.7 | L98 A102 A125 V126 L132 N133 | L98-L129 HydrophobicContact CB-CD2 4.34Å; L98-L129 HydrophobicContact CD2-CD2 4.36Å; A102-L129 HydrophobicContact CB-CB 4.18Å; A102-L129 HydrophobicContact CB-CD1 4.28Å; A125-L129 VanDerWaalsContact O-CG 3.3Å; A125-L129 WeakPolarHBondContact O-CG 3.36Å; A125-L129 PolarHBondContact O-N 3.24Å; V126-L129 PolarHBondContact O-N 3.11Å; L129-L132 PolarHBondContact O-N 2.98Å; L129-N133 PolarHBondContact O-N 2.91Å |
| 130 | T | 88.4 | Confident | 88.6 | Confident | 3 Ų | 3 | 25.9 Ų | 25.9 | 2% | 0.018 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -62 | -49.4 | 175.5 | -55.7 | 0 | 0 | 0 | 0 | 111 | L99 W106 V126 L128 V134 F316 | L99-T130 HydrophobicContact CD1-CG2 4.42Å; W106-T130 PolarHBondContact NE1-OG1 3.39Å; V126-T130 WeakPolarHBondContact O-CB 3.35Å; V126-T130 PolarHBondContact O-N 3.45Å; V126-T130 PolarHBondContact O-OG1 3.18Å; L128-T130 VanDerWaalsContact C-N 3.31Å; L128-T130 PolarHBondContact O-N 2.77Å; T130-V134 VanDerWaalsContact O-CG2 3.27Å; T130-V134 WeakPolarHBondContact O-CG2 3.48Å; T130-V134 PolarHBondContact O-N 3.05Å; T130-F316 HydrophobicContact CG2-CE1 3.83Å; T130-F316 HydrophobicContact CG2-CZ 4.32Å |
| 131 | G | 86.6 | Confident | 88.6 | Confident | 0 Ų | 0 | 22.5 Ų | 22.5 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -62.4 | -44.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | S127 L128 N133 V134 Y135 | S127-G131 PolarHBondContact O-N 2.98Å; S127-G131 VanDerWaalsContact O-N 3.1Å; L128-G131 PolarHBondContact O-N 3.4Å; G131-N133 VanDerWaalsContact C-N 3.33Å; G131-N133 PolarHBondContact O-N 3.46Å; G131-V134 PolarHBondContact O-N 2.82Å; G131-V134 VanDerWaalsContact O-N 3.13Å; G131-Y135 WeakPolarHBondContact O-CD2 3.46Å; G131-Y135 PolarHBondContact O-N 3.12Å |
| 132 | L | 91 | Very high | 88.4 | Confident | 20 Ų | 20 | 21.1 Ų | 21.1 | 11% | 0.105 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -59.5 | -41.5 | -178.8 | -176.7 | 66.9 | 0 | 0 | 0 | 111.6 | L128 L129 A136 W177 A180 L181 A184 | L128-L132 WeakPolarHBondContact O-CB 3.25Å; L128-L132 PolarHBondContact O-N 3.39Å; L129-L132 PolarHBondContact O-N 2.98Å; L132-A136 WeakPolarHBondContact O-CB 3.35Å; L132-A136 PolarHBondContact O-N 3.42Å; L132-W177 HydrophobicContact CD1-CE3 4.24Å; L132-W177 HydrophobicContact CD1-CZ3 4.33Å; L132-W177 HydrophobicContact CD2-CE3 4.49Å; L132-W177 HydrophobicContact CD2-CZ3 4Å; L132-W177 HydrophobicContact CG-CE3 4.47Å; L132-W177 HydrophobicContact CG-CZ3 4.06Å; L132-A180 HydrophobicContact CD1-CB 3.85Å; L132-L181 HydrophobicContact CD1-CB 4.22Å; L132-L181 HydrophobicContact CD1-CD1 4.39Å; L132-A184 HydrophobicContact CB-CB 4.22Å |
| 133 | N | 91.3 | Very high | 88.4 | Confident | 2 Ų | 2 | 17.5 Ų | 17.5 | 1% | 0.011 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -58.6 | -47.8 | 173.7 | 175.9 | -82.2 | 0 | 0 | 0 | 111.8 | A95 D96 L99 L129 G131 Y135 A136 S137 | A95-N133 PolarHBondContact O-ND2 3.19Å; D96-N133 WeakPolarHBondContact CA-ND2 3.19Å; D96-N133 PolarHBondContact N-ND2 3.42Å; D96-N133 PolarHBondContact OD1-ND2 3.43Å; L99-N133 HydrophobicContact CB-CB 3.88Å; L99-N133 HydrophobicContact CD2-CB 4.08Å; L99-N133 HydrophobicContact CG-CB 4.49Å; L129-N133 PolarHBondContact O-N 2.91Å; G131-N133 VanDerWaalsContact C-N 3.33Å; G131-N133 PolarHBondContact O-N 3.46Å; N133-Y135 PolarHBondContact O-N 2.86Å; N133-A136 PolarHBondContact O-N 3.48Å; N133-S137 WeakPolarHBondContact O-CB 3.38Å; N133-S137 PolarHBondContact O-N 3.45Å; N133-S137 PolarHBondContact O-OG 2.99Å |
| 134 | V | 86.4 | Confident | 88.2 | Confident | 11 Ų | 11 | 17.8 Ų | 17.8 | 7% | 0.067 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -56.7 | -52.8 | -176.9 | -163.5 | 0 | 0 | 0 | 0 | 110.8 | T130 G131 C138 W276 | T130-V134 VanDerWaalsContact O-CG2 3.27Å; T130-V134 WeakPolarHBondContact O-CG2 3.48Å; T130-V134 PolarHBondContact O-N 3.05Å; G131-V134 PolarHBondContact O-N 2.82Å; G131-V134 VanDerWaalsContact O-N 3.13Å; V134-C138 PolarHBondContact O-N 3.28Å; V134-C138 PolarHBondContact O-SG 3.45Å; V134-W276 HydrophobicContact CB-CH2 4.4Å; V134-W276 HydrophobicContact CG1-CD2 4.29Å; V134-W276 HydrophobicContact CG1-CE3 4.16Å; V134-W276 HydrophobicContact CG1-CH2 4.34Å; V134-W276 HydrophobicContact CG1-CZ2 4.44Å; V134-W276 HydrophobicContact CG1-CZ3 4.18Å; V134-W276 HydrophobicContact CG2-CE3 4.48Å; V134-W276 HydrophobicContact CG2-CH2 3.35Å; V134-W276 HydrophobicContact CG2-CZ2 3.87Å; V134-W276 HydrophobicContact CG2-CZ3 3.7Å |
| 135 | Y | 88.9 | Confident | 87.7 | Confident | 7 Ų | 7 | 14.4 Ų | 14.4 | 3% | 0.027 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -71.2 | -42.2 | -176.9 | -56 | -67.4 | 0 | 0 | 0 | 112.2 | G131 N133 S137 C138 F139 A183 A184 F225 P230 | G131-Y135 WeakPolarHBondContact O-CD2 3.46Å; G131-Y135 PolarHBondContact O-N 3.12Å; N133-Y135 PolarHBondContact O-N 2.86Å; Y135-S137 VanDerWaalsContact C-N 3.31Å; Y135-S137 PolarHBondContact O-N 3.41Å; Y135-C138 PolarHBondContact O-N 2.95Å; Y135-F139 WeakPolarHBondContact O-CB 3.2Å; Y135-F139 WeakPolarHBondContact O-CD2 3.39Å; Y135-F139 WeakPolarHBondContact O-CG 3.43Å; Y135-F139 PolarHBondContact O-N 3.12Å; Y135-A183 HydrophobicContact CD1-CB 3.67Å; Y135-A183 HydrophobicContact CD2-CB 3.64Å; Y135-A183 HydrophobicContact CE1-CB 3.8Å; Y135-A183 HydrophobicContact CE2-CB 3.79Å; Y135-A183 WeakPolarHBondContact CE2-O 3.32Å; Y135-A183 HydrophobicContact CG-CB 3.58Å; Y135-A183 PolarHBondContact OH-O 3.1Å; Y135-A184 HydrophobicContact CD2-CB 4.04Å; Y135-A184 HydrophobicContact CE2-CB 4.17Å; Y135-F225 VanDerWaalsContact CE1-O 3.28Å; Y135-F225 WeakPolarHBondContact CE1-O 3.29Å; Y135-F225 PolarHBondContact OH-O 3.18Å; Y135-P230 HydrophobicContact CD1-CG 4.23Å; Y135-P230 HydrophobicContact CE1-CG 3.75Å |
| 136 | A | 91.5 | Very high | 87.2 | Confident | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -59.2 | -44.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | A95 L132 N133 F139 F140 W177 A180 | A95-A136 HydrophobicContact CB-CB 4.03Å; L132-A136 WeakPolarHBondContact O-CB 3.35Å; L132-A136 PolarHBondContact O-N 3.42Å; N133-A136 PolarHBondContact O-N 3.48Å; A136-F139 PolarHBondContact O-N 3.39Å; A136-F140 HydrophobicContact CB-CD2 4.24Å; A136-F140 HydrophobicContact CB-CE2 4.11Å; A136-F140 WeakPolarHBondContact O-CB 3.35Å; A136-F140 WeakPolarHBondContact O-CD2 3.45Å; A136-F140 WeakPolarHBondContact O-CG 3.46Å; A136-F140 PolarHBondContact O-N 2.86Å; A136-W177 HydrophobicContact CB-CZ3 4.28Å; A136-A180 HydrophobicContact CB-CB 4Å |
| 137 | S | 89.3 | Confident | 86.6 | Confident | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -62.3 | -49.5 | 177.3 | -68 | 0 | 0 | 0 | 0 | 112.2 | L92 N133 Y135 F139 F140 L141 F272 | L92-S137 VanDerWaalsContact CD1-OG 3.31Å; L92-S137 WeakPolarHBondContact CD1-OG 3.43Å; N133-S137 WeakPolarHBondContact O-CB 3.38Å; N133-S137 PolarHBondContact O-N 3.45Å; N133-S137 PolarHBondContact O-OG 2.99Å; Y135-S137 VanDerWaalsContact C-N 3.31Å; Y135-S137 PolarHBondContact O-N 3.41Å; S137-F139 PolarHBondContact O-N 3.29Å; S137-F140 PolarHBondContact O-N 3.34Å; S137-L141 WeakPolarHBondContact O-CB 3.44Å; S137-L141 WeakPolarHBondContact O-CG 3.17Å; S137-L141 PolarHBondContact O-N 3.33Å; S137-F272 VanDerWaalsContact CB-CE2 3.41Å |
| 138 | C | 86 | Confident | 86 | Confident | 1 Ų | 1 | 21.8 Ų | 21.8 | 1% | 0.007 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -54.1 | -49.3 | 173.4 | -72.5 | 0 | 0 | 0 | 0 | 112.2 | V134 Y135 L141 M142 I233 M234 F272 | V134-C138 PolarHBondContact O-N 3.28Å; V134-C138 PolarHBondContact O-SG 3.45Å; Y135-C138 PolarHBondContact O-N 2.95Å; C138-L141 PolarHBondContact O-N 2.9Å; C138-M142 WeakPolarHBondContact O-CB 3.22Å; C138-M142 PolarHBondContact O-N 2.77Å; C138-I233 HydrophobicContact CB-CB 4.45Å; C138-I233 HydrophobicContact CB-CG2 3.86Å; C138-M234 HydrophobicContact CB-SD 4.32Å; C138-F272 VanDerWaalsContact SG-CE1 3.54Å |
| 139 | F | 89.2 | Confident | 85 | Confident | 42 Ų | 42 | 22.9 Ų | 22.9 | 18% | 0.184 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -69.8 | -39.6 | -177.6 | -70.7 | -47.7 | 0 | 0 | 0 | 113.2 | Y135 A136 S137 M142 A143 I176 A180 I233 | Y135-F139 WeakPolarHBondContact O-CB 3.2Å; Y135-F139 WeakPolarHBondContact O-CD2 3.39Å; Y135-F139 WeakPolarHBondContact O-CG 3.43Å; Y135-F139 PolarHBondContact O-N 3.12Å; A136-F139 PolarHBondContact O-N 3.39Å; S137-F139 PolarHBondContact O-N 3.29Å; F139-M142 PolarHBondContact O-N 2.87Å; F139-A143 WeakPolarHBondContact O-CB 3.29Å; F139-A143 PolarHBondContact O-N 3.12Å; F139-I176 HydrophobicContact CB-CB 4.38Å; F139-I176 HydrophobicContact CB-CG1 4.16Å; F139-I176 HydrophobicContact CB-CG2 3.58Å; F139-I176 HydrophobicContact CG-CG2 4.5Å; F139-A180 HydrophobicContact CD2-CB 4.16Å; F139-A180 HydrophobicContact CE2-CB 4.44Å; F139-I233 HydrophobicContact CD1-CD1 3.94Å; F139-I233 HydrophobicContact CD1-CG2 4.4Å; F139-I233 HydrophobicContact CE1-CD1 3.32Å; F139-I233 HydrophobicContact CE1-CG1 4.1Å; F139-I233 HydrophobicContact CZ-CD1 3.79Å |
| 140 | F | 88.9 | Confident | 84 | Confident | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -67.8 | -36.5 | 175.4 | -74.7 | -55 | 0 | 0 | 0 | 112.1 | F88 N91 L92 A136 S137 A143 M144 T173 I176 W177 | F88-F140 HydrophobicContact CB-CD1 4.2Å; F88-F140 HydrophobicContact CD1-CD1 4Å; F88-F140 HydrophobicContact CD1-CE1 4.21Å; F88-F140 HydrophobicContact CG-CD1 4.41Å; N91-F140 HydrophobicContact CB-CD1 4.33Å; N91-F140 HydrophobicContact CB-CD2 4.32Å; N91-F140 HydrophobicContact CB-CE1 3.69Å; N91-F140 HydrophobicContact CB-CE2 3.67Å; N91-F140 HydrophobicContact CB-CZ 3.34Å; L92-F140 HydrophobicContact CB-CB 4.4Å; A136-F140 HydrophobicContact CB-CD2 4.24Å; A136-F140 HydrophobicContact CB-CE2 4.11Å; A136-F140 WeakPolarHBondContact O-CB 3.35Å; A136-F140 WeakPolarHBondContact O-CD2 3.45Å; A136-F140 WeakPolarHBondContact O-CG 3.46Å; A136-F140 PolarHBondContact O-N 2.86Å; S137-F140 PolarHBondContact O-N 3.34Å; F140-A143 PolarHBondContact O-N 3.16Å; F140-M144 HydrophobicContact CB-CE 4.35Å; F140-M144 WeakPolarHBondContact O-CB 3.46Å; F140-M144 WeakPolarHBondContact O-CE 3.42Å; F140-M144 WeakPolarHBondContact O-CG 3.2Å; F140-M144 PolarHBondContact O-N 3.06Å; F140-T173 HydrophobicContact CE1-CG2 4.17Å; F140-T173 HydrophobicContact CZ-CG2 4.18Å; F140-I176 HydrophobicContact CD1-CD1 3.71Å; F140-I176 HydrophobicContact CD1-CG2 3.89Å; F140-I176 HydrophobicContact CD2-CG2 4.07Å; F140-I176 HydrophobicContact CE1-CB 3.98Å; F140-I176 HydrophobicContact CE1-CD1 3.75Å; F140-I176 HydrophobicContact CE1-CG1 4.48Å; F140-I176 HydrophobicContact CE1-CG2 3.55Å; F140-I176 HydrophobicContact CE2-CG2 3.75Å; F140-I176 HydrophobicContact CG-CG2 4.11Å; F140-I176 HydrophobicContact CZ-CB 4.13Å; F140-I176 HydrophobicContact CZ-CG2 3.44Å; F140-I176 VanDerWaalsContact CZ-CG2 3.44Å; F140-W177 HydrophobicContact CE2-CZ2 4.21Å; F140-W177 AromaticContact CZ-NE1 3.73Å |
| 141 | L | 84.1 | Confident | 83.1 | Confident | 2 Ų | 2 | 25.4 Ų | 25.4 | 1% | 0.01 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -64 | -45.2 | 172.4 | -70.1 | 170.5 | 0 | 0 | 0 | 111.5 | S137 C138 A143 M144 S145 M234 V268 V269 F272 | S137-L141 WeakPolarHBondContact O-CB 3.44Å; S137-L141 WeakPolarHBondContact O-CG 3.17Å; S137-L141 PolarHBondContact O-N 3.33Å; C138-L141 PolarHBondContact O-N 2.9Å; L141-A143 PolarHBondContact O-N 3.16Å; L141-M144 HydrophobicContact CD2-CE 4.2Å; L141-M144 PolarHBondContact O-N 2.97Å; L141-S145 PolarHBondContact O-N 3.02Å; L141-M234 HydrophobicContact CD1-CE 4.26Å; L141-M234 HydrophobicContact CD1-SD 4.29Å; L141-V268 HydrophobicContact CD1-CG1 4.48Å; L141-V268 HydrophobicContact CD2-CB 4.24Å; L141-V268 HydrophobicContact CD2-CG1 3.47Å; L141-V268 VanDerWaalsContact CD2-CG1 3.47Å; L141-V269 HydrophobicContact CB-CG2 4.33Å; L141-V269 HydrophobicContact CD2-CG2 4.26Å; L141-F272 HydrophobicContact CD1-CB 4.06Å; L141-F272 HydrophobicContact CD1-CD1 4.48Å; L141-F272 HydrophobicContact CD1-CD2 4.2Å; L141-F272 HydrophobicContact CD1-CG 4Å |
| 142 | M | 84.6 | Confident | 82 | Confident | 49 Ų | 49 | 26.7 Ų | 26.7 | 24% | 0.241 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -59.1 | -47.2 | 174.6 | -167 | -167.9 | -162 | 0 | 0 | 112 | C138 F139 M144 S145 L146 I233 L236 | C138-M142 WeakPolarHBondContact O-CB 3.22Å; C138-M142 PolarHBondContact O-N 2.77Å; F139-M142 PolarHBondContact O-N 2.87Å; M142-M144 PolarHBondContact O-N 3.3Å; M142-S145 PolarHBondContact O-N 3.26Å; M142-L146 WeakPolarHBondContact O-CB 3.35Å; M142-L146 PolarHBondContact O-N 3.46Å; M142-I233 HydrophobicContact CB-CG2 4.04Å; M142-I233 HydrophobicContact CG-CG2 4.36Å; M142-I233 HydrophobicContact SD-CG2 3.95Å; M142-L236 HydrophobicContact CE-CB 4.32Å; M142-L236 HydrophobicContact CE-CD2 3.47Å; M142-L236 VanDerWaalsContact CE-CD2 3.47Å; M142-L236 HydrophobicContact CE-CG 3.78Å |
| 143 | A | 85.9 | Confident | 80.6 | Confident | 12 Ų | 12 | 27.6 Ų | 27.6 | 10% | 0.099 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.4 | -37 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | F88 F139 F140 L141 T147 I176 | F88-A143 HydrophobicContact CD2-CB 4.39Å; F88-A143 HydrophobicContact CE2-CB 4.25Å; F88-A143 HydrophobicContact CZ-CB 4.41Å; F139-A143 WeakPolarHBondContact O-CB 3.29Å; F139-A143 PolarHBondContact O-N 3.12Å; F140-A143 PolarHBondContact O-N 3.16Å; L141-A143 PolarHBondContact O-N 3.16Å; A143-T147 VanDerWaalsContact O-CB 3.25Å; A143-T147 WeakPolarHBondContact O-CB 3.31Å; A143-T147 PolarHBondContact O-N 2.85Å; A143-T147 PolarHBondContact O-OG1 3.48Å; A143-I176 HydrophobicContact CB-CD1 3.66Å |
| 144 | M | 82.4 | Confident | 79.2 | Confident | 5 Ų | 5 | 31.5 Ų | 31.5 | 3% | 0.025 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -64.3 | -43.8 | 173.2 | -78.6 | -171.3 | -90.3 | 0 | 0 | 112.4 | I85 F88 V89 L92 F140 L141 M142 R148 | I85-M144 HydrophobicContact CG2-CG 4.19Å; I85-M144 HydrophobicContact CG2-SD 4.16Å; F88-M144 HydrophobicContact CB-CE 4.43Å; F88-M144 HydrophobicContact CB-CG 3.7Å; F88-M144 HydrophobicContact CB-SD 4.21Å; F88-M144 HydrophobicContact CD2-CG 4Å; F88-M144 HydrophobicContact CG-CG 4.32Å; V89-M144 HydrophobicContact CG2-CE 4.27Å; V89-M144 HydrophobicContact CG2-SD 3.57Å; V89-M144 VanDerWaalsContact CG2-SD 3.57Å; L92-M144 HydrophobicContact CD2-CE 3.95Å; F140-M144 HydrophobicContact CB-CE 4.35Å; F140-M144 WeakPolarHBondContact O-CB 3.46Å; F140-M144 WeakPolarHBondContact O-CE 3.42Å; F140-M144 WeakPolarHBondContact O-CG 3.2Å; F140-M144 PolarHBondContact O-N 3.06Å; L141-M144 HydrophobicContact CD2-CE 4.2Å; L141-M144 PolarHBondContact O-N 2.97Å; M142-M144 PolarHBondContact O-N 3.3Å; M144-R148 PolarHBondContact O-N 2.86Å |
| 145 | S | 78.3 | Confident | 77.9 | Confident | 6 Ų | 6 | 35 Ų | 35 | 4% | 0.042 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -63.4 | -47.1 | 174.8 | -73.7 | 0 | 0 | 0 | 0 | 112.2 | L141 M142 R148 Y149 | L141-S145 PolarHBondContact O-N 3.02Å; M142-S145 PolarHBondContact O-N 3.26Å; S145-R148 PolarHBondContact O-N 2.9Å; S145-Y149 PolarHBondContact O-N 2.83Å |
| 146 | L | 79.8 | Confident | 76.4 | Confident | 80 Ų | 80 | 40.5 Ų | 40.5 | 42% | 0.419 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.5 | -43.3 | 179.2 | -176.9 | 61.3 | 0 | 0 | 0 | 111.9 | M142 R148 Y149 C150 | M142-L146 WeakPolarHBondContact O-CB 3.35Å; M142-L146 PolarHBondContact O-N 3.46Å; L146-R148 VanDerWaalsContact C-N 3.29Å; L146-R148 PolarHBondContact O-N 3.27Å; L146-Y149 WeakPolarHBondContact O-CB 3.5Å; L146-Y149 PolarHBondContact O-N 3.42Å; L146-Y149 VanDerWaalsContact O-N 3.1Å; L146-C150 PolarHBondContact O-N 2.84Å; L146-C150 PolarHBondContact O-SG 3.4Å |
| 147 | T | 78.3 | Confident | 74.4 | Confident | 47 Ų | 47 | 48.4 Ų | 48.4 | 29% | 0.288 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.9 | -37 | 178.2 | -58.2 | 0 | 0 | 0 | 0 | 111.8 | I85 F88 A143 S151 | I85-T147 HydrophobicContact CD1-CG2 3.91Å; I85-T147 HydrophobicContact CG1-CG2 3.91Å; F88-T147 WeakPolarHBondContact CE2-OG1 3.47Å; A143-T147 VanDerWaalsContact O-CB 3.25Å; A143-T147 WeakPolarHBondContact O-CB 3.31Å; A143-T147 PolarHBondContact O-N 2.85Å; A143-T147 PolarHBondContact O-OG1 3.48Å; T147-S151 WeakPolarHBondContact O-CB 3.41Å; T147-S151 PolarHBondContact O-N 2.86Å |
| 148 | R | 73.1 | Confident | 72.5 | Confident | 75 Ų | 75 | 55.2 Ų | 55.2 | 28% | 0.283 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -67.2 | -43 | 172.1 | -75.7 | -63 | -177.4 | -148.2 | -7.2 | 112.3 | I85 M144 S145 L146 S151 V152 F244 | I85-R148 HydrophobicContact CD1-CG 3.66Å; I85-R148 VanDerWaalsContact CD1-CZ 3.41Å; I85-R148 VanDerWaalsContact CD1-NE 3.31Å; M144-R148 PolarHBondContact O-N 2.86Å; S145-R148 PolarHBondContact O-N 2.9Å; L146-R148 VanDerWaalsContact C-N 3.29Å; L146-R148 PolarHBondContact O-N 3.27Å; R148-S151 PolarHBondContact O-N 3.45Å; R148-V152 PolarHBondContact O-N 3.2Å; R148-F244 HydrophobicContact CB-CD2 4.2Å; R148-F244 HydrophobicContact CB-CE2 3.85Å |
| 149 | Y | 70.3 | Confident | 70.9 | Confident | 70 Ų | 70 | 59.4 Ų | 59.4 | 28% | 0.275 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -59.6 | -50.6 | 176.3 | 178.5 | -98.8 | 0 | 0 | 0 | 112 | S145 L146 V152 A153 R243 | S145-Y149 PolarHBondContact O-N 2.83Å; L146-Y149 WeakPolarHBondContact O-CB 3.5Å; L146-Y149 PolarHBondContact O-N 3.42Å; L146-Y149 VanDerWaalsContact O-N 3.1Å; Y149-V152 PolarHBondContact O-N 2.88Å; Y149-A153 WeakPolarHBondContact O-CB 3.42Å; Y149-A153 PolarHBondContact O-N 3.1Å; Y149-R243 HydrophobicContact CE2-CG 4.46Å |
| 150 | C | 70 | Confident | 68.7 | Low | 36 Ų | 36 | 60.4 Ų | 60.4 | 24% | 0.243 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -61.7 | -45.6 | 177.8 | -65.7 | 0 | 0 | 0 | 0 | 112.2 | L146 V152 A153 T154 L166 | L146-C150 PolarHBondContact O-N 2.84Å; L146-C150 PolarHBondContact O-SG 3.4Å; C150-V152 PolarHBondContact O-N 2.98Å; C150-V152 VanDerWaalsContact O-N 3.12Å; C150-A153 PolarHBondContact O-N 3.14Å; C150-T154 PolarHBondContact O-N 3.06Å; C150-T154 PolarHBondContact O-OG1 2.85Å; C150-L166 HydrophobicContact CB-CD1 4.29Å |
| 151 | S | 68.3 | Low | 66.6 | Low | 68 Ų | 68 | 67 Ų | 67 | 48% | 0.476 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -57.7 | -27 | 177.7 | 178.9 | 0 | 0 | 0 | 0 | 113.7 | T147 R148 A155 | T147-S151 WeakPolarHBondContact O-CB 3.41Å; T147-S151 PolarHBondContact O-N 2.86Å; R148-S151 PolarHBondContact O-N 3.45Å; S151-A155 WeakPolarHBondContact O-CB 3.44Å |
| 152 | V | 63.4 | Low | 64.8 | Low | 27 Ų | 27 | 74.1 Ų | 74.1 | 16% | 0.164 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -91.4 | -40.7 | 177.5 | 163.2 | 0 | 0 | 0 | 0 | 111.7 | R148 Y149 C150 T154 A155 L156 F244 H248 | R148-V152 PolarHBondContact O-N 3.2Å; Y149-V152 PolarHBondContact O-N 2.88Å; C150-V152 PolarHBondContact O-N 2.98Å; C150-V152 VanDerWaalsContact O-N 3.12Å; V152-T154 VanDerWaalsContact C-N 3.26Å; V152-T154 PolarHBondContact O-N 3.33Å; V152-A155 PolarHBondContact O-N 3.07Å; V152-A155 VanDerWaalsContact O-N 3.17Å; V152-L156 HydrophobicContact CG1-CD1 3.89Å; V152-L156 WeakPolarHBondContact O-CG 3.44Å; V152-L156 PolarHBondContact O-N 3.38Å; V152-F244 HydrophobicContact CB-CE2 4.15Å; V152-F244 HydrophobicContact CG2-CD2 4.46Å; V152-F244 HydrophobicContact CG2-CE2 3.53Å; V152-F244 HydrophobicContact CG2-CZ 4.04Å; V152-H248 VanDerWaalsContact CG1-NE2 3.26Å; V152-H248 WeakPolarHBondContact CG1-NE2 3.46Å; V152-H248 WeakPolarHBondContact CG2-NE2 3.44Å |
| 153 | A | 63.4 | Low | 62.7 | Low | 40 Ų | 40 | 74.4 Ų | 74.4 | 33% | 0.331 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -60.4 | -36.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y149 C150 | Y149-A153 WeakPolarHBondContact O-CB 3.42Å; Y149-A153 PolarHBondContact O-N 3.1Å; C150-A153 PolarHBondContact O-N 3.14Å |
| 154 | T | 61 | Low | 60.9 | Low | 84 Ų | 84 | 83.4 Ų | 83.4 | 52% | 0.515 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -71.9 | -41 | 173.5 | -56.5 | 0 | 0 | 0 | 0 | 112.1 | C150 V152 L156 K157 | C150-T154 PolarHBondContact O-N 3.06Å; C150-T154 PolarHBondContact O-OG1 2.85Å; V152-T154 VanDerWaalsContact C-N 3.26Å; V152-T154 PolarHBondContact O-N 3.33Å; T154-L156 PolarHBondContact O-N 3.45Å; T154-L156 VanDerWaalsContact O-N 3.12Å; T154-K157 PolarHBondContact O-N 3.35Å |
| 155 | A | 59.4 | Low | 59.1 | Low | 85 Ų | 85 | 92.2 Ų | 92.2 | 70% | 0.702 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -65.9 | -11 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | S151 V152 | S151-A155 WeakPolarHBondContact O-CB 3.44Å; V152-A155 PolarHBondContact O-N 3.07Å; V152-A155 VanDerWaalsContact O-N 3.17Å |
| 156 | L | 56.2 | Low | 57.6 | Low | 122 Ų | 122 | 98.5 Ų | 98.5 | 64% | 0.639 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.9 | 4.6 | 177.6 | -69 | 168 | 0 | 0 | 0 | 113.7 | V152 T154 | V152-L156 HydrophobicContact CG1-CD1 3.89Å; V152-L156 WeakPolarHBondContact O-CG 3.44Å; V152-L156 PolarHBondContact O-N 3.38Å; T154-L156 PolarHBondContact O-N 3.45Å; T154-L156 VanDerWaalsContact O-N 3.12Å |
| 157 | K | 50.7 | Low | 56.4 | Low | 165 Ų | 165 | 98.3 Ų | 98.3 | 72% | 0.717 | 58% | 0.575 | S | S | * | * | trans | -111.2 | 113.1 | 176.8 | -76.7 | -168.8 | 171.8 | -167.3 | 0 | 110.9 | T154 A159 | T154-K157 PolarHBondContact O-N 3.35Å; K157-A159 VanDerWaalsContact C-N 3.26Å; K157-A159 PolarHBondContact O-N 3.16Å | ||
| 158 | P | 49.6 | Very low | 56.4 | Low | 143 Ų | 143 | 99.9 Ų | 99.9 | 93% | 0.929 | 58% | 0.581 | S | S | * | * | S | Bend | trans | -66.5 | -16.2 | -176.3 | -25.4 | 35.6 | 0 | 0 | 0 | 116.4 | ||
| 159 | A | 51.3 | Low | 56.7 | Low | 90 Ų | 90 | 97.7 Ų | 97.7 | 74% | 0.744 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -135.3 | 94.1 | -170.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | K157 | K157-A159 VanDerWaalsContact C-N 3.26Å; K157-A159 PolarHBondContact O-N 3.16Å |
| 160 | A | 43.3 | Very low | 57.4 | Low | 63 Ų | 63 | 102.8 Ų | 102.8 | 52% | 0.521 | 60% | 0.597 | S | S | . | * | trans | 167.6 | 133.8 | 137.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | L162 | A160-L162 HydrophobicContact CB-CB 4.18Å; A160-L162 PolarHBondContact O-N 3.5Å | ||
| 161 | P | 45.8 | Very low | 58.2 | Low | 137 Ų | 137 | 104.6 Ų | 104.6 | 89% | 0.89 | 61% | 0.607 | S | S | * | * | trans | -75.8 | 46.1 | 163.9 | 34.8 | -35.5 | 0 | 0 | 0 | 111.1 | G163 | P161-G163 PolarHBondContact O-N 3.19Š| ||
| 162 | L | 44.9 | Very low | 59.1 | Low | 153 Ų | 153 | 103 Ų | 103 | 80% | 0.801 | 59% | 0.594 | S | S | * | * | trans | -72.9 | 84.1 | 169.5 | -128.1 | 73.5 | 0 | 0 | 0 | 107.1 | A160 | A160-L162 HydrophobicContact CB-CB 4.18Å; A160-L162 PolarHBondContact O-N 3.5Å | ||
| 163 | G | 42.2 | Very low | 60.4 | Low | 55 Ų | 55 | 102 Ų | 102 | 57% | 0.567 | 59% | 0.588 | S | S | * | * | trans | -78.5 | -148.2 | -150.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | P161 K165 | P161-G163 PolarHBondContact O-N 3.19Å; G163-K165 PolarHBondContact O-N 2.68Å | ||
| 164 | H | 46.8 | Very low | 61.8 | Low | 201 Ų | 201 | 103 Ų | 103 | 93% | 0.931 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -70 | 40.4 | -169.8 | -154.7 | -74.8 | 0 | 0 | 0 | 114.1 | ||
| 165 | K | 45.8 | Very low | 63.2 | Low | 190 Ų | 190 | 104.4 Ų | 104.4 | 83% | 0.826 | 60% | 0.6 | S | S | * | * | trans | -120.9 | 8 | -155.3 | -149.2 | 178.8 | -177.1 | -178 | 0 | 114.7 | G163 C167 | G163-K165 PolarHBondContact O-N 2.68Å; K165-C167 PolarHBondContact O-N 3.46Å | ||
| 166 | L | 46.1 | Very low | 64.8 | Low | 138 Ų | 138 | 101.1 Ų | 101.1 | 72% | 0.723 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -78 | 66.5 | 167.1 | -88.9 | 160.4 | 0 | 0 | 0 | 110.3 | C150 | C150-L166 HydrophobicContact CB-CD1 4.29Š|
| 167 | C | 55.4 | Low | 66.7 | Low | 76 Ų | 76 | 97.9 Ų | 97.9 | 51% | 0.514 | 55% | 0.55 | S | S | . | . | trans | 60.9 | 141.8 | -175.5 | -63.3 | 0 | 0 | 0 | 0 | 116 | K165 S169 T172 | K165-C167 PolarHBondContact O-N 3.46Å; C167-S169 PolarHBondContact O-N 2.84Å; C167-T172 WeakPolarHBondContact CB-OG1 3.41Å | ||
| 168 | D | 76.9 | Confident | 68.7 | Low | 79 Ų | 79 | 92.6 Ų | 92.6 | 42% | 0.422 | 54% | 0.537 | S | S | . | . | trans | -60.7 | 131.2 | 161.5 | 175.7 | 2.7 | 0 | 0 | 0 | 108.3 | R170 V171 T172 | D168-R170 PolarHBondContact O-N 2.89Å; D168-R170 WeakPolarHBondContact OD1-CG 3.45Å; D168-R170 PolarHBondContact OD1-N 3.18Å; D168-R170 WeakPolarHBondContact OD2-CB 3.41Å; D168-R170 WeakPolarHBondContact OD2-CD 3.43Å; D168-V171 HydrophobicContact CB-CB 4.43Å; D168-V171 HydrophobicContact CB-CG2 4.12Å; D168-V171 WeakPolarHBondContact O-CA 3.42Å; D168-V171 WeakPolarHBondContact O-CB 3.16Å; D168-V171 PolarHBondContact O-N 3.41Å; D168-T172 PolarHBondContact O-N 3.13Å; D168-T172 PolarHBondContact O-OG1 2.82Å | ||
| 169 | S | 80.5 | Confident | 70.6 | Confident | 30 Ų | 30 | 87.2 Ų | 87.2 | 21% | 0.21 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -46.8 | -31.4 | 171.1 | 58.4 | 0 | 0 | 0 | 0 | 114 | F87 C167 T173 | F87-S169 WeakPolarHBondContact CE1-O 3.4Å; C167-S169 PolarHBondContact O-N 2.84Å; S169-T173 VanDerWaalsContact O-CB 3.22Å; S169-T173 WeakPolarHBondContact O-CB 3.42Å; S169-T173 PolarHBondContact O-N 2.83Å; S169-T173 PolarHBondContact O-OG1 2.92Å |
| 170 | R | 84.7 | Confident | 72.6 | Confident | 176 Ų | 176 | 82.9 Ų | 82.9 | 66% | 0.664 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -66.7 | -47.1 | 173.2 | -56.7 | 176.1 | -176.9 | -170.3 | 0.6 | 112.2 | F87 D168 T173 A174 | F87-R170 HydrophobicContact CE1-CG 4.4Å; F87-R170 HydrophobicContact CZ-CG 4.28Å; D168-R170 PolarHBondContact O-N 2.89Å; D168-R170 WeakPolarHBondContact OD1-CG 3.45Å; D168-R170 PolarHBondContact OD1-N 3.18Å; D168-R170 WeakPolarHBondContact OD2-CB 3.41Å; D168-R170 WeakPolarHBondContact OD2-CD 3.43Å; R170-T173 PolarHBondContact O-N 3.24Å; R170-A174 WeakPolarHBondContact O-CB 3.29Å; R170-A174 PolarHBondContact O-N 2.93Å |
| 171 | V | 87.3 | Confident | 74.9 | Confident | 75 Ų | 75 | 84.1 Ų | 84.1 | 46% | 0.455 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.7 | -45.9 | 177.5 | 176 | 0 | 0 | 0 | 0 | 110.3 | D168 T173 A174 L175 | D168-V171 HydrophobicContact CB-CB 4.43Å; D168-V171 HydrophobicContact CB-CG2 4.12Å; D168-V171 WeakPolarHBondContact O-CA 3.42Å; D168-V171 WeakPolarHBondContact O-CB 3.16Å; D168-V171 PolarHBondContact O-N 3.41Å; V171-T173 VanDerWaalsContact C-N 3.32Å; V171-T173 PolarHBondContact O-N 2.98Å; V171-A174 PolarHBondContact O-N 2.95Å; V171-L175 HydrophobicContact CG1-CD1 4.18Å; V171-L175 WeakPolarHBondContact O-CG 3.44Å; V171-L175 PolarHBondContact O-N 2.93Å |
| 172 | T | 87.3 | Confident | 77 | Confident | 34 Ų | 34 | 82.5 Ų | 82.5 | 21% | 0.209 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -58.4 | -44 | 174.8 | -54.9 | 0 | 0 | 0 | 0 | 111.4 | F88 C167 D168 L175 I176 | F88-T172 HydrophobicContact CE1-CG2 4.11Å; F88-T172 HydrophobicContact CZ-CG2 3.91Å; C167-T172 WeakPolarHBondContact CB-OG1 3.41Å; D168-T172 PolarHBondContact O-N 3.13Å; D168-T172 PolarHBondContact O-OG1 2.82Å; T172-L175 PolarHBondContact O-N 3.25Å; T172-I176 HydrophobicContact CG2-CD1 4.06Å; T172-I176 VanDerWaalsContact O-CG1 3.23Å; T172-I176 WeakPolarHBondContact O-CG1 3.34Å; T172-I176 PolarHBondContact O-N 2.88Å |
| 173 | T | 90.6 | Very high | 78.9 | Confident | 7 Ų | 7 | 75.4 Ų | 75.4 | 4% | 0.043 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -64.8 | -39.8 | 175.3 | -74.3 | 0 | 0 | 0 | 0 | 112.8 | F87 F88 N91 F140 S169 R170 V171 I176 W177 | F87-T173 HydrophobicContact CE1-CG2 3.9Å; F87-T173 VanDerWaalsContact CE1-OG1 3.28Å; F87-T173 WeakPolarHBondContact CE1-OG1 3.29Å; F87-T173 HydrophobicContact CZ-CG2 4.39Å; F88-T173 WeakPolarHBondContact CD1-OG1 3.35Å; F88-T173 WeakPolarHBondContact CE1-OG1 3.45Å; N91-T173 HydrophobicContact CB-CG2 4.39Å; N91-T173 WeakPolarHBondContact OD1-CG2 3.34Å; F140-T173 HydrophobicContact CE1-CG2 4.17Å; F140-T173 HydrophobicContact CZ-CG2 4.18Å; S169-T173 VanDerWaalsContact O-CB 3.22Å; S169-T173 WeakPolarHBondContact O-CB 3.42Å; S169-T173 PolarHBondContact O-N 2.83Å; S169-T173 PolarHBondContact O-OG1 2.92Å; R170-T173 PolarHBondContact O-N 3.24Å; V171-T173 VanDerWaalsContact C-N 3.32Å; V171-T173 PolarHBondContact O-N 2.98Å; T173-I176 PolarHBondContact O-N 3.29Å; T173-W177 VanDerWaalsContact O-CD1 3.24Å; T173-W177 PolarHBondContact O-N 2.76Å |
| 174 | A | 91.7 | Very high | 81.1 | Confident | 59 Ų | 59 | 72.8 Ų | 72.8 | 49% | 0.488 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.9 | -41.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | R170 V171 I176 W177 A178 | R170-A174 WeakPolarHBondContact O-CB 3.29Å; R170-A174 PolarHBondContact O-N 2.93Å; V171-A174 PolarHBondContact O-N 2.95Å; A174-I176 VanDerWaalsContact C-N 3.35Å; A174-W177 PolarHBondContact O-N 3.47Å; A174-A178 WeakPolarHBondContact O-CB 3.45Å; A174-A178 PolarHBondContact O-N 2.91Å |
| 175 | L | 91.3 | Very high | 82.9 | Confident | 115 Ų | 115 | 65 Ų | 65 | 60% | 0.602 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -63.7 | -38.4 | 173.3 | -68.2 | 170.9 | 0 | 0 | 0 | 112.1 | V171 T172 G179 | V171-L175 HydrophobicContact CG1-CD1 4.18Å; V171-L175 WeakPolarHBondContact O-CG 3.44Å; V171-L175 PolarHBondContact O-N 2.93Å; T172-L175 PolarHBondContact O-N 3.25Å; L175-G179 PolarHBondContact O-N 2.85Å |
| 176 | I | 92.9 | Very high | 84.5 | Confident | 16 Ų | 16 | 57.4 Ų | 57.4 | 8% | 0.082 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -64 | -47.9 | 174.6 | -71.6 | 165.6 | 0 | 0 | 0 | 111.2 | F139 F140 A143 T172 T173 A174 G179 A180 | F139-I176 HydrophobicContact CB-CB 4.38Å; F139-I176 HydrophobicContact CB-CG1 4.16Å; F139-I176 HydrophobicContact CB-CG2 3.58Å; F139-I176 HydrophobicContact CG-CG2 4.5Å; F140-I176 HydrophobicContact CD1-CD1 3.71Å; F140-I176 HydrophobicContact CD1-CG2 3.89Å; F140-I176 HydrophobicContact CD2-CG2 4.07Å; F140-I176 HydrophobicContact CE1-CB 3.98Å; F140-I176 HydrophobicContact CE1-CD1 3.75Å; F140-I176 HydrophobicContact CE1-CG1 4.48Å; F140-I176 HydrophobicContact CE1-CG2 3.55Å; F140-I176 HydrophobicContact CE2-CG2 3.75Å; F140-I176 HydrophobicContact CG-CG2 4.11Å; F140-I176 HydrophobicContact CZ-CB 4.13Å; F140-I176 HydrophobicContact CZ-CG2 3.44Å; F140-I176 VanDerWaalsContact CZ-CG2 3.44Å; A143-I176 HydrophobicContact CB-CD1 3.66Å; T172-I176 HydrophobicContact CG2-CD1 4.06Å; T172-I176 VanDerWaalsContact O-CG1 3.23Å; T172-I176 WeakPolarHBondContact O-CG1 3.34Å; T172-I176 PolarHBondContact O-N 2.88Å; T173-I176 PolarHBondContact O-N 3.29Å; A174-I176 VanDerWaalsContact C-N 3.35Å; I176-G179 PolarHBondContact O-N 3.48Å; I176-A180 VanDerWaalsContact O-CB 3.23Å; I176-A180 WeakPolarHBondContact O-CB 3.48Å; I176-A180 PolarHBondContact O-N 3.29Å |
| 177 | W | 95 | Very high | 85.9 | Confident | 54 Ų | 54 | 53 Ų | 53 | 21% | 0.205 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -63.1 | -41.8 | 177.3 | -79.9 | 115.7 | 0 | 0 | 0 | 112.1 | N91 L94 A95 L98 L132 A136 F140 T173 A174 A180 L181 | N91-W177 HydrophobicContact CB-CZ2 4.45Å; N91-W177 PolarHBondContact OD1-NE1 3.06Å; L94-W177 HydrophobicContact CD2-CZ2 4.27Å; A95-W177 HydrophobicContact CB-CH2 3.83Å; A95-W177 HydrophobicContact CB-CZ3 4.5Å; L98-W177 HydrophobicContact CD1-CH2 4.35Å; L132-W177 HydrophobicContact CD1-CE3 4.24Å; L132-W177 HydrophobicContact CD1-CZ3 4.33Å; L132-W177 HydrophobicContact CD2-CE3 4.49Å; L132-W177 HydrophobicContact CD2-CZ3 4Å; L132-W177 HydrophobicContact CG-CE3 4.47Å; L132-W177 HydrophobicContact CG-CZ3 4.06Å; A136-W177 HydrophobicContact CB-CZ3 4.28Å; F140-W177 HydrophobicContact CE2-CZ2 4.21Å; F140-W177 AromaticContact CZ-NE1 3.73Å; T173-W177 VanDerWaalsContact O-CD1 3.24Å; T173-W177 PolarHBondContact O-N 2.76Å; A174-W177 PolarHBondContact O-N 3.47Å; W177-A180 PolarHBondContact O-N 2.89Å; W177-L181 VanDerWaalsContact O-CB 3.28Å; W177-L181 WeakPolarHBondContact O-CB 3.38Å; W177-L181 PolarHBondContact O-N 3.45Å |
| 178 | A | 93.9 | Very high | 87 | Confident | 54 Ų | 54 | 50.1 Ų | 50.1 | 45% | 0.446 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -63.4 | -47.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A174 A180 L181 V182 | A174-A178 WeakPolarHBondContact O-CB 3.45Å; A174-A178 PolarHBondContact O-N 2.91Å; A178-A180 PolarHBondContact O-N 3.5Å; A178-L181 PolarHBondContact O-N 2.88Å; A178-V182 WeakPolarHBondContact O-CG2 3.45Å; A178-V182 PolarHBondContact O-N 3.43Å |
| 179 | G | 90 | Very high | 87.1 | Confident | 29 Ų | 29 | 50.9 Ų | 50.9 | 30% | 0.299 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63.3 | -40.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L175 I176 V182 A183 | L175-G179 PolarHBondContact O-N 2.85Å; I176-G179 PolarHBondContact O-N 3.48Å; G179-V182 PolarHBondContact O-N 3.12Å; G179-A183 WeakPolarHBondContact O-CB 3.43Å; G179-A183 PolarHBondContact O-N 2.92Å |
| 180 | A | 91.8 | Very high | 86.8 | Confident | 0 Ų | 0 | 51.1 Ų | 51.1 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.8 | -40.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112 | L132 A136 F139 I176 W177 A178 A183 A184 | L132-A180 HydrophobicContact CD1-CB 3.85Å; A136-A180 HydrophobicContact CB-CB 4Å; F139-A180 HydrophobicContact CD2-CB 4.16Å; F139-A180 HydrophobicContact CE2-CB 4.44Å; I176-A180 VanDerWaalsContact O-CB 3.23Å; I176-A180 WeakPolarHBondContact O-CB 3.48Å; I176-A180 PolarHBondContact O-N 3.29Å; W177-A180 PolarHBondContact O-N 2.89Å; A178-A180 PolarHBondContact O-N 3.5Å; A180-A183 PolarHBondContact O-N 3.35Å; A180-A184 WeakPolarHBondContact O-CB 3.43Å; A180-A184 PolarHBondContact O-N 2.82Å |
| 181 | L | 91.8 | Very high | 86.2 | Confident | 88 Ų | 88 | 42.8 Ų | 42.8 | 46% | 0.461 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -66.9 | -42.7 | 176.9 | -174.1 | 66.2 | 0 | 0 | 0 | 111.7 | L128 L132 W177 A178 A184 A185 | L128-L181 HydrophobicContact CD1-CD1 4.11Å; L128-L181 HydrophobicContact CD2-CD1 4.39Å; L132-L181 HydrophobicContact CD1-CB 4.22Å; L132-L181 HydrophobicContact CD1-CD1 4.39Å; W177-L181 VanDerWaalsContact O-CB 3.28Å; W177-L181 WeakPolarHBondContact O-CB 3.38Å; W177-L181 PolarHBondContact O-N 3.45Å; A178-L181 PolarHBondContact O-N 2.88Å; L181-A184 PolarHBondContact O-N 3.49Å; L181-A185 WeakPolarHBondContact O-CB 3.42Å; L181-A185 PolarHBondContact O-N 2.9Å |
| 182 | V | 89.6 | Confident | 85.6 | Confident | 103 Ų | 103 | 41 Ų | 41 | 62% | 0.624 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -63.4 | -42.9 | 175.7 | 169.8 | 0 | 0 | 0 | 0 | 111.4 | A178 G179 A184 A185 P186 | A178-V182 WeakPolarHBondContact O-CG2 3.45Å; A178-V182 PolarHBondContact O-N 3.43Å; G179-V182 PolarHBondContact O-N 3.12Å; V182-A184 VanDerWaalsContact C-N 3.33Å; V182-A184 PolarHBondContact O-N 3.27Å; V182-A185 PolarHBondContact O-N 3.03Å; V182-P186 WeakPolarHBondContact O-CD 3.1Å |
| 183 | A | 86.3 | Confident | 85 | Confident | 4 Ų | 4 | 41.2 Ų | 41.2 | 3% | 0.033 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -69.9 | -28.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y135 G179 A180 F225 L229 | Y135-A183 HydrophobicContact CD1-CB 3.67Å; Y135-A183 HydrophobicContact CD2-CB 3.64Å; Y135-A183 HydrophobicContact CE1-CB 3.8Å; Y135-A183 HydrophobicContact CE2-CB 3.79Å; Y135-A183 WeakPolarHBondContact CE2-O 3.32Å; Y135-A183 HydrophobicContact CG-CB 3.58Å; Y135-A183 PolarHBondContact OH-O 3.1Å; G179-A183 WeakPolarHBondContact O-CB 3.43Å; G179-A183 PolarHBondContact O-N 2.92Å; A180-A183 PolarHBondContact O-N 3.35Å; A183-F225 HydrophobicContact CB-CD1 4.22Å; A183-L229 HydrophobicContact CB-CD2 4.48Å |
| 184 | A | 87.4 | Confident | 83.9 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -81.5 | -24.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | L128 L132 Y135 A180 L181 V182 R187 A188 | L128-A184 HydrophobicContact CD1-CB 3.87Å; L132-A184 HydrophobicContact CB-CB 4.22Å; Y135-A184 HydrophobicContact CD2-CB 4.04Å; Y135-A184 HydrophobicContact CE2-CB 4.17Å; A180-A184 WeakPolarHBondContact O-CB 3.43Å; A180-A184 PolarHBondContact O-N 2.82Å; L181-A184 PolarHBondContact O-N 3.49Å; V182-A184 VanDerWaalsContact C-N 3.33Å; V182-A184 PolarHBondContact O-N 3.27Å; A184-R187 WeakPolarHBondContact O-CB 3.36Å; A184-R187 PolarHBondContact O-N 3.3Å; A184-A188 PolarHBondContact O-N 3.23Å |
| 185 | A | 84.1 | Confident | 82.4 | Confident | 38 Ų | 38 | 48.3 Ų | 48.3 | 31% | 0.314 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -54.3 | -42.5 | -175 | 0 | 0 | 0 | 0 | 0 | 114 | L181 V182 R187 A188 V189 | L181-A185 WeakPolarHBondContact O-CB 3.42Å; L181-A185 PolarHBondContact O-N 2.9Å; V182-A185 PolarHBondContact O-N 3.03Å; A185-R187 VanDerWaalsContact C-N 3.31Å; A185-R187 PolarHBondContact O-N 3.45Å; A185-A188 PolarHBondContact O-N 3.47Å; A185-V189 WeakPolarHBondContact O-CG2 3.01Å; A185-V189 PolarHBondContact O-N 3.1Å |
| 186 | P | 79.6 | Confident | 80.7 | Confident | 31 Ų | 31 | 43.8 Ų | 43.8 | 20% | 0.201 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -56.2 | -40.4 | 174.8 | -26.9 | 35.5 | 0 | 0 | 0 | 113.6 | V182 A188 V189 F190 | V182-P186 WeakPolarHBondContact O-CD 3.1Å; P186-A188 PolarHBondContact O-N 3.4Å; P186-V189 PolarHBondContact O-N 3.13Å; P186-F190 HydrophobicContact CB-CD2 4.29Å; P186-F190 HydrophobicContact CB-CE2 4.37Å; P186-F190 WeakPolarHBondContact O-CB 3.32Å; P186-F190 WeakPolarHBondContact O-CD2 3.46Å; P186-F190 PolarHBondContact O-N 2.87Å; P186-F190 VanDerWaalsContact O-N 3.08Å |
| 187 | R | 75.3 | Confident | 78.8 | Confident | 46 Ų | 46 | 44.8 Ų | 44.8 | 17% | 0.174 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.7 | -33.7 | 176.4 | -93.7 | -175.6 | 178 | -123.2 | 0.6 | 112.4 | A184 A185 A191 L206 Y279 | A184-R187 WeakPolarHBondContact O-CB 3.36Å; A184-R187 PolarHBondContact O-N 3.3Å; A185-R187 VanDerWaalsContact C-N 3.31Å; A185-R187 PolarHBondContact O-N 3.45Å; R187-A191 VanDerWaalsContact O-CB 3.25Å; R187-A191 WeakPolarHBondContact O-CB 3.44Å; R187-A191 PolarHBondContact O-N 2.75Å; R187-L206 HydrophobicContact CG-CD2 4.28Å; R187-Y279 PolarHBondContact NH2-OH 2.93Å |
| 188 | A | 79.4 | Confident | 76.6 | Confident | 15 Ų | 15 | 51.8 Ų | 51.8 | 12% | 0.124 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -89.4 | -31.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | K124 L128 A184 A185 P186 | K124-A188 WeakPolarHBondContact CD-O 3.41Å; K124-A188 WeakPolarHBondContact CE-O 3.17Å; K124-A188 WeakPolarHBondContact CG-O 3.45Å; L128-A188 HydrophobicContact CB-CB 3.7Å; L128-A188 HydrophobicContact CD1-CB 3.69Å; L128-A188 HydrophobicContact CG-CB 4.15Å; A184-A188 PolarHBondContact O-N 3.23Å; A185-A188 PolarHBondContact O-N 3.47Å; P186-A188 PolarHBondContact O-N 3.4Å |
| 189 | V | 79.2 | Confident | 74.8 | Confident | 95 Ų | 95 | 52.6 Ų | 52.6 | 58% | 0.576 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -67.8 | -45.9 | 174.8 | 170.1 | 0 | 0 | 0 | 0 | 110.3 | A185 P186 | A185-V189 WeakPolarHBondContact O-CG2 3.01Å; A185-V189 PolarHBondContact O-N 3.1Å; P186-V189 PolarHBondContact O-N 3.13Å |
| 190 | F | 73.2 | Confident | 73.3 | Confident | 35 Ų | 35 | 56.1 Ų | 56.1 | 15% | 0.154 | 31% | 0.313 | C | S | . | . | S | Bend | trans | -87.2 | -6.9 | -178.9 | -61.5 | -60.8 | 0 | 0 | 0 | 114.7 | P186 D192 L206 R207 F208 N218 | P186-F190 HydrophobicContact CB-CD2 4.29Å; P186-F190 HydrophobicContact CB-CE2 4.37Å; P186-F190 WeakPolarHBondContact O-CB 3.32Å; P186-F190 WeakPolarHBondContact O-CD2 3.46Å; P186-F190 PolarHBondContact O-N 2.87Å; P186-F190 VanDerWaalsContact O-N 3.08Å; F190-D192 PolarHBondContact O-N 3.27Å; F190-L206 HydrophobicContact CB-CG 4.44Å; F190-L206 CarbonylContact O-C 3.6Å; F190-L206 VanDerWaalsContact O-CA 3.32Å; F190-L206 WeakPolarHBondContact O-CA 2.77Å; F190-R207 PolarHBondContact O-N 2.92Å; F190-F208 HydrophobicContact CB-CD1 4Å; F190-F208 HydrophobicContact CB-CE1 3.76Å; F190-F208 AromaticContact CD1-CD1 3.75Å; F190-F208 HydrophobicContact CD1-CD1 3.75Å; F190-F208 HydrophobicContact CD1-CE1 4.17Å; F190-F208 AromaticContact CD2-CD1 3.97Å; F190-F208 HydrophobicContact CD2-CD1 3.97Å; F190-F208 AromaticContact CD2-CE1 3.57Å; F190-F208 HydrophobicContact CD2-CE1 3.57Å; F190-F208 HydrophobicContact CE1-CD1 4.18Å; F190-F208 HydrophobicContact CE2-CD1 4.37Å; F190-F208 HydrophobicContact CE2-CE1 4.17Å; F190-F208 AromaticContact CG-CD1 3.64Å; F190-F208 HydrophobicContact CG-CD1 3.64Å; F190-F208 AromaticContact CG-CE1 3.58Å; F190-F208 HydrophobicContact CG-CE1 3.58Å; F190-F208 HydrophobicContact CZ-CD1 4.47Å; F190-N218 WeakPolarHBondContact CZ-OD1 3.35Å |
| 191 | A | 72.9 | Confident | 72 | Confident | 0 Ų | 0 | 57.7 Ų | 57.7 | 0% | 0 | 32% | 0.321 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.8 | 122.9 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | K124 R187 L206 | K124-A191 WeakPolarHBondContact CE-O 3.25Å; K124-A191 HydrophobicContact CG-CB 4.17Å; K124-A191 WeakPolarHBondContact CG-O 3.29Å; R187-A191 VanDerWaalsContact O-CB 3.25Å; R187-A191 WeakPolarHBondContact O-CB 3.44Å; R187-A191 PolarHBondContact O-N 2.75Å; A191-L206 HydrophobicContact CB-CD1 4.47Å |
| 192 | D | 75.2 | Confident | 71.2 | Confident | 39 Ų | 39 | 55 Ų | 55 | 21% | 0.209 | 31% | 0.308 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.2 | 164.3 | -178.5 | -165.6 | 22.3 | 0 | 0 | 0 | 111 | F190 L205 R207 | F190-D192 PolarHBondContact O-N 3.27Å; D192-L205 PolarHBondContact N-O 3.01Å; D192-L205 PolarHBondContact O-N 3.08Å; D192-L205 VanDerWaalsContact O-O 3.11Å; D192-R207 HydrophobicContact CB-CB 3.68Å; D192-R207 WeakPolarHBondContact OD2-CD 3.27Å; D192-R207 IonicContact OD2-CZ 3.96Å; D192-R207 IonicContact OD2-NE 3.76Å; D192-R207 IonicContact OD2-NH1 2.85Å; D192-R207 PolarHBondContact OD2-NH1 3.35Å |
| 193 | L | 74.4 | Confident | 70.2 | Confident | 37 Ų | 37 | 50.4 Ų | 50.4 | 19% | 0.194 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.9 | 109.1 | 171 | -75.6 | -179.7 | 0 | 0 | 0 | 110.6 | W116 L120 C123 C204 | W116-L193 HydrophobicContact CB-CD2 4Å; W116-L193 HydrophobicContact CG-CD2 4Å; L120-L193 HydrophobicContact CB-CD1 4.11Å; L120-L193 HydrophobicContact CB-CG 4.44Å; L120-L193 HydrophobicContact CD1-CB 4.49Å; L120-L193 HydrophobicContact CD1-CG 4.27Å; L120-L193 VanDerWaalsContact N-CD1 3.34Å; C123-L193 HydrophobicContact CB-CD2 4.31Å; L193-C204 HydrophobicContact CD2-CB 4.17Å |
| 194 | N | 66.3 | Low | 69.6 | Low | 34 Ų | 34 | 50.8 Ų | 50.8 | 18% | 0.182 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.4 | 130.4 | 168 | -71 | -44.4 | 0 | 0 | 0 | 109.3 | T202 A203 L205 R207 | N194-T202 CarbonylContact O-C 3.6Å; N194-T202 WeakPolarHBondContact O-CA 3.45Å; N194-A203 PolarHBondContact N-O 3.49Å; N194-A203 VanDerWaalsContact N-O 3.14Å; N194-A203 PolarHBondContact O-N 3.09Å; N194-L205 HydrophobicContact CB-CD1 4.37Å; N194-R207 WeakPolarHBondContact OD1-CD 3.31Å; N194-R207 PolarHBondContact OD1-NE 3.49Å |
| 195 | R | 61.4 | Low | 68.7 | Low | 182 Ų | 182 | 53.6 Ų | 53.6 | 69% | 0.687 | 30% | 0.298 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -72.1 | 133.4 | 163.5 | -75.3 | 179.1 | 172.2 | 103.4 | 3.1 | 109.2 | N200 D201 T202 | R195-N200 WeakPolarHBondContact CD-OD1 3.44Å; R195-N200 PolarHBondContact NE-OD1 3.28Å; R195-D201 CarbonylContact C-O 3.6Å; R195-D201 VanDerWaalsContact CA-O 3.27Å; R195-D201 WeakPolarHBondContact CA-O 3.25Å; R195-T202 HydrophobicContact CG-CG2 3.79Å |
| 196 | V | 54.6 | Low | 67.7 | Low | 20 Ų | 20 | 54 Ų | 54 | 12% | 0.121 | 29% | 0.294 | C | S | . | . | trans | -126.4 | 114.6 | -176.5 | -175.8 | 0 | 0 | 0 | 0 | 109.6 | F12 I15 D201 A203 | F12-V196 HydrophobicContact CD2-CG1 4.18Å; F12-V196 HydrophobicContact CE2-CG1 4.17Å; F12-V196 HydrophobicContact CE2-CG2 4.49Å; I15-V196 HydrophobicContact CD1-CG1 4.31Å; V196-D201 PolarHBondContact N-O 3.26Å; V196-A203 HydrophobicContact CG2-CB 4Å | ||
| 197 | G | 52.8 | Low | 66.8 | Low | 37 Ų | 37 | 58.8 Ų | 58.8 | 38% | 0.381 | 31% | 0.308 | S | S | . | . | S | Bend | trans | 80.3 | -178.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | A199 | G197-A199 PolarHBondContact O-N 2.92Š|
| 198 | M | 50.2 | Low | 66.1 | Low | 200 Ų | 200 | 58.1 Ų | 58.1 | 99% | 0.985 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.3 | -21 | -171.9 | -64.4 | -65.8 | -140.8 | 0 | 0 | 114.5 | N200 | M198-N200 VanDerWaalsContact C-N 3.34Å; M198-N200 PolarHBondContact O-N 2.88Å |
| 199 | A | 54.6 | Low | 64.9 | Low | 72 Ų | 72 | 60.5 Ų | 60.5 | 60% | 0.595 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.1 | 13.5 | -168.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | G197 D201 | G197-A199 PolarHBondContact O-N 2.92Å; A199-D201 PolarHBondContact O-N 3.46Å |
| 200 | N | 60.2 | Low | 63.5 | Low | 103 Ų | 103 | 64.8 Ų | 64.8 | 55% | 0.551 | 33% | 0.332 | S | S | * | . | trans | 64.1 | 15.5 | -178.1 | -158.7 | 30.1 | 0 | 0 | 0 | 114.8 | R195 M198 | R195-N200 WeakPolarHBondContact CD-OD1 3.44Å; R195-N200 PolarHBondContact NE-OD1 3.28Å; M198-N200 VanDerWaalsContact C-N 3.34Å; M198-N200 PolarHBondContact O-N 2.88Å | ||
| 201 | D | 64.3 | Low | 62.7 | Low | 33 Ų | 33 | 65.1 Ų | 65.1 | 18% | 0.176 | 35% | 0.346 | C | S | . | . | trans | -55.5 | 143.8 | 169 | -67 | -26.9 | 0 | 0 | 0 | 110.7 | R8 N115 R195 V196 A199 | R8-D201 IonicContact CZ-OD2 3.28Å; R8-D201 VanDerWaalsContact CZ-OD2 3.28Å; R8-D201 IonicContact NH1-OD2 2.82Å; R8-D201 PolarHBondContact NH1-OD2 3.2Å; R8-D201 IonicContact NH2-OD2 2.78Å; R8-D201 PolarHBondContact NH2-OD2 2.93Å; N115-D201 PolarHBondContact ND2-OD1 3.35Å; R195-D201 CarbonylContact C-O 3.6Å; R195-D201 VanDerWaalsContact CA-O 3.27Å; R195-D201 WeakPolarHBondContact CA-O 3.25Å; V196-D201 PolarHBondContact N-O 3.26Å; A199-D201 PolarHBondContact O-N 3.46Å | ||
| 202 | T | 73.6 | Confident | 61.9 | Low | 31 Ų | 31 | 71 Ų | 71 | 19% | 0.19 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 117.5 | -176.7 | 49.7 | 0 | 0 | 0 | 0 | 112.2 | N115 W116 N194 R195 | N115-T202 PolarHBondContact OD1-N 2.87Å; N115-T202 PolarHBondContact OD1-O 3.3Å; W116-T202 WeakPolarHBondContact CA-O 3.01Å; W116-T202 WeakPolarHBondContact CB-O 3.33Å; W116-T202 PolarHBondContact N-O 3.41Å; W116-T202 PolarHBondContact O-OG1 3.41Å; N194-T202 CarbonylContact O-C 3.6Å; N194-T202 WeakPolarHBondContact O-CA 3.45Å; R195-T202 HydrophobicContact CG-CG2 3.79Å |
| 203 | A | 69.4 | Low | 61.2 | Low | 6 Ų | 6 | 75.7 Ų | 75.7 | 5% | 0.05 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.1 | 136.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y114 N194 V196 L205 | Y114-A203 WeakPolarHBondContact O-CA 3.41Å; Y114-A203 WeakPolarHBondContact O-CB 3.16Å; N194-A203 PolarHBondContact N-O 3.49Å; N194-A203 VanDerWaalsContact N-O 3.14Å; N194-A203 PolarHBondContact O-N 3.09Å; V196-A203 HydrophobicContact CG2-CB 4Å; A203-L205 HydrophobicContact CB-CD1 3.85Å; A203-L205 HydrophobicContact CB-CG 3.99Å; A203-L205 PolarHBondContact O-N 2.91Å |
| 204 | C | 74.5 | Confident | 60.8 | Low | 13 Ų | 13 | 80.5 Ų | 80.5 | 9% | 0.088 | 42% | 0.423 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.6 | 105 | 172.7 | 178.6 | 0 | 0 | 0 | 0 | 110.3 | W116 C123 L193 | W116-C204 HydrophobicContact CB-CB 3.9Å; W116-C204 HydrophobicContact CD2-CB 3.59Å; W116-C204 HydrophobicContact CE3-CB 3.68Å; W116-C204 HydrophobicContact CG-CB 3.68Å; W116-C204 HydrophobicContact CZ3-CB 4.46Å; C123-C204 WeakPolarHBondContact CA-SG 3.47Å; C123-C204 HydrophobicContact CB-CB 3.85Å; C123-C204 WeakPolarHBondContact CB-SG 3.46Å; C123-C204 VanDerWaalsContact SG-CA 3.53Å; C123-C204 WeakPolarHBondContact SG-CB 3.21Å; C123-C204 CovalentContact SG-SG 2.04Å; C123-C204 PolarHBondContact SG-SG 2.93Å; L193-C204 HydrophobicContact CD2-CB 4.17Å |
| 205 | L | 67.3 | Low | 60.7 | Low | 58 Ų | 58 | 82.8 Ų | 82.8 | 30% | 0.304 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 151.4 | -171.3 | -68.5 | 170.1 | 0 | 0 | 0 | 111 | F12 D192 N194 A203 R207 | F12-L205 HydrophobicContact CE1-CD1 4.31Å; F12-L205 HydrophobicContact CZ-CD1 3.99Å; D192-L205 PolarHBondContact N-O 3.01Å; D192-L205 PolarHBondContact O-N 3.08Å; D192-L205 VanDerWaalsContact O-O 3.11Å; N194-L205 HydrophobicContact CB-CD1 4.37Å; A203-L205 HydrophobicContact CB-CD1 3.85Å; A203-L205 HydrophobicContact CB-CG 3.99Å; A203-L205 PolarHBondContact O-N 2.91Å; L205-R207 PolarHBondContact O-N 2.98Å; L205-R207 VanDerWaalsContact O-N 3.16Å |
| 206 | L | 62.6 | Low | 60.9 | Low | 46 Ų | 46 | 76.8 Ų | 76.8 | 24% | 0.241 | 42% | 0.423 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.7 | 106.4 | 165.6 | -93.5 | 70.4 | 0 | 0 | 0 | 108.8 | R187 F190 A191 F208 | R187-L206 HydrophobicContact CG-CD2 4.28Å; F190-L206 HydrophobicContact CB-CG 4.44Å; F190-L206 CarbonylContact O-C 3.6Å; F190-L206 VanDerWaalsContact O-CA 3.32Å; F190-L206 WeakPolarHBondContact O-CA 2.77Å; A191-L206 HydrophobicContact CB-CD1 4.47Å; L206-F208 HydrophobicContact CB-CE2 4.33Å; L206-F208 HydrophobicContact CB-CZ 4.25Å; L206-F208 HydrophobicContact CD2-CZ 4.11Å |
| 207 | R | 62.7 | Low | 61.6 | Low | 132 Ų | 132 | 79 Ų | 79 | 50% | 0.498 | 44% | 0.437 | S | S | . | . | P | Polyproline II helix | trans | -101.1 | 118.8 | 176.9 | -170.5 | -170.5 | -168 | 171.6 | 6.8 | 109.6 | F190 D192 N194 L205 | F190-R207 PolarHBondContact O-N 2.92Å; D192-R207 HydrophobicContact CB-CB 3.68Å; D192-R207 WeakPolarHBondContact OD2-CD 3.27Å; D192-R207 IonicContact OD2-CZ 3.96Å; D192-R207 IonicContact OD2-NE 3.76Å; D192-R207 IonicContact OD2-NH1 2.85Å; D192-R207 PolarHBondContact OD2-NH1 3.35Å; N194-R207 WeakPolarHBondContact OD1-CD 3.31Å; N194-R207 PolarHBondContact OD1-NE 3.49Å; L205-R207 PolarHBondContact O-N 2.98Å; L205-R207 VanDerWaalsContact O-N 3.16Å |
| 208 | F | 59.1 | Low | 62.2 | Low | 32 Ų | 32 | 77.2 Ų | 77.2 | 14% | 0.14 | 42% | 0.419 | C | S | . | . | P | Polyproline II helix | trans | -95 | 144.1 | 172.6 | -59 | -67 | 0 | 0 | 0 | 110.1 | F190 L206 K210 N218 | F190-F208 HydrophobicContact CB-CD1 4Å; F190-F208 HydrophobicContact CB-CE1 3.76Å; F190-F208 AromaticContact CD1-CD1 3.75Å; F190-F208 HydrophobicContact CD1-CD1 3.75Å; F190-F208 HydrophobicContact CD1-CE1 4.17Å; F190-F208 AromaticContact CD2-CD1 3.97Å; F190-F208 HydrophobicContact CD2-CD1 3.97Å; F190-F208 AromaticContact CD2-CE1 3.57Å; F190-F208 HydrophobicContact CD2-CE1 3.57Å; F190-F208 HydrophobicContact CE1-CD1 4.18Å; F190-F208 HydrophobicContact CE2-CD1 4.37Å; F190-F208 HydrophobicContact CE2-CE1 4.17Å; F190-F208 AromaticContact CG-CD1 3.64Å; F190-F208 HydrophobicContact CG-CD1 3.64Å; F190-F208 AromaticContact CG-CE1 3.58Å; F190-F208 HydrophobicContact CG-CE1 3.58Å; F190-F208 HydrophobicContact CZ-CD1 4.47Å; L206-F208 HydrophobicContact CB-CE2 4.33Å; L206-F208 HydrophobicContact CB-CZ 4.25Å; L206-F208 HydrophobicContact CD2-CZ 4.11Å; F208-K210 PolarHBondContact O-N 2.96Å; F208-N218 HydrophobicContact CB-CB 4.15Å; F208-N218 HydrophobicContact CD1-CB 3.45Å; F208-N218 VanDerWaalsContact CD1-CB 3.45Å; F208-N218 VanDerWaalsContact CD1-CG 3.48Å; F208-N218 HydrophobicContact CD2-CB 4.48Å; F208-N218 HydrophobicContact CE1-CB 3.89Å; F208-N218 HydrophobicContact CG-CB 3.77Å |
| 209 | P | 55 | Low | 63.1 | Low | 65 Ų | 65 | 68 Ų | 68 | 42% | 0.422 | 37% | 0.373 | S | S | . | . | P | Polyproline II helix | trans | -61.4 | 134.7 | 176.3 | 25 | -34.2 | 0 | 0 | 0 | 110.8 | W214 | P209-W214 HydrophobicContact CG-CB 4.42Å; P209-W214 HydrophobicContact CG-CD2 4.48Å; P209-W214 HydrophobicContact CG-CG 4.34Å |
| 210 | K | 48.8 | Very low | 63.9 | Low | 185 Ų | 185 | 69.7 Ų | 69.7 | 80% | 0.804 | 37% | 0.371 | S | S | * | . | S | Bend | trans | -69.6 | 130.5 | 179.8 | -70.2 | -161 | 172.4 | -158.7 | 0 | 110.7 | F208 | F208-K210 PolarHBondContact O-N 2.96Š|
| 211 | G | 56.1 | Low | 64.6 | Low | 43 Ų | 43 | 67.4 Ų | 67.4 | 44% | 0.443 | 36% | 0.359 | S | S | . | . | S | Bend | trans | 156.5 | 133.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | N213 W214 L215 | G211-N213 PolarHBondContact O-N 3.33Å; G211-W214 PolarHBondContact O-N 3.45Å; G211-L215 PolarHBondContact O-N 3Å |
| 212 | T | 56.1 | Low | 64.8 | Low | 123 Ų | 123 | 69.4 Ų | 69.4 | 76% | 0.755 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -50.7 | -50 | -172.6 | 42.2 | 0 | 0 | 0 | 0 | 113.2 | W214 L215 | T212-W214 VanDerWaalsContact C-N 3.33Å; T212-W214 PolarHBondContact O-N 3.5Å; T212-L215 PolarHBondContact O-N 2.89Å |
| 213 | N | 61.4 | Low | 64.7 | Low | 138 Ų | 138 | 69.2 Ų | 69.2 | 74% | 0.738 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -67.1 | -30.6 | -179.1 | -63.9 | -8.7 | 0 | 0 | 0 | 113.3 | G211 V217 | G211-N213 PolarHBondContact O-N 3.33Å; N213-V217 VanDerWaalsContact O-CG2 3.3Å; N213-V217 WeakPolarHBondContact O-CG2 3.44Å |
| 214 | W | 65.1 | Low | 65.2 | Low | 138 Ų | 138 | 72.7 Ų | 72.7 | 52% | 0.523 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -83.4 | -29 | -179.9 | -98 | 113.5 | 0 | 0 | 0 | 112.9 | P209 G211 T212 V217 N218 | P209-W214 HydrophobicContact CG-CB 4.42Å; P209-W214 HydrophobicContact CG-CD2 4.48Å; P209-W214 HydrophobicContact CG-CG 4.34Å; G211-W214 PolarHBondContact O-N 3.45Å; T212-W214 VanDerWaalsContact C-N 3.33Å; T212-W214 PolarHBondContact O-N 3.5Å; W214-V217 HydrophobicContact CE3-CB 4.36Å; W214-V217 HydrophobicContact CE3-CG1 4.13Å; W214-V217 HydrophobicContact CZ3-CG1 4.02Å; W214-V217 PolarHBondContact O-N 3.35Å; W214-N218 VanDerWaalsContact O-CB 3.27Å; W214-N218 WeakPolarHBondContact O-CB 3.32Å; W214-N218 VanDerWaalsContact O-CG 3.25Å; W214-N218 PolarHBondContact O-N 2.9Å; W214-N218 PolarHBondContact O-ND2 2.82Å |
| 215 | L | 64.3 | Low | 65.3 | Low | 82 Ų | 82 | 74.7 Ų | 74.7 | 43% | 0.429 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -61.1 | -52.8 | 179.3 | -168 | 71.5 | 0 | 0 | 0 | 111.2 | G211 T212 V217 N218 Q219 | G211-L215 PolarHBondContact O-N 3Å; T212-L215 PolarHBondContact O-N 2.89Å; L215-V217 PolarHBondContact O-N 2.92Å; L215-N218 PolarHBondContact O-N 3.42Å; L215-Q219 WeakPolarHBondContact O-CB 3.1Å; L215-Q219 VanDerWaalsContact O-CD 3.29Å; L215-Q219 PolarHBondContact O-N 3.34Å; L215-Q219 PolarHBondContact O-OE1 3.47Å |
| 216 | A | 65.6 | Low | 65.3 | Low | 55 Ų | 55 | 72.8 Ų | 72.8 | 46% | 0.455 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -62.5 | -41.6 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q219 L220 | A216-Q219 PolarHBondContact O-N 3.11Å; A216-L220 WeakPolarHBondContact O-CB 3.11Å; A216-L220 PolarHBondContact O-N 2.85Å |
| 217 | V | 69.9 | Low | 65.7 | Low | 66 Ų | 66 | 72 Ų | 72 | 40% | 0.4 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.7 | -45.5 | 177.4 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | N213 W214 L215 L220 L221 | N213-V217 VanDerWaalsContact O-CG2 3.3Å; N213-V217 WeakPolarHBondContact O-CG2 3.44Å; W214-V217 HydrophobicContact CE3-CB 4.36Å; W214-V217 HydrophobicContact CE3-CG1 4.13Å; W214-V217 HydrophobicContact CZ3-CG1 4.02Å; W214-V217 PolarHBondContact O-N 3.35Å; L215-V217 PolarHBondContact O-N 2.92Å; V217-L220 PolarHBondContact O-N 3.36Å; V217-L221 HydrophobicContact CG1-CD1 4.19Å; V217-L221 WeakPolarHBondContact O-CD1 3.1Å; V217-L221 PolarHBondContact O-N 3.41Å |
| 218 | N | 65.8 | Low | 66.6 | Low | 1 Ų | 1 | 70 Ų | 70 | 1% | 0.005 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -65.6 | -40.1 | 179 | -77 | -40.8 | 0 | 0 | 0 | 112.3 | F190 F208 W214 L215 L221 R222 | F190-N218 WeakPolarHBondContact CZ-OD1 3.35Å; F208-N218 HydrophobicContact CB-CB 4.15Å; F208-N218 HydrophobicContact CD1-CB 3.45Å; F208-N218 VanDerWaalsContact CD1-CB 3.45Å; F208-N218 VanDerWaalsContact CD1-CG 3.48Å; F208-N218 HydrophobicContact CD2-CB 4.48Å; F208-N218 HydrophobicContact CE1-CB 3.89Å; F208-N218 HydrophobicContact CG-CB 3.77Å; W214-N218 VanDerWaalsContact O-CB 3.27Å; W214-N218 WeakPolarHBondContact O-CB 3.32Å; W214-N218 VanDerWaalsContact O-CG 3.25Å; W214-N218 PolarHBondContact O-N 2.9Å; W214-N218 PolarHBondContact O-ND2 2.82Å; L215-N218 PolarHBondContact O-N 3.42Å; N218-L221 WeakPolarHBondContact O-CB 3.44Å; N218-L221 PolarHBondContact O-N 2.85Å; N218-R222 WeakPolarHBondContact O-CB 3.28Å; N218-R222 PolarHBondContact O-N 2.85Å |
| 219 | Q | 68.1 | Low | 67.7 | Low | 6 Ų | 6 | 70.9 Ų | 70.9 | 3% | 0.028 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -66.9 | -41.3 | 175.5 | -93.4 | 70.1 | -57.5 | 0 | 0 | 111.3 | L215 A216 L221 R222 L223 Q290 L291 | L215-Q219 WeakPolarHBondContact O-CB 3.1Å; L215-Q219 VanDerWaalsContact O-CD 3.29Å; L215-Q219 PolarHBondContact O-N 3.34Å; L215-Q219 PolarHBondContact O-OE1 3.47Å; A216-Q219 PolarHBondContact O-N 3.11Å; Q219-L221 VanDerWaalsContact C-N 3.34Å; Q219-L221 PolarHBondContact O-N 3.49Å; Q219-R222 CarbonylContact O-C 3.53Å; Q219-R222 WeakPolarHBondContact O-CB 3Å; Q219-R222 PolarHBondContact O-N 3.44Å; Q219-R222 VanDerWaalsContact O-N 3.11Å; Q219-L223 WeakPolarHBondContact O-CG 3.43Å; Q219-L223 PolarHBondContact O-N 3.12Å; Q219-Q290 HydrophobicContact CG-CB 4.36Å; Q219-Q290 PolarHBondContact NE2-O 2.95Å; Q219-L291 HydrophobicContact CB-CD1 4.24Å; Q219-L291 HydrophobicContact CB-CD2 3.69Å; Q219-L291 HydrophobicContact CB-CG 4.01Å; Q219-L291 HydrophobicContact CG-CD2 4.05Å; Q219-L291 HydrophobicContact CG-CG 4.09Å |
| 220 | L | 73 | Confident | 68.7 | Low | 107 Ų | 107 | 68.1 Ų | 68.1 | 56% | 0.56 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -62 | -40.5 | 173.3 | -177 | 63 | 0 | 0 | 0 | 111.8 | A216 V217 L223 L224 | A216-L220 WeakPolarHBondContact O-CB 3.11Å; A216-L220 PolarHBondContact O-N 2.85Å; V217-L220 PolarHBondContact O-N 3.36Å; L220-L223 PolarHBondContact O-N 3.48Å; L220-L224 WeakPolarHBondContact O-CB 3.44Å; L220-L224 PolarHBondContact O-N 2.87Å |
| 221 | L | 73.5 | Confident | 70 | Confident | 56 Ų | 56 | 64 Ų | 64 | 29% | 0.293 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -61.6 | -42.2 | 171.1 | -101.2 | 66.1 | 0 | 0 | 0 | 111.5 | V217 N218 Q219 L223 L224 F225 | V217-L221 HydrophobicContact CG1-CD1 4.19Å; V217-L221 WeakPolarHBondContact O-CD1 3.1Å; V217-L221 PolarHBondContact O-N 3.41Å; N218-L221 WeakPolarHBondContact O-CB 3.44Å; N218-L221 PolarHBondContact O-N 2.85Å; Q219-L221 VanDerWaalsContact C-N 3.34Å; Q219-L221 PolarHBondContact O-N 3.49Å; L221-L223 VanDerWaalsContact C-N 3.34Å; L221-L223 PolarHBondContact O-N 2.92Å; L221-L224 PolarHBondContact O-N 3.36Å; L221-F225 HydrophobicContact CB-CD2 4.43Å; L221-F225 HydrophobicContact CG-CD2 4.17Å; L221-F225 HydrophobicContact CG-CE2 4.11Å; L221-F225 WeakPolarHBondContact O-CB 3.39Å; L221-F225 WeakPolarHBondContact O-CD2 3.47Å; L221-F225 PolarHBondContact O-N 3.32Å |
| 222 | R | 68.3 | Low | 71.3 | Confident | 75 Ų | 75 | 68.2 Ų | 68.2 | 28% | 0.283 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -65.2 | -36.6 | 178.9 | -157.9 | 178.2 | -159.8 | -159.8 | 2 | 112.1 | N218 Q219 G226 | N218-R222 WeakPolarHBondContact O-CB 3.28Å; N218-R222 PolarHBondContact O-N 2.85Å; Q219-R222 CarbonylContact O-C 3.53Å; Q219-R222 WeakPolarHBondContact O-CB 3Å; Q219-R222 PolarHBondContact O-N 3.44Å; Q219-R222 VanDerWaalsContact O-N 3.11Å; R222-G226 WeakPolarHBondContact O-CA 3.2Å; R222-G226 PolarHBondContact O-N 3.47Å |
| 223 | L | 72.4 | Confident | 72.5 | Confident | 27 Ų | 27 | 62.6 Ų | 62.6 | 14% | 0.141 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -72.9 | -46.5 | 173.2 | -69.9 | 172.2 | 0 | 0 | 0 | 112 | Q219 L220 L221 F227 L228 L284 A287 L291 | Q219-L223 WeakPolarHBondContact O-CG 3.43Å; Q219-L223 PolarHBondContact O-N 3.12Å; L220-L223 PolarHBondContact O-N 3.48Å; L221-L223 VanDerWaalsContact C-N 3.34Å; L221-L223 PolarHBondContact O-N 2.92Å; L223-F227 WeakPolarHBondContact O-CA 3.33Å; L223-F227 WeakPolarHBondContact O-CB 3.31Å; L223-F227 PolarHBondContact O-N 3.45Å; L223-L228 PolarHBondContact O-N 3.41Å; L223-L284 HydrophobicContact CD2-CD1 3.49Å; L223-L284 VanDerWaalsContact CD2-CD1 3.49Å; L223-A287 HydrophobicContact CD2-CB 3.71Å; L223-A287 HydrophobicContact CG-CB 4.22Å; L223-L291 HydrophobicContact CD1-CD1 4.09Å |
| 224 | L | 80.4 | Confident | 73.3 | Confident | 79 Ų | 79 | 56.3 Ų | 56.3 | 41% | 0.414 | 28% | 0.28 | S | S | . | . | I | π-helix | trans | -65.4 | -55.2 | -177.1 | -178.7 | 62.6 | 0 | 0 | 0 | 111.6 | L220 L221 L228 L229 | L220-L224 WeakPolarHBondContact O-CB 3.44Å; L220-L224 PolarHBondContact O-N 2.87Å; L221-L224 PolarHBondContact O-N 3.36Å; L224-L228 HydrophobicContact CD1-CB 4.41Å; L224-L228 HydrophobicContact CD1-CD1 4.34Å; L224-L229 WeakPolarHBondContact O-CB 3.36Å; L224-L229 PolarHBondContact O-N 3.01Å |
| 225 | F | 76 | Confident | 74 | Confident | 55 Ų | 55 | 53 Ų | 53 | 24% | 0.241 | 27% | 0.272 | C | S | . | . | I | π-helix | trans | -78.8 | -42.1 | 179.7 | -68.6 | -80 | 0 | 0 | 0 | 111.7 | Y135 A183 L221 L229 P230 | Y135-F225 VanDerWaalsContact CE1-O 3.28Å; Y135-F225 WeakPolarHBondContact CE1-O 3.29Å; Y135-F225 PolarHBondContact OH-O 3.18Å; A183-F225 HydrophobicContact CB-CD1 4.22Å; L221-F225 HydrophobicContact CB-CD2 4.43Å; L221-F225 HydrophobicContact CG-CD2 4.17Å; L221-F225 HydrophobicContact CG-CE2 4.11Å; L221-F225 WeakPolarHBondContact O-CB 3.39Å; L221-F225 WeakPolarHBondContact O-CD2 3.47Å; L221-F225 PolarHBondContact O-N 3.32Å; F225-L229 HydrophobicContact CD1-CD2 3.73Å; F225-L229 HydrophobicContact CE1-CD2 4.11Å; F225-P230 WeakPolarHBondContact O-CD 3.39Å; F225-P230 WeakPolarHBondContact O-CG 3.3Å |
| 226 | G | 67.1 | Low | 74.9 | Confident | 18 Ų | 18 | 51.9 Ų | 51.9 | 19% | 0.186 | 27% | 0.266 | C | S | . | . | I | π-helix | trans | -76.9 | -21.1 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | R222 N280 | R222-G226 WeakPolarHBondContact O-CA 3.2Å; R222-G226 PolarHBondContact O-N 3.47Å; G226-N280 PolarHBondContact O-OD1 3.37Å |
| 227 | F | 71.8 | Confident | 75.4 | Confident | 30 Ų | 30 | 49.2 Ų | 49.2 | 13% | 0.132 | 24% | 0.244 | C | C | . | . | I | π-helix | trans | -131.1 | -62.4 | -175.9 | 179.7 | -91.7 | 0 | 0 | 0 | 112.8 | L223 L229 Y231 N280 L284 | L223-F227 WeakPolarHBondContact O-CA 3.33Å; L223-F227 WeakPolarHBondContact O-CB 3.31Å; L223-F227 PolarHBondContact O-N 3.45Å; F227-L229 PolarHBondContact O-N 3.38Å; F227-Y231 VanDerWaalsContact O-CB 3.3Å; F227-Y231 WeakPolarHBondContact O-CB 3.3Å; F227-Y231 PolarHBondContact O-N 3.22Å; F227-Y231 VanDerWaalsContact O-N 3.12Å; F227-N280 HydrophobicContact CD2-CB 3.64Å; F227-N280 VanDerWaalsContact CD2-O 3.31Å; F227-N280 WeakPolarHBondContact CD2-O 3.35Å; F227-N280 HydrophobicContact CE2-CB 3.87Å; F227-L284 HydrophobicContact CD2-CB 4.1Å; F227-L284 HydrophobicContact CE1-CD2 4.07Å; F227-L284 HydrophobicContact CE2-CB 4.15Å; F227-L284 HydrophobicContact CE2-CD2 4.01Å; F227-L284 HydrophobicContact CZ-CD2 3.73Å |
| 228 | L | 80.6 | Confident | 75.6 | Confident | 90 Ų | 90 | 50.1 Ų | 50.1 | 47% | 0.471 | 24% | 0.241 | S | C | . | . | I | π-helix | trans | -64.5 | -46.9 | -169.6 | -67.7 | 173.6 | 0 | 0 | 0 | 112.7 | L223 L224 Y231 F232 | L223-L228 PolarHBondContact O-N 3.41Å; L224-L228 HydrophobicContact CD1-CB 4.41Å; L224-L228 HydrophobicContact CD1-CD1 4.34Å; L228-Y231 PolarHBondContact O-N 3.13Å; L228-F232 WeakPolarHBondContact O-CB 3.34Å; L228-F232 PolarHBondContact O-N 2.9Å |
| 229 | L | 82 | Confident | 76.2 | Confident | 50 Ų | 50 | 54.5 Ų | 54.5 | 26% | 0.262 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -65.2 | -51.8 | -177.3 | 175.8 | 67.2 | 0 | 0 | 0 | 112.2 | A183 L224 F225 F227 Y231 F232 I233 | A183-L229 HydrophobicContact CB-CD2 4.48Å; L224-L229 WeakPolarHBondContact O-CB 3.36Å; L224-L229 PolarHBondContact O-N 3.01Å; F225-L229 HydrophobicContact CD1-CD2 3.73Å; F225-L229 HydrophobicContact CE1-CD2 4.11Å; F227-L229 PolarHBondContact O-N 3.38Å; L229-Y231 VanDerWaalsContact C-N 3.33Å; L229-Y231 PolarHBondContact O-N 3.07Å; L229-F232 PolarHBondContact O-N 3.11Å; L229-I233 HydrophobicContact CD1-CD1 3.83Å; L229-I233 HydrophobicContact CD1-CG1 4.24Å; L229-I233 HydrophobicContact CG-CD1 3.85Å; L229-I233 VanDerWaalsContact O-CD1 3.31Å; L229-I233 WeakPolarHBondContact O-CD1 3.37Å; L229-I233 WeakPolarHBondContact O-CG1 3.45Å; L229-I233 PolarHBondContact O-N 3.22Å |
| 230 | P | 75.9 | Confident | 76.5 | Confident | 7 Ų | 7 | 55.7 Ų | 55.7 | 5% | 0.045 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -53.2 | -47.5 | 171.9 | -27.9 | 33.4 | 0 | 0 | 0 | 112.8 | Y135 F225 I233 M234 | Y135-P230 HydrophobicContact CD1-CG 4.23Å; Y135-P230 HydrophobicContact CE1-CG 3.75Å; F225-P230 WeakPolarHBondContact O-CD 3.39Å; F225-P230 WeakPolarHBondContact O-CG 3.3Å; P230-I233 PolarHBondContact O-N 3.46Å; P230-M234 WeakPolarHBondContact O-CB 3.49Å; P230-M234 VanDerWaalsContact O-CG 3.31Å; P230-M234 WeakPolarHBondContact O-CG 3.2Å; P230-M234 PolarHBondContact O-N 2.96Å |
| 231 | Y | 77.1 | Confident | 76.3 | Confident | 99 Ų | 99 | 50.9 Ų | 50.9 | 39% | 0.388 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -69 | -38.7 | -175.7 | -164.1 | -123.1 | 0 | 0 | 0 | 112.2 | F227 L228 L229 M234 I235 F277 | F227-Y231 VanDerWaalsContact O-CB 3.3Å; F227-Y231 WeakPolarHBondContact O-CB 3.3Å; F227-Y231 PolarHBondContact O-N 3.22Å; F227-Y231 VanDerWaalsContact O-N 3.12Å; L228-Y231 PolarHBondContact O-N 3.13Å; L229-Y231 VanDerWaalsContact C-N 3.33Å; L229-Y231 PolarHBondContact O-N 3.07Å; Y231-M234 PolarHBondContact O-N 2.82Å; Y231-I235 HydrophobicContact CD1-CD1 3.67Å; Y231-I235 HydrophobicContact CE1-CD1 3.47Å; Y231-I235 VanDerWaalsContact CE1-CD1 3.47Å; Y231-I235 HydrophobicContact CE1-CG1 4.39Å; Y231-I235 HydrophobicContact CE2-CD1 4.44Å; Y231-I235 HydrophobicContact CG-CD1 4.26Å; Y231-I235 WeakPolarHBondContact O-CB 3.48Å; Y231-I235 WeakPolarHBondContact O-CG1 3.45Å; Y231-I235 PolarHBondContact O-N 2.85Å; Y231-F277 HydrophobicContact CE2-CD2 4.21Å |
| 232 | F | 83.8 | Confident | 76.1 | Confident | 130 Ų | 130 | 51.4 Ų | 51.4 | 57% | 0.57 | 25% | 0.248 | S | C | * | . | H | α-helix | trans | -61.5 | -46.7 | 172.1 | 176.6 | -99.1 | 0 | 0 | 0 | 112.3 | L228 L229 M234 I235 L236 | L228-F232 WeakPolarHBondContact O-CB 3.34Å; L228-F232 PolarHBondContact O-N 2.9Å; L229-F232 PolarHBondContact O-N 3.11Å; F232-M234 VanDerWaalsContact C-N 3.33Å; F232-M234 PolarHBondContact O-N 3.4Å; F232-I235 PolarHBondContact O-N 2.93Å; F232-L236 HydrophobicContact CE1-CD2 4.08Å; F232-L236 HydrophobicContact CZ-CD2 4.14Å; F232-L236 VanDerWaalsContact O-CB 3.26Å; F232-L236 WeakPolarHBondContact O-CB 3.39Å; F232-L236 PolarHBondContact O-N 3.23Å |
| 233 | I | 81.2 | Confident | 76.3 | Confident | 5 Ų | 5 | 54.3 Ų | 54.3 | 3% | 0.026 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -59.5 | -45.6 | 176 | -66.4 | 158 | 0 | 0 | 0 | 110.3 | C138 F139 M142 L229 P230 L236 S237 | C138-I233 HydrophobicContact CB-CB 4.45Å; C138-I233 HydrophobicContact CB-CG2 3.86Å; F139-I233 HydrophobicContact CD1-CD1 3.94Å; F139-I233 HydrophobicContact CD1-CG2 4.4Å; F139-I233 HydrophobicContact CE1-CD1 3.32Å; F139-I233 HydrophobicContact CE1-CG1 4.1Å; F139-I233 HydrophobicContact CZ-CD1 3.79Å; M142-I233 HydrophobicContact CB-CG2 4.04Å; M142-I233 HydrophobicContact CG-CG2 4.36Å; M142-I233 HydrophobicContact SD-CG2 3.95Å; L229-I233 HydrophobicContact CD1-CD1 3.83Å; L229-I233 HydrophobicContact CD1-CG1 4.24Å; L229-I233 HydrophobicContact CG-CD1 3.85Å; L229-I233 VanDerWaalsContact O-CD1 3.31Å; L229-I233 WeakPolarHBondContact O-CD1 3.37Å; L229-I233 WeakPolarHBondContact O-CG1 3.45Å; L229-I233 PolarHBondContact O-N 3.22Å; P230-I233 PolarHBondContact O-N 3.46Å; I233-L236 PolarHBondContact O-N 3.39Å; I233-S237 WeakPolarHBondContact O-CB 3.41Å; I233-S237 PolarHBondContact O-N 3.15Å |
| 234 | M | 76.9 | Confident | 75.9 | Confident | 7 Ų | 7 | 53.9 Ų | 53.9 | 3% | 0.034 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -65.7 | -47.3 | -179.5 | -73.4 | -56.5 | -60.9 | 0 | 0 | 112.2 | C138 L141 P230 Y231 F232 L236 S237 Y238 V269 F272 C273 | C138-M234 HydrophobicContact CB-SD 4.32Å; L141-M234 HydrophobicContact CD1-CE 4.26Å; L141-M234 HydrophobicContact CD1-SD 4.29Å; P230-M234 WeakPolarHBondContact O-CB 3.49Å; P230-M234 VanDerWaalsContact O-CG 3.31Å; P230-M234 WeakPolarHBondContact O-CG 3.2Å; P230-M234 PolarHBondContact O-N 2.96Å; Y231-M234 PolarHBondContact O-N 2.82Å; F232-M234 VanDerWaalsContact C-N 3.33Å; F232-M234 PolarHBondContact O-N 3.4Å; M234-L236 PolarHBondContact O-N 2.89Å; M234-S237 PolarHBondContact O-N 3.27Å; M234-S237 PolarHBondContact O-OG 3.1Å; M234-Y238 PolarHBondContact O-N 3.39Å; M234-V269 HydrophobicContact CE-CB 4.49Å; M234-V269 HydrophobicContact CE-CG1 3.87Å; M234-V269 WeakPolarHBondContact CE-O 3.3Å; M234-F272 HydrophobicContact CE-CB 3.98Å; M234-F272 HydrophobicContact CE-CD1 3.69Å; M234-F272 HydrophobicContact CE-CG 4.2Å; M234-F272 HydrophobicContact CG-CD1 4.32Å; M234-F272 HydrophobicContact SD-CD1 3.75Å; M234-F272 HydrophobicContact SD-CE1 4.15Å; M234-C273 WeakPolarHBondContact CE-SG 3.32Å |
| 235 | I | 80.4 | Confident | 75.2 | Confident | 69 Ų | 69 | 52.6 Ų | 52.6 | 35% | 0.354 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -56.6 | -49.2 | 173.5 | -73.2 | 169 | 0 | 0 | 0 | 110.5 | Y231 F232 S237 Y238 L239 | Y231-I235 HydrophobicContact CD1-CD1 3.67Å; Y231-I235 HydrophobicContact CE1-CD1 3.47Å; Y231-I235 VanDerWaalsContact CE1-CD1 3.47Å; Y231-I235 HydrophobicContact CE1-CG1 4.39Å; Y231-I235 HydrophobicContact CE2-CD1 4.44Å; Y231-I235 HydrophobicContact CG-CD1 4.26Å; Y231-I235 WeakPolarHBondContact O-CB 3.48Å; Y231-I235 WeakPolarHBondContact O-CG1 3.45Å; Y231-I235 PolarHBondContact O-N 2.85Å; F232-I235 PolarHBondContact O-N 2.93Å; I235-S237 VanDerWaalsContact C-N 3.33Å; I235-S237 PolarHBondContact O-N 3.47Å; I235-Y238 CarbonylContact O-C 3.47Å; I235-Y238 PolarHBondContact O-N 3.21Å; I235-Y238 VanDerWaalsContact O-N 3.12Å; I235-L239 HydrophobicContact CG2-CD1 3.72Å; I235-L239 HydrophobicContact CG2-CG 4.12Å; I235-L239 WeakPolarHBondContact O-CG 3.48Å; I235-L239 PolarHBondContact O-N 3.03Å |
| 236 | L | 82.1 | Confident | 74.8 | Confident | 57 Ų | 57 | 53.4 Ų | 53.4 | 30% | 0.298 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -63.9 | -39 | -178.6 | -177 | 51.4 | 0 | 0 | 0 | 111.5 | M142 F232 I233 M234 Y238 L239 L240 | M142-L236 HydrophobicContact CE-CB 4.32Å; M142-L236 HydrophobicContact CE-CD2 3.47Å; M142-L236 VanDerWaalsContact CE-CD2 3.47Å; M142-L236 HydrophobicContact CE-CG 3.78Å; F232-L236 HydrophobicContact CE1-CD2 4.08Å; F232-L236 HydrophobicContact CZ-CD2 4.14Å; F232-L236 VanDerWaalsContact O-CB 3.26Å; F232-L236 WeakPolarHBondContact O-CB 3.39Å; F232-L236 PolarHBondContact O-N 3.23Å; I233-L236 PolarHBondContact O-N 3.39Å; M234-L236 PolarHBondContact O-N 2.89Å; L236-Y238 VanDerWaalsContact C-N 3.32Å; L236-Y238 PolarHBondContact O-N 3.28Å; L236-L239 PolarHBondContact O-N 3.46Å; L236-L240 HydrophobicContact CD1-CD1 4.33Å; L236-L240 HydrophobicContact CD1-CG 4.28Å; L236-L240 HydrophobicContact CG-CD1 4.3Å; L236-L240 WeakPolarHBondContact O-CB 3.31Å; L236-L240 VanDerWaalsContact O-CG 3.23Å; L236-L240 WeakPolarHBondContact O-CG 3.48Å; L236-L240 PolarHBondContact O-N 2.78Å |
| 237 | S | 77.1 | Confident | 74.4 | Confident | 0 Ų | 0 | 61.3 Ų | 61.3 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -62.2 | -38.2 | 173.3 | 84.7 | 0 | 0 | 0 | 0 | 112.6 | I233 M234 I235 L241 | I233-S237 WeakPolarHBondContact O-CB 3.41Å; I233-S237 PolarHBondContact O-N 3.15Å; M234-S237 PolarHBondContact O-N 3.27Å; M234-S237 PolarHBondContact O-OG 3.1Å; I235-S237 VanDerWaalsContact C-N 3.33Å; I235-S237 PolarHBondContact O-N 3.47Å; S237-L241 VanDerWaalsContact O-CB 3.29Å; S237-L241 WeakPolarHBondContact O-CB 3.22Å; S237-L241 PolarHBondContact O-N 2.99Å; S237-L241 VanDerWaalsContact O-N 3.12Å |
| 238 | Y | 74.3 | Confident | 73.6 | Confident | 84 Ų | 84 | 63 Ų | 63 | 33% | 0.329 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -72.5 | -41.3 | 177.4 | 176.1 | -103.7 | 0 | 0 | 0 | 112.2 | M234 I235 L236 L241 L242 V269 L270 | M234-Y238 PolarHBondContact O-N 3.39Å; I235-Y238 CarbonylContact O-C 3.47Å; I235-Y238 PolarHBondContact O-N 3.21Å; I235-Y238 VanDerWaalsContact O-N 3.12Å; L236-Y238 VanDerWaalsContact C-N 3.32Å; L236-Y238 PolarHBondContact O-N 3.28Å; Y238-L241 HydrophobicContact CD2-CD2 4.28Å; Y238-L241 CarbonylContact O-C 3.6Å; Y238-L241 WeakPolarHBondContact O-CB 3.05Å; Y238-L241 PolarHBondContact O-N 2.89Å; Y238-L242 HydrophobicContact CE1-CD2 4.26Å; Y238-L242 WeakPolarHBondContact O-CB 3.28Å; Y238-L242 PolarHBondContact O-N 3.49Å; Y238-V269 HydrophobicContact CD2-CG1 4.47Å; Y238-L270 HydrophobicContact CD2-CD2 4.05Å; Y238-L270 HydrophobicContact CD2-CG 4.48Å; Y238-L270 HydrophobicContact CE2-CD2 3.77Å; Y238-L270 HydrophobicContact CE2-CG 4.26Å |
| 239 | L | 78.1 | Confident | 72.2 | Confident | 93 Ų | 93 | 67.8 Ų | 67.8 | 49% | 0.487 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -66.1 | -39.6 | 176.7 | -69.8 | 176 | 0 | 0 | 0 | 111.9 | I235 L236 L242 R243 | I235-L239 HydrophobicContact CG2-CD1 3.72Å; I235-L239 HydrophobicContact CG2-CG 4.12Å; I235-L239 WeakPolarHBondContact O-CG 3.48Å; I235-L239 PolarHBondContact O-N 3.03Å; L236-L239 PolarHBondContact O-N 3.46Å; L239-L242 PolarHBondContact O-N 3.38Å; L239-R243 VanDerWaalsContact O-CB 3.25Å; L239-R243 WeakPolarHBondContact O-CB 3.07Å; L239-R243 PolarHBondContact O-N 2.81Å |
| 240 | L | 74.4 | Confident | 70.6 | Confident | 31 Ų | 31 | 72.4 Ų | 72.4 | 16% | 0.162 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62 | -43 | 172.8 | -72.9 | 169 | 0 | 0 | 0 | 111.7 | L236 F244 | L236-L240 HydrophobicContact CD1-CD1 4.33Å; L236-L240 HydrophobicContact CD1-CG 4.28Å; L236-L240 HydrophobicContact CG-CD1 4.3Å; L236-L240 WeakPolarHBondContact O-CB 3.31Å; L236-L240 VanDerWaalsContact O-CG 3.23Å; L236-L240 WeakPolarHBondContact O-CG 3.48Å; L236-L240 PolarHBondContact O-N 2.78Å; L240-F244 WeakPolarHBondContact O-CB 3.38Å; L240-F244 PolarHBondContact O-N 3.43Å |
| 241 | L | 68.9 | Low | 69 | Low | 7 Ų | 7 | 78.4 Ų | 78.4 | 4% | 0.037 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.5 | -41.7 | 174.7 | 166.8 | 74 | 0 | 0 | 0 | 112.7 | S237 Y238 F244 L245 V265 A266 | S237-L241 VanDerWaalsContact O-CB 3.29Å; S237-L241 WeakPolarHBondContact O-CB 3.22Å; S237-L241 PolarHBondContact O-N 2.99Å; S237-L241 VanDerWaalsContact O-N 3.12Å; Y238-L241 HydrophobicContact CD2-CD2 4.28Å; Y238-L241 CarbonylContact O-C 3.6Å; Y238-L241 WeakPolarHBondContact O-CB 3.05Å; Y238-L241 PolarHBondContact O-N 2.89Å; L241-F244 WeakPolarHBondContact O-CB 3.46Å; L241-F244 PolarHBondContact O-N 2.04Å; L241-L245 HydrophobicContact CD1-CD1 4.22Å; L241-L245 HydrophobicContact CD1-CG 4.38Å; L241-L245 HydrophobicContact CG-CD1 4.13Å; L241-L245 WeakPolarHBondContact O-CG 2.98Å; L241-L245 PolarHBondContact O-N 3.14Å; L241-V265 HydrophobicContact CD1-CB 4.2Å; L241-V265 HydrophobicContact CD1-CG1 4.25Å; L241-A266 HydrophobicContact CD1-CB 4.42Å; L241-A266 VanDerWaalsContact CD2-CA 3.41Å; L241-A266 HydrophobicContact CD2-CB 3.71Å; L241-A266 HydrophobicContact CG-CB 4.48Å |
| 242 | L | 68.4 | Low | 67.8 | Low | 67 Ų | 67 | 77.4 Ų | 77.4 | 35% | 0.351 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -66.6 | -43.7 | 178 | -177.3 | 61.3 | 0 | 0 | 0 | 110.2 | Y238 L239 F244 L245 C246 | Y238-L242 HydrophobicContact CE1-CD2 4.26Å; Y238-L242 WeakPolarHBondContact O-CB 3.28Å; Y238-L242 PolarHBondContact O-N 3.49Å; L239-L242 PolarHBondContact O-N 3.38Å; L242-F244 VanDerWaalsContact C-N 3.29Å; L242-F244 PolarHBondContact O-N 2.97Å; L242-L245 PolarHBondContact O-N 3.06Å; L242-L245 VanDerWaalsContact O-N 3.12Å; L242-C246 WeakPolarHBondContact O-CB 3.46Å; L242-C246 PolarHBondContact O-N 3.41Å; L242-C246 PolarHBondContact O-SG 2.97Å; L242-C246 VanDerWaalsContact O-SG 3.34Å |
| 243 | R | 73.2 | Confident | 66.1 | Low | 136 Ų | 136 | 77.3 Ų | 77.3 | 51% | 0.513 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -57.2 | -40.8 | 171.5 | -175.9 | 176.1 | 179.3 | 157.4 | 0.5 | 111.7 | Y149 L239 R247 | Y149-R243 HydrophobicContact CE2-CG 4.46Å; L239-R243 VanDerWaalsContact O-CB 3.25Å; L239-R243 WeakPolarHBondContact O-CB 3.07Å; L239-R243 PolarHBondContact O-N 2.81Å; R243-R247 WeakPolarHBondContact O-CB 3.43Å; R243-R247 WeakPolarHBondContact O-CG 3.28Å; R243-R247 PolarHBondContact O-N 3.16Å; R243-R247 VanDerWaalsContact O-N 3.08Å |
| 244 | F | 64.9 | Low | 64.6 | Low | 18 Ų | 18 | 83.2 Ų | 83.2 | 8% | 0.079 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -61.4 | -50.6 | 171.9 | 178.1 | -73.1 | 0 | 0 | 0 | 111.6 | R148 V152 L240 L241 L242 C246 R247 H248 | R148-F244 HydrophobicContact CB-CD2 4.2Å; R148-F244 HydrophobicContact CB-CE2 3.85Å; V152-F244 HydrophobicContact CB-CE2 4.15Å; V152-F244 HydrophobicContact CG2-CD2 4.46Å; V152-F244 HydrophobicContact CG2-CE2 3.53Å; V152-F244 HydrophobicContact CG2-CZ 4.04Å; L240-F244 WeakPolarHBondContact O-CB 3.38Å; L240-F244 PolarHBondContact O-N 3.43Å; L241-F244 WeakPolarHBondContact O-CB 3.46Å; L241-F244 PolarHBondContact O-N 2.04Å; L242-F244 VanDerWaalsContact C-N 3.29Å; L242-F244 PolarHBondContact O-N 2.97Å; F244-C246 PolarHBondContact O-N 3.32Å; F244-R247 PolarHBondContact O-N 3.43Å; F244-H248 AromaticContact CE1-CD2 3.58Å; F244-H248 AromaticContact CE2-CD2 3.94Å; F244-H248 AromaticContact CZ-CD2 3.48Å; F244-H248 VanDerWaalsContact CZ-CD2 3.48Å; F244-H248 WeakPolarHBondContact CZ-CD2 3.49Å; F244-H248 AromaticContact CZ-NE2 3.84Å; F244-H248 PolarHBondContact O-N 3.24Å |
| 245 | L | 64.5 | Low | 63.3 | Low | 51 Ų | 51 | 87 Ų | 87 | 27% | 0.267 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -61.9 | -43.3 | -177.7 | -75.6 | 167.9 | 0 | 0 | 0 | 112.3 | L241 L242 H248 K249 S262 A266 | L241-L245 HydrophobicContact CD1-CD1 4.22Å; L241-L245 HydrophobicContact CD1-CG 4.38Å; L241-L245 HydrophobicContact CG-CD1 4.13Å; L241-L245 WeakPolarHBondContact O-CG 2.98Å; L241-L245 PolarHBondContact O-N 3.14Å; L242-L245 PolarHBondContact O-N 3.06Å; L242-L245 VanDerWaalsContact O-N 3.12Å; L245-H248 PolarHBondContact O-N 3.19Å; L245-K249 PolarHBondContact O-N 3.36Å; L245-K249 VanDerWaalsContact O-N 3.16Å; L245-S262 WeakPolarHBondContact CD2-OG 3.32Å; L245-A266 HydrophobicContact CD1-CB 4.45Å |
| 246 | C | 67.2 | Low | 61.6 | Low | 72 Ų | 72 | 90.8 Ų | 90.8 | 49% | 0.486 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -65.7 | -42.8 | 176.2 | -66.9 | 0 | 0 | 0 | 0 | 111.9 | L242 F244 H248 K249 | L242-C246 WeakPolarHBondContact O-CB 3.46Å; L242-C246 PolarHBondContact O-N 3.41Å; L242-C246 PolarHBondContact O-SG 2.97Å; L242-C246 VanDerWaalsContact O-SG 3.34Å; F244-C246 PolarHBondContact O-N 3.32Å; C246-H248 VanDerWaalsContact C-N 3.35Å; C246-H248 PolarHBondContact O-N 2.76Å; C246-K249 PolarHBondContact O-N 2.84Å |
| 247 | R | 60.4 | Low | 60 | Low | 185 Ų | 185 | 96.7 Ų | 96.7 | 70% | 0.698 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -66.7 | -33.2 | 178 | -71.7 | -76.3 | 172.6 | 155.3 | -4.8 | 112.9 | R243 F244 | R243-R247 WeakPolarHBondContact O-CB 3.43Å; R243-R247 WeakPolarHBondContact O-CG 3.28Å; R243-R247 PolarHBondContact O-N 3.16Å; R243-R247 VanDerWaalsContact O-N 3.08Å; F244-R247 PolarHBondContact O-N 3.43Å |
| 248 | H | 53.9 | Low | 58.7 | Low | 64 Ų | 64 | 101.4 Ų | 101.4 | 30% | 0.296 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -82.8 | -10.5 | 176.4 | -98.5 | -69.5 | 0 | 0 | 0 | 115.4 | V152 F244 L245 C246 L250 Q258 | V152-H248 VanDerWaalsContact CG1-NE2 3.26Å; V152-H248 WeakPolarHBondContact CG1-NE2 3.46Å; V152-H248 WeakPolarHBondContact CG2-NE2 3.44Å; F244-H248 AromaticContact CE1-CD2 3.58Å; F244-H248 AromaticContact CE2-CD2 3.94Å; F244-H248 AromaticContact CZ-CD2 3.48Å; F244-H248 VanDerWaalsContact CZ-CD2 3.48Å; F244-H248 WeakPolarHBondContact CZ-CD2 3.49Å; F244-H248 AromaticContact CZ-NE2 3.84Å; F244-H248 PolarHBondContact O-N 3.24Å; L245-H248 PolarHBondContact O-N 3.19Å; C246-H248 VanDerWaalsContact C-N 3.35Å; C246-H248 PolarHBondContact O-N 2.76Å; H248-L250 VanDerWaalsContact C-N 3.28Å; H248-L250 PolarHBondContact O-N 3.03Å; H248-Q258 PolarHBondContact CE1-OE1 2.77Å; H248-Q258 PolarHBondContact ND1-OE1 3.47Å |
| 249 | K | 51.7 | Low | 57.6 | Low | 191 Ų | 191 | 100.1 Ų | 100.1 | 83% | 0.83 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.8 | -2.5 | 178.6 | -103.5 | -168.3 | 171.5 | -168.2 | 0 | 114.6 | L245 C246 | L245-K249 PolarHBondContact O-N 3.36Å; L245-K249 VanDerWaalsContact O-N 3.16Å; C246-K249 PolarHBondContact O-N 2.84Å |
| 250 | L | 48.1 | Very low | 56.3 | Low | 147 Ų | 147 | 98.2 Ų | 98.2 | 77% | 0.77 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -118.6 | -25.7 | -167.8 | -80 | 162.8 | 0 | 0 | 0 | 116.6 | H248 | H248-L250 VanDerWaalsContact C-N 3.28Å; H248-L250 PolarHBondContact O-N 3.03Å |
| 251 | N | 43.4 | Very low | 55.3 | Low | 134 Ų | 134 | 99.4 Ų | 99.4 | 72% | 0.717 | 51% | 0.512 | S | S | * | . | S | Bend | trans | -114.7 | 119.7 | 179.7 | -80.5 | -0.6 | 0 | 0 | 0 | 111.9 | V253 | N251-V253 PolarHBondContact O-N 3.16Š|
| 252 | G | 51.2 | Low | 54.8 | Low | 78 Ų | 78 | 99.6 Ų | 99.6 | 80% | 0.804 | 51% | 0.514 | S | S | * | . | trans | -85.7 | 97 | -170.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 253 | V | 47.1 | Very low | 54.5 | Low | 127 Ų | 127 | 103.1 Ų | 103.1 | 77% | 0.77 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -133.1 | 113.2 | 156.6 | -176.4 | 0 | 0 | 0 | 0 | 109.3 | N251 | N251-V253 PolarHBondContact O-N 3.16Š|
| 254 | N | 50.2 | Low | 54.1 | Low | 130 Ų | 130 | 96.9 Ų | 96.9 | 70% | 0.695 | 50% | 0.504 | S | S | * | . | trans | 36.6 | 65.7 | 176.5 | -155.5 | -22.7 | 0 | 0 | 0 | 116 | Q256 | N254-Q256 VanDerWaalsContact C-N 3.33Å; N254-Q256 PolarHBondContact O-N 3.46Å | ||
| 255 | P | 50 | Low | 54.1 | Low | 86 Ų | 86 | 97 Ų | 97 | 56% | 0.558 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -66.8 | -24.8 | -165 | 24.7 | -35.1 | 0 | 0 | 0 | 115.4 | R257 Q258 A259 | P255-R257 PolarHBondContact O-N 3.44Å; P255-Q258 PolarHBondContact O-N 3.22Å; P255-A259 WeakPolarHBondContact O-CB 3.3Å; P255-A259 PolarHBondContact O-N 3Å; P255-A259 VanDerWaalsContact O-N 3.1Å |
| 256 | Q | 45.1 | Very low | 54.2 | Low | 148 Ų | 148 | 95.1 Ų | 95.1 | 69% | 0.692 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63.9 | -36.9 | -167.4 | -69.3 | -165.8 | 6.2 | 0 | 0 | 114.4 | N254 | N254-Q256 VanDerWaalsContact C-N 3.33Å; N254-Q256 PolarHBondContact O-N 3.46Å |
| 257 | R | 48.4 | Very low | 54.5 | Low | 181 Ų | 181 | 94.3 Ų | 94.3 | 68% | 0.683 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -81.1 | -32.9 | -176.7 | -162.9 | 176.1 | -178 | -158.9 | 0.3 | 112.8 | P255 E332 | P255-R257 PolarHBondContact O-N 3.44Å; R257-E332 IonicContact CZ-OE1 3.66Å; R257-E332 IonicContact NH2-OE1 2.76Å; R257-E332 PolarHBondContact NH2-OE1 3.43Å |
| 258 | Q | 48.7 | Very low | 55.1 | Low | 100 Ų | 100 | 85.5 Ų | 85.5 | 47% | 0.467 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -78.8 | -45.1 | 179.5 | -67.8 | -173.3 | -4.9 | 0 | 0 | 112 | H248 P255 H260 V261 S262 | H248-Q258 PolarHBondContact CE1-OE1 2.77Å; H248-Q258 PolarHBondContact ND1-OE1 3.47Å; P255-Q258 PolarHBondContact O-N 3.22Å; Q258-H260 VanDerWaalsContact C-N 3.25Å; Q258-H260 PolarHBondContact O-N 2.64Å; Q258-V261 PolarHBondContact O-N 2.93Å; Q258-S262 PolarHBondContact O-N 3.19Å; Q258-S262 VanDerWaalsContact O-N 3.14Å; Q258-S262 PolarHBondContact O-OG 3.38Å |
| 259 | A | 51.3 | Low | 55.9 | Low | 56 Ų | 56 | 82.4 Ų | 82.4 | 46% | 0.463 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -60.7 | -32.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | P255 V261 S262 K263 | P255-A259 WeakPolarHBondContact O-CB 3.3Å; P255-A259 PolarHBondContact O-N 3Å; P255-A259 VanDerWaalsContact O-N 3.1Å; A259-V261 VanDerWaalsContact C-N 3.3Å; A259-V261 PolarHBondContact O-N 3.02Å; A259-S262 PolarHBondContact O-OG 2.9Å; A259-K263 WeakPolarHBondContact O-CB 3.33Å; A259-K263 PolarHBondContact O-N 3.35Å; A259-K263 VanDerWaalsContact O-N 3.11Å |
| 260 | H | 52.3 | Low | 57.1 | Low | 54 Ų | 54 | 77.2 Ų | 77.2 | 25% | 0.25 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -70.5 | -25.3 | 177.5 | -159.8 | -38 | 0 | 0 | 0 | 112.9 | Q258 I329 | Q258-H260 VanDerWaalsContact C-N 3.25Å; Q258-H260 PolarHBondContact O-N 2.64Å; H260-I329 PolarHBondContact CE1-O 2.82Å; H260-I329 PolarHBondContact ND1-O 2.78Å; H260-I329 WeakPolarHBondContact O-CG2 3.26Å |
| 261 | V | 52.7 | Low | 58.5 | Low | 55 Ų | 55 | 71.4 Ų | 71.4 | 33% | 0.333 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -87 | -38.4 | 178.9 | 176.2 | 0 | 0 | 0 | 0 | 111.2 | Q258 A259 S264 V265 | Q258-V261 PolarHBondContact O-N 2.93Å; A259-V261 VanDerWaalsContact C-N 3.3Å; A259-V261 PolarHBondContact O-N 3.02Å; V261-S264 WeakPolarHBondContact O-CB 3.36Å; V261-S264 PolarHBondContact O-N 3.47Å; V261-S264 VanDerWaalsContact O-N 3.1Å; V261-V265 PolarHBondContact O-N 3.4Å |
| 262 | S | 57.5 | Low | 60 | Low | 11 Ų | 11 | 65.2 Ų | 65.2 | 8% | 0.077 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -68.3 | -37.7 | 174.8 | 55.9 | 0 | 0 | 0 | 0 | 112.4 | L245 Q258 A259 S264 V265 A266 | L245-S262 WeakPolarHBondContact CD2-OG 3.32Å; Q258-S262 PolarHBondContact O-N 3.19Å; Q258-S262 VanDerWaalsContact O-N 3.14Å; Q258-S262 PolarHBondContact O-OG 3.38Å; A259-S262 PolarHBondContact O-OG 2.9Å; S262-S264 PolarHBondContact O-N 3.04Å; S262-V265 PolarHBondContact O-N 3.19Å; S262-A266 PolarHBondContact O-N 3.4Å |
| 263 | K | 64.1 | Low | 61.1 | Low | 142 Ų | 142 | 63.2 Ų | 63.2 | 62% | 0.617 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -58.3 | -30 | 168.7 | -172 | 170.4 | -178.9 | 175.8 | 0 | 112.2 | A259 V267 | A259-K263 WeakPolarHBondContact O-CB 3.33Å; A259-K263 PolarHBondContact O-N 3.35Å; A259-K263 VanDerWaalsContact O-N 3.11Å; K263-V267 HydrophobicContact CG-CG2 4.46Å; K263-V267 WeakPolarHBondContact O-CG2 3.19Å; K263-V267 PolarHBondContact O-N 3.1Å; K263-V267 VanDerWaalsContact O-N 3.09Å |
| 264 | S | 63 | Low | 62.7 | Low | 5 Ų | 5 | 61.5 Ų | 61.5 | 4% | 0.035 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -64 | -49.1 | 174.9 | -159.6 | 0 | 0 | 0 | 0 | 112.3 | V261 S262 A266 V267 V268 I329 | V261-S264 WeakPolarHBondContact O-CB 3.36Å; V261-S264 PolarHBondContact O-N 3.47Å; V261-S264 VanDerWaalsContact O-N 3.1Å; S262-S264 PolarHBondContact O-N 3.04Å; S264-A266 VanDerWaalsContact C-N 3.3Å; S264-A266 PolarHBondContact O-N 3.48Å; S264-V267 PolarHBondContact O-N 3.47Å; S264-V268 WeakPolarHBondContact O-CG2 3.47Å; S264-V268 PolarHBondContact O-N 3.16Å; S264-I329 VanDerWaalsContact CB-CG2 3.5Å |
| 265 | V | 65.3 | Low | 64.3 | Low | 19 Ų | 19 | 55.6 Ų | 55.6 | 12% | 0.115 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -66.3 | -37.9 | -179.5 | -176.8 | 0 | 0 | 0 | 0 | 110.2 | L241 V261 S262 V268 V269 | L241-V265 HydrophobicContact CD1-CB 4.2Å; L241-V265 HydrophobicContact CD1-CG1 4.25Å; V261-V265 PolarHBondContact O-N 3.4Å; S262-V265 PolarHBondContact O-N 3.19Å; V265-V268 PolarHBondContact O-N 2.81Å; V265-V269 HydrophobicContact CG1-CG2 4.11Å; V265-V269 WeakPolarHBondContact O-CB 3.27Å; V265-V269 WeakPolarHBondContact O-CG2 3.43Å; V265-V269 PolarHBondContact O-N 3.04Å |
| 266 | A | 67.9 | Low | 65.7 | Low | 13 Ų | 13 | 52 Ų | 52 | 11% | 0.107 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -59.8 | -45.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | L241 L245 S262 S264 L270 | L241-A266 HydrophobicContact CD1-CB 4.42Å; L241-A266 VanDerWaalsContact CD2-CA 3.41Å; L241-A266 HydrophobicContact CD2-CB 3.71Å; L241-A266 HydrophobicContact CG-CB 4.48Å; L245-A266 HydrophobicContact CD1-CB 4.45Å; S262-A266 PolarHBondContact O-N 3.4Å; S264-A266 VanDerWaalsContact C-N 3.3Å; S264-A266 PolarHBondContact O-N 3.48Å; A266-L270 VanDerWaalsContact O-CB 3.3Å; A266-L270 WeakPolarHBondContact O-CB 3.4Å; A266-L270 VanDerWaalsContact O-CG 3.29Å; A266-L270 WeakPolarHBondContact O-CG 3.45Å; A266-L270 PolarHBondContact O-N 2.99Å |
| 267 | V | 73.4 | Confident | 67.4 | Low | 54 Ų | 54 | 50 Ų | 50 | 33% | 0.327 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -66 | -40.1 | 178.5 | 174.7 | 0 | 0 | 0 | 0 | 111.2 | K263 S264 S271 I325 I329 | K263-V267 HydrophobicContact CG-CG2 4.46Å; K263-V267 WeakPolarHBondContact O-CG2 3.19Å; K263-V267 PolarHBondContact O-N 3.1Å; K263-V267 VanDerWaalsContact O-N 3.09Å; S264-V267 PolarHBondContact O-N 3.47Å; V267-S271 WeakPolarHBondContact O-CB 3.45Å; V267-S271 PolarHBondContact O-N 3.07Å; V267-I325 HydrophobicContact CB-CG2 4.1Å; V267-I325 HydrophobicContact CG1-CD1 4.22Å; V267-I325 HydrophobicContact CG1-CG1 4.19Å; V267-I325 HydrophobicContact CG1-CG2 3.72Å; V267-I329 HydrophobicContact CB-CD1 3.87Å; V267-I329 HydrophobicContact CG1-CD1 4.17Å; V267-I329 HydrophobicContact CG2-CD1 4.03Å |
| 268 | V | 72.1 | Confident | 69.1 | Low | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -65 | -50 | 176.2 | -176.4 | 0 | 0 | 0 | 0 | 111.6 | L141 S264 V265 L270 S271 F272 N322 I325 Y326 | L141-V268 HydrophobicContact CD1-CG1 4.48Å; L141-V268 HydrophobicContact CD2-CB 4.24Å; L141-V268 HydrophobicContact CD2-CG1 3.47Å; L141-V268 VanDerWaalsContact CD2-CG1 3.47Å; S264-V268 WeakPolarHBondContact O-CG2 3.47Å; S264-V268 PolarHBondContact O-N 3.16Å; V265-V268 PolarHBondContact O-N 2.81Å; V268-L270 PolarHBondContact O-N 2.9Å; V268-S271 PolarHBondContact O-N 2.93Å; V268-F272 WeakPolarHBondContact O-CB 3.5Å; V268-F272 PolarHBondContact O-N 3.3Å; V268-N322 VanDerWaalsContact CG1-OD1 3.31Å; V268-N322 WeakPolarHBondContact CG1-OD1 3.36Å; V268-I325 HydrophobicContact CG2-CB 4.01Å; V268-I325 HydrophobicContact CG2-CD1 4.37Å; V268-I325 HydrophobicContact CG2-CG2 3.42Å; V268-I325 VanDerWaalsContact CG2-CG2 3.42Å; V268-Y326 HydrophobicContact CG2-CD1 4.4Å; V268-Y326 HydrophobicContact CG2-CE1 3.85Å |
| 269 | V | 71.4 | Confident | 70.6 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -60.7 | -46.2 | -178.9 | 169.6 | 0 | 0 | 0 | 0 | 111.3 | L141 M234 Y238 V265 F272 C273 | L141-V269 HydrophobicContact CB-CG2 4.33Å; L141-V269 HydrophobicContact CD2-CG2 4.26Å; M234-V269 HydrophobicContact CE-CB 4.49Å; M234-V269 HydrophobicContact CE-CG1 3.87Å; M234-V269 WeakPolarHBondContact CE-O 3.3Å; Y238-V269 HydrophobicContact CD2-CG1 4.47Å; V265-V269 HydrophobicContact CG1-CG2 4.11Å; V265-V269 WeakPolarHBondContact O-CB 3.27Å; V265-V269 WeakPolarHBondContact O-CG2 3.43Å; V265-V269 PolarHBondContact O-N 3.04Å; V269-F272 PolarHBondContact O-N 3.44Å; V269-C273 PolarHBondContact O-N 3.38Å; V269-C273 PolarHBondContact O-SG 3.28Å; V269-C273 VanDerWaalsContact O-SG 3.33Å |
| 270 | L | 76.1 | Confident | 71.9 | Confident | 82 Ų | 82 | 37.5 Ų | 37.5 | 43% | 0.429 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -65.9 | -41.2 | 177.3 | -71.3 | 170.7 | 0 | 0 | 0 | 112.2 | Y238 A266 V268 F272 C273 T274 | Y238-L270 HydrophobicContact CD2-CD2 4.05Å; Y238-L270 HydrophobicContact CD2-CG 4.48Å; Y238-L270 HydrophobicContact CE2-CD2 3.77Å; Y238-L270 HydrophobicContact CE2-CG 4.26Å; A266-L270 VanDerWaalsContact O-CB 3.3Å; A266-L270 WeakPolarHBondContact O-CB 3.4Å; A266-L270 VanDerWaalsContact O-CG 3.29Å; A266-L270 WeakPolarHBondContact O-CG 3.45Å; A266-L270 PolarHBondContact O-N 2.99Å; V268-L270 PolarHBondContact O-N 2.9Å; L270-F272 VanDerWaalsContact C-N 3.33Å; L270-F272 PolarHBondContact O-N 2.9Å; L270-C273 WeakPolarHBondContact O-CB 3.36Å; L270-C273 PolarHBondContact O-N 3.4Å; L270-T274 PolarHBondContact O-N 2.77Å; L270-T274 PolarHBondContact O-OG1 2.85Å |
| 271 | S | 78.3 | Confident | 73.3 | Confident | 25 Ų | 25 | 37.6 Ų | 37.6 | 18% | 0.175 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.8 | -36.5 | 177.1 | -169.2 | 0 | 0 | 0 | 0 | 112.2 | V267 V268 T274 C275 | V267-S271 WeakPolarHBondContact O-CB 3.45Å; V267-S271 PolarHBondContact O-N 3.07Å; V268-S271 PolarHBondContact O-N 2.93Å; S271-T274 PolarHBondContact O-OG1 3.24Å; S271-C275 WeakPolarHBondContact O-CB 3.25Å; S271-C275 PolarHBondContact O-N 2.99Å; S271-C275 VanDerWaalsContact O-N 3.1Å; S271-C275 PolarHBondContact O-SG 2.74Å |
| 272 | F | 74.3 | Confident | 74.5 | Confident | 4 Ų | 4 | 36 Ų | 36 | 2% | 0.018 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -67.7 | -45.2 | 174.4 | -167.2 | -84.7 | 0 | 0 | 0 | 110.6 | S137 C138 L141 M234 V268 V269 L270 T274 C275 W276 | S137-F272 VanDerWaalsContact CB-CE2 3.41Å; C138-F272 VanDerWaalsContact SG-CE1 3.54Å; L141-F272 HydrophobicContact CD1-CB 4.06Å; L141-F272 HydrophobicContact CD1-CD1 4.48Å; L141-F272 HydrophobicContact CD1-CD2 4.2Å; L141-F272 HydrophobicContact CD1-CG 4Å; M234-F272 HydrophobicContact CE-CB 3.98Å; M234-F272 HydrophobicContact CE-CD1 3.69Å; M234-F272 HydrophobicContact CE-CG 4.2Å; M234-F272 HydrophobicContact CG-CD1 4.32Å; M234-F272 HydrophobicContact SD-CD1 3.75Å; M234-F272 HydrophobicContact SD-CE1 4.15Å; V268-F272 WeakPolarHBondContact O-CB 3.5Å; V268-F272 PolarHBondContact O-N 3.3Å; V269-F272 PolarHBondContact O-N 3.44Å; L270-F272 VanDerWaalsContact C-N 3.33Å; L270-F272 PolarHBondContact O-N 2.9Å; F272-T274 PolarHBondContact O-N 3.47Å; F272-C275 PolarHBondContact O-N 2.86Å; F272-W276 AromaticContact CD1-CD1 3.61Å; F272-W276 HydrophobicContact CD1-CG 4.34Å; F272-W276 AromaticContact CD2-CD1 3.86Å; F272-W276 AromaticContact CD2-NE1 3.89Å; F272-W276 AromaticContact CE1-CD1 3.38Å; F272-W276 AromaticContact CE1-CG 3.94Å; F272-W276 HydrophobicContact CE1-CG 3.94Å; F272-W276 AromaticContact CE1-NE1 3.8Å; F272-W276 AromaticContact CE2-CD1 3.64Å; F272-W276 AromaticContact CE2-NE1 3.32Å; F272-W276 VanDerWaalsContact CE2-NE1 3.32Å; F272-W276 AromaticContact CG-CD1 3.86Å; F272-W276 AromaticContact CZ-CD1 3.41Å; F272-W276 VanDerWaalsContact CZ-CD1 3.41Å; F272-W276 HydrophobicContact CZ-CD2 4.49Å; F272-W276 HydrophobicContact CZ-CG 4.17Å; F272-W276 AromaticContact CZ-NE1 3.28Å; F272-W276 VanDerWaalsContact CZ-NE1 3.28Å; F272-W276 PolarHBondContact O-N 3.02Å |
| 273 | C | 74.9 | Confident | 75.2 | Confident | 35 Ų | 35 | 36.4 Ų | 36.4 | 24% | 0.236 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -55 | -51.5 | 173.8 | -72.5 | 0 | 0 | 0 | 0 | 112.3 | M234 V269 L270 C275 W276 F277 | M234-C273 WeakPolarHBondContact CE-SG 3.32Å; V269-C273 PolarHBondContact O-N 3.38Å; V269-C273 PolarHBondContact O-SG 3.28Å; V269-C273 VanDerWaalsContact O-SG 3.33Å; L270-C273 WeakPolarHBondContact O-CB 3.36Å; L270-C273 PolarHBondContact O-N 3.4Å; C273-C275 VanDerWaalsContact C-N 3.33Å; C273-C275 PolarHBondContact O-N 3.29Å; C273-W276 PolarHBondContact O-N 3.34Å; C273-F277 WeakPolarHBondContact O-CB 3.47Å; C273-F277 PolarHBondContact O-N 3.47Å |
| 274 | T | 79.8 | Confident | 75.7 | Confident | 92 Ų | 92 | 32 Ų | 32 | 56% | 0.564 | 18% | 0.18 | S | C | * | . | H | α-helix | trans | -67.1 | -33.2 | -177.5 | 53.9 | 0 | 0 | 0 | 0 | 112.9 | L270 S271 F272 P278 L314 | L270-T274 PolarHBondContact O-N 2.77Å; L270-T274 PolarHBondContact O-OG1 2.85Å; S271-T274 PolarHBondContact O-OG1 3.24Å; F272-T274 PolarHBondContact O-N 3.47Å; T274-P278 WeakPolarHBondContact O-CD 3.5Å; T274-L314 WeakPolarHBondContact O-CD2 3.49Å |
| 275 | C | 83.4 | Confident | 76.2 | Confident | 5 Ų | 5 | 35 Ų | 35 | 3% | 0.034 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -68.1 | -44 | 175.9 | -69.5 | 0 | 0 | 0 | 0 | 112.5 | S271 F272 C273 L314 A315 | S271-C275 WeakPolarHBondContact O-CB 3.25Å; S271-C275 PolarHBondContact O-N 2.99Å; S271-C275 VanDerWaalsContact O-N 3.1Å; S271-C275 PolarHBondContact O-SG 2.74Å; F272-C275 PolarHBondContact O-N 2.86Å; C273-C275 VanDerWaalsContact C-N 3.33Å; C273-C275 PolarHBondContact O-N 3.29Å; C275-L314 HydrophobicContact CB-CG 4.48Å; C275-L314 VanDerWaalsContact CB-O 3.32Å; C275-L314 WeakPolarHBondContact CB-O 3.34Å; C275-A315 WeakPolarHBondContact O-CA 3.44Å; C275-A315 PolarHBondContact O-N 3.05Å |
| 276 | W | 80.2 | Confident | 76.5 | Confident | 11 Ų | 11 | 34.9 Ų | 34.9 | 4% | 0.042 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -86.9 | -24.1 | -174.4 | -77.6 | 93.3 | 0 | 0 | 0 | 114.3 | V134 F272 C273 Y279 N280 A315 S318 | V134-W276 HydrophobicContact CB-CH2 4.4Å; V134-W276 HydrophobicContact CG1-CD2 4.29Å; V134-W276 HydrophobicContact CG1-CE3 4.16Å; V134-W276 HydrophobicContact CG1-CH2 4.34Å; V134-W276 HydrophobicContact CG1-CZ2 4.44Å; V134-W276 HydrophobicContact CG1-CZ3 4.18Å; V134-W276 HydrophobicContact CG2-CE3 4.48Å; V134-W276 HydrophobicContact CG2-CH2 3.35Å; V134-W276 HydrophobicContact CG2-CZ2 3.87Å; V134-W276 HydrophobicContact CG2-CZ3 3.7Å; F272-W276 AromaticContact CD1-CD1 3.61Å; F272-W276 HydrophobicContact CD1-CG 4.34Å; F272-W276 AromaticContact CD2-CD1 3.86Å; F272-W276 AromaticContact CD2-NE1 3.89Å; F272-W276 AromaticContact CE1-CD1 3.38Å; F272-W276 AromaticContact CE1-CG 3.94Å; F272-W276 HydrophobicContact CE1-CG 3.94Å; F272-W276 AromaticContact CE1-NE1 3.8Å; F272-W276 AromaticContact CE2-CD1 3.64Å; F272-W276 AromaticContact CE2-NE1 3.32Å; F272-W276 VanDerWaalsContact CE2-NE1 3.32Å; F272-W276 AromaticContact CG-CD1 3.86Å; F272-W276 AromaticContact CZ-CD1 3.41Å; F272-W276 VanDerWaalsContact CZ-CD1 3.41Å; F272-W276 HydrophobicContact CZ-CD2 4.49Å; F272-W276 HydrophobicContact CZ-CG 4.17Å; F272-W276 AromaticContact CZ-NE1 3.28Å; F272-W276 VanDerWaalsContact CZ-NE1 3.28Å; F272-W276 PolarHBondContact O-N 3.02Å; C273-W276 PolarHBondContact O-N 3.34Å; W276-Y279 AromaticContact CE3-CD1 3.94Å; W276-Y279 HydrophobicContact CE3-CD1 3.94Å; W276-Y279 AromaticContact CZ3-CD1 3.87Å; W276-Y279 HydrophobicContact CZ3-CD1 3.87Å; W276-Y279 HydrophobicContact CZ3-CE1 4.05Å; W276-Y279 PolarHBondContact O-N 3.05Å; W276-N280 WeakPolarHBondContact O-CB 3.5Å; W276-N280 PolarHBondContact O-N 3.2Å; W276-N280 PolarHBondContact O-ND2 3.18Å; W276-A315 HydrophobicContact CD2-CB 3.85Å; W276-A315 HydrophobicContact CE3-CB 3.73Å; W276-A315 HydrophobicContact CG-CB 4.49Å; W276-A315 HydrophobicContact CH2-CB 4.01Å; W276-A315 HydrophobicContact CZ2-CB 4.15Å; W276-A315 HydrophobicContact CZ3-CB 3.81Å; W276-A315 PolarHBondContact NE1-O 3.34Å; W276-S318 PolarHBondContact NE1-OG 2.88Å |
| 277 | F | 80.6 | Confident | 76.5 | Confident | 106 Ų | 106 | 34.3 Ų | 34.3 | 47% | 0.465 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -53 | -52.4 | -177.4 | -178.7 | -99.7 | 0 | 0 | 0 | 114.8 | Y231 C273 Y279 N280 V281 | Y231-F277 HydrophobicContact CE2-CD2 4.21Å; C273-F277 WeakPolarHBondContact O-CB 3.47Å; C273-F277 PolarHBondContact O-N 3.47Å; F277-Y279 PolarHBondContact O-N 3.28Å; F277-N280 WeakPolarHBondContact O-CB 3.45Å; F277-N280 PolarHBondContact O-N 2.93Å; F277-V281 HydrophobicContact CD1-CG2 4.24Å; F277-V281 HydrophobicContact CD2-CG2 4.27Å; F277-V281 HydrophobicContact CE1-CG2 3.83Å; F277-V281 HydrophobicContact CE2-CG2 3.87Å; F277-V281 HydrophobicContact CG-CG2 4.45Å; F277-V281 HydrophobicContact CZ-CG2 3.63Å; F277-V281 WeakPolarHBondContact O-CG2 3.5Å; F277-V281 PolarHBondContact O-N 2.9Å |
| 278 | P | 83.4 | Confident | 76.4 | Confident | 39 Ų | 39 | 34.2 Ų | 34.2 | 25% | 0.253 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -65.1 | -39.4 | -177.3 | 25.2 | -33.7 | 0 | 0 | 0 | 112.3 | T274 N280 V281 L282 A311 L314 | T274-P278 WeakPolarHBondContact O-CD 3.5Å; P278-N280 VanDerWaalsContact C-N 3.29Å; P278-N280 PolarHBondContact O-N 3.43Å; P278-V281 PolarHBondContact O-N 2.86Å; P278-L282 WeakPolarHBondContact O-CG 3.34Å; P278-L282 PolarHBondContact O-N 3.48Å; P278-A311 HydrophobicContact CB-CB 3.95Å; P278-A311 HydrophobicContact CG-CB 4.26Å; P278-L314 HydrophobicContact CG-CD2 3.76Å |
| 279 | Y | 81.8 | Confident | 76.3 | Confident | 23 Ų | 23 | 35.1 Ų | 35.1 | 9% | 0.09 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.7 | -41.2 | 176.2 | 175.2 | -96.4 | 0 | 0 | 0 | 111.6 | R187 W276 F277 T283 F308 N312 A315 | R187-Y279 PolarHBondContact NH2-OH 2.93Å; W276-Y279 AromaticContact CE3-CD1 3.94Å; W276-Y279 HydrophobicContact CE3-CD1 3.94Å; W276-Y279 AromaticContact CZ3-CD1 3.87Å; W276-Y279 HydrophobicContact CZ3-CD1 3.87Å; W276-Y279 HydrophobicContact CZ3-CE1 4.05Å; W276-Y279 PolarHBondContact O-N 3.05Å; F277-Y279 PolarHBondContact O-N 3.28Å; Y279-T283 VanDerWaalsContact O-CB 3.31Å; Y279-T283 WeakPolarHBondContact O-CB 3.46Å; Y279-T283 PolarHBondContact O-N 2.86Å; Y279-T283 PolarHBondContact O-OG1 2.9Å; Y279-F308 HydrophobicContact CD2-CE2 4.33Å; Y279-F308 HydrophobicContact CE2-CE2 4.08Å; Y279-F308 AromaticContact CE2-CZ 3.9Å; Y279-F308 HydrophobicContact CE2-CZ 3.9Å; Y279-N312 HydrophobicContact CD2-CB 4.16Å; Y279-N312 WeakPolarHBondContact CD2-OD1 3.35Å; Y279-N312 HydrophobicContact CE2-CB 4.4Å; Y279-N312 WeakPolarHBondContact CE2-OD1 3.44Å; Y279-A315 HydrophobicContact CG-CB 4.33Å |
| 280 | N | 77.9 | Confident | 76 | Confident | 13 Ų | 13 | 38.3 Ų | 38.3 | 7% | 0.07 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.5 | -46.8 | 176.8 | -86.5 | -92.6 | 0 | 0 | 0 | 111.7 | G226 F227 W276 F277 P278 T283 L284 | G226-N280 PolarHBondContact O-OD1 3.37Å; F227-N280 HydrophobicContact CD2-CB 3.64Å; F227-N280 VanDerWaalsContact CD2-O 3.31Å; F227-N280 WeakPolarHBondContact CD2-O 3.35Å; F227-N280 HydrophobicContact CE2-CB 3.87Å; W276-N280 WeakPolarHBondContact O-CB 3.5Å; W276-N280 PolarHBondContact O-N 3.2Å; W276-N280 PolarHBondContact O-ND2 3.18Å; F277-N280 WeakPolarHBondContact O-CB 3.45Å; F277-N280 PolarHBondContact O-N 2.93Å; P278-N280 VanDerWaalsContact C-N 3.29Å; P278-N280 PolarHBondContact O-N 3.43Å; N280-T283 PolarHBondContact O-N 3.2Å; N280-L284 WeakPolarHBondContact O-CB 3.3Å; N280-L284 PolarHBondContact O-N 3.41Å |
| 281 | V | 80.6 | Confident | 75.6 | Confident | 55 Ų | 55 | 37 Ų | 37 | 33% | 0.333 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -63.1 | -42.5 | 178.3 | 171.7 | 0 | 0 | 0 | 0 | 112.1 | F277 P278 L284 W285 | F277-V281 HydrophobicContact CD1-CG2 4.24Å; F277-V281 HydrophobicContact CD2-CG2 4.27Å; F277-V281 HydrophobicContact CE1-CG2 3.83Å; F277-V281 HydrophobicContact CE2-CG2 3.87Å; F277-V281 HydrophobicContact CG-CG2 4.45Å; F277-V281 HydrophobicContact CZ-CG2 3.63Å; F277-V281 WeakPolarHBondContact O-CG2 3.5Å; F277-V281 PolarHBondContact O-N 2.9Å; P278-V281 PolarHBondContact O-N 2.86Å; V281-L284 WeakPolarHBondContact O-CB 3.37Å; V281-L284 PolarHBondContact O-N 3.34Å; V281-W285 PolarHBondContact O-N 3.31Å |
| 282 | L | 77.9 | Confident | 75 | Confident | 23 Ų | 23 | 42.8 Ų | 42.8 | 12% | 0.12 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -70 | -36.8 | 178.2 | -63 | -176 | 0 | 0 | 0 | 112.1 | P278 L284 W285 S286 V303 L307 F308 A311 | P278-L282 WeakPolarHBondContact O-CG 3.34Å; P278-L282 PolarHBondContact O-N 3.48Å; L282-L284 VanDerWaalsContact C-N 3.32Å; L282-L284 PolarHBondContact O-N 2.91Å; L282-W285 HydrophobicContact CD2-CE3 4.44Å; L282-W285 PolarHBondContact O-N 3.14Å; L282-S286 PolarHBondContact O-N 3.39Å; L282-S286 PolarHBondContact O-OG 2.86Å; L282-V303 HydrophobicContact CD1-CG1 4.19Å; L282-V303 HydrophobicContact CD2-CG1 3.35Å; L282-V303 HydrophobicContact CG-CG1 4.38Å; L282-L307 HydrophobicContact CD1-CB 4.02Å; L282-F308 HydrophobicContact CB-CD2 3.99Å; L282-F308 HydrophobicContact CD1-CB 4.17Å; L282-A311 HydrophobicContact CD1-CB 3.95Å |
| 283 | T | 72.6 | Confident | 74.6 | Confident | 19 Ų | 19 | 48.3 Ų | 48.3 | 12% | 0.117 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -63.6 | -37.9 | 172.7 | -57.9 | 0 | 0 | 0 | 0 | 111.9 | Y279 N280 A287 | Y279-T283 VanDerWaalsContact O-CB 3.31Å; Y279-T283 WeakPolarHBondContact O-CB 3.46Å; Y279-T283 PolarHBondContact O-N 2.86Å; Y279-T283 PolarHBondContact O-OG1 2.9Å; N280-T283 PolarHBondContact O-N 3.2Å; T283-A287 WeakPolarHBondContact O-CB 3.27Å; T283-A287 PolarHBondContact O-N 3.35Å; T283-A287 VanDerWaalsContact O-N 3.09Å |
| 284 | L | 74.3 | Confident | 74.3 | Confident | 48 Ų | 48 | 49.3 Ų | 49.3 | 25% | 0.251 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -62.7 | -46.9 | 173 | 168.5 | 63.5 | 0 | 0 | 0 | 111.4 | L223 F227 N280 V281 L282 A287 L288 | L223-L284 HydrophobicContact CD2-CD1 3.49Å; L223-L284 VanDerWaalsContact CD2-CD1 3.49Å; F227-L284 HydrophobicContact CD2-CB 4.1Å; F227-L284 HydrophobicContact CE1-CD2 4.07Å; F227-L284 HydrophobicContact CE2-CB 4.15Å; F227-L284 HydrophobicContact CE2-CD2 4.01Å; F227-L284 HydrophobicContact CZ-CD2 3.73Å; N280-L284 WeakPolarHBondContact O-CB 3.3Å; N280-L284 PolarHBondContact O-N 3.41Å; V281-L284 WeakPolarHBondContact O-CB 3.37Å; V281-L284 PolarHBondContact O-N 3.34Å; L282-L284 VanDerWaalsContact C-N 3.32Å; L282-L284 PolarHBondContact O-N 2.91Å; L284-A287 WeakPolarHBondContact O-CB 3.39Å; L284-A287 PolarHBondContact O-N 3.38Å; L284-A287 VanDerWaalsContact O-N 3.11Å; L284-L288 HydrophobicContact CD1-CD1 4.22Å; L284-L288 HydrophobicContact CD1-CG 4.17Å; L284-L288 HydrophobicContact CG-CD1 4.27Å; L284-L288 WeakPolarHBondContact O-CG 3.34Å; L284-L288 PolarHBondContact O-N 3.16Å |
| 285 | W | 74.8 | Confident | 73.9 | Confident | 69 Ų | 69 | 53.4 Ų | 53.4 | 26% | 0.261 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -62.7 | -45.9 | 179.6 | -173.7 | 15 | 0 | 0 | 0 | 112.1 | V281 L282 A287 L288 I289 Y300 V303 | V281-W285 PolarHBondContact O-N 3.31Å; L282-W285 HydrophobicContact CD2-CE3 4.44Å; L282-W285 PolarHBondContact O-N 3.14Å; W285-A287 PolarHBondContact O-N 3.42Å; W285-L288 PolarHBondContact O-N 2.99Å; W285-L288 VanDerWaalsContact O-N 3.13Å; W285-I289 PolarHBondContact O-N 2.71Å; W285-I289 VanDerWaalsContact O-N 3.15Å; W285-Y300 HydrophobicContact CD2-CD2 4.07Å; W285-Y300 AromaticContact CE2-CD2 3.92Å; W285-Y300 HydrophobicContact CE3-CD2 4.33Å; W285-Y300 HydrophobicContact CH2-CD2 4.32Å; W285-Y300 HydrophobicContact CZ2-CD2 4.05Å; W285-Y300 HydrophobicContact CZ2-CG 4.44Å; W285-Y300 HydrophobicContact CZ3-CD2 4.46Å; W285-V303 HydrophobicContact CE3-CG1 4.1Å; W285-V303 HydrophobicContact CH2-CB 4.5Å; W285-V303 HydrophobicContact CH2-CG2 4.45Å; W285-V303 HydrophobicContact CZ3-CB 3.81Å; W285-V303 HydrophobicContact CZ3-CG1 3.74Å; W285-V303 HydrophobicContact CZ3-CG2 3.9Å |
| 286 | S | 70.4 | Confident | 73.1 | Confident | 16 Ų | 16 | 56.8 Ų | 56.8 | 11% | 0.112 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58.7 | -33.3 | 172.8 | -66.8 | 0 | 0 | 0 | 0 | 113.1 | L282 Q290 Y300 | L282-S286 PolarHBondContact O-N 3.39Å; L282-S286 PolarHBondContact O-OG 2.86Å; S286-Q290 WeakPolarHBondContact O-CB 3.43Å; S286-Q290 VanDerWaalsContact O-CG 3.27Å; S286-Q290 WeakPolarHBondContact O-CG 3.36Å; S286-Q290 PolarHBondContact O-N 3.29Å; S286-Q290 VanDerWaalsContact O-N 3.11Å; S286-Y300 WeakPolarHBondContact CB-OH 3.13Å; S286-Y300 PolarHBondContact OG-OH 3.06Å |
| 287 | A | 68.3 | Low | 72.8 | Confident | 1 Ų | 1 | 58.1 Ų | 58.1 | 1% | 0.008 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -75.2 | -29.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | L223 T283 L284 W285 Q290 L291 | L223-A287 HydrophobicContact CD2-CB 3.71Å; L223-A287 HydrophobicContact CG-CB 4.22Å; T283-A287 WeakPolarHBondContact O-CB 3.27Å; T283-A287 PolarHBondContact O-N 3.35Å; T283-A287 VanDerWaalsContact O-N 3.09Å; L284-A287 WeakPolarHBondContact O-CB 3.39Å; L284-A287 PolarHBondContact O-N 3.38Å; L284-A287 VanDerWaalsContact O-N 3.11Å; W285-A287 PolarHBondContact O-N 3.42Å; A287-Q290 CarbonylContact O-C 3.54Å; A287-Q290 PolarHBondContact O-N 3.49Å; A287-L291 WeakPolarHBondContact O-CG 3.39Å; A287-L291 PolarHBondContact O-N 3.01Å |
| 288 | L | 71.6 | Confident | 72.3 | Confident | 53 Ų | 53 | 58.5 Ų | 58.5 | 28% | 0.277 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -70.4 | -38.5 | 173.6 | -69.5 | 170.4 | 0 | 0 | 0 | 112 | L284 W285 L291 L293 T294 | L284-L288 HydrophobicContact CD1-CD1 4.22Å; L284-L288 HydrophobicContact CD1-CG 4.17Å; L284-L288 HydrophobicContact CG-CD1 4.27Å; L284-L288 WeakPolarHBondContact O-CG 3.34Å; L284-L288 PolarHBondContact O-N 3.16Å; W285-L288 PolarHBondContact O-N 2.99Å; W285-L288 VanDerWaalsContact O-N 3.13Å; L288-L291 PolarHBondContact O-N 3.38Å; L288-L293 HydrophobicContact CD2-CD1 3.88Å; L288-L293 PolarHBondContact O-N 3.09Å; L288-L293 VanDerWaalsContact O-N 3.17Å; L288-T294 HydrophobicContact CB-CG2 4.47Å |
| 289 | I | 70.3 | Confident | 71.7 | Confident | 18 Ų | 18 | 59.6 Ų | 59.6 | 9% | 0.092 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -65 | -40.9 | 171.5 | -66.1 | 167.3 | 0 | 0 | 0 | 110.2 | W285 L291 D292 T294 I296 Y300 | W285-I289 PolarHBondContact O-N 2.71Å; W285-I289 VanDerWaalsContact O-N 3.15Å; I289-L291 PolarHBondContact O-N 3.43Å; I289-D292 PolarHBondContact O-N 2.98Å; I289-D292 VanDerWaalsContact O-N 3.12Å; I289-T294 VanDerWaalsContact CG1-OG1 3.28Å; I289-T294 WeakPolarHBondContact CG1-OG1 3.4Å; I289-T294 PolarHBondContact N-OG1 3.18Å; I289-I296 HydrophobicContact CG2-CD1 4.44Å; I289-I296 HydrophobicContact CG2-CG1 3.67Å; I289-Y300 HydrophobicContact CD1-CD1 3.81Å; I289-Y300 HydrophobicContact CD1-CD2 3.29Å; I289-Y300 HydrophobicContact CD1-CE1 3.89Å; I289-Y300 HydrophobicContact CD1-CE2 3.4Å; I289-Y300 HydrophobicContact CD1-CG 3.51Å |
| 290 | Q | 65.3 | Low | 71.1 | Confident | 68 Ų | 68 | 59.1 Ų | 59.1 | 32% | 0.318 | 32% | 0.32 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.2 | 12.5 | 174.4 | -70.9 | -178.5 | -18.7 | 0 | 0 | 115.1 | Q219 S286 A287 | Q219-Q290 HydrophobicContact CG-CB 4.36Å; Q219-Q290 PolarHBondContact NE2-O 2.95Å; S286-Q290 WeakPolarHBondContact O-CB 3.43Å; S286-Q290 VanDerWaalsContact O-CG 3.27Å; S286-Q290 WeakPolarHBondContact O-CG 3.36Å; S286-Q290 PolarHBondContact O-N 3.29Å; S286-Q290 VanDerWaalsContact O-N 3.11Å; A287-Q290 CarbonylContact O-C 3.54Å; A287-Q290 PolarHBondContact O-N 3.49Å |
| 291 | L | 66.2 | Low | 70.5 | Confident | 53 Ų | 53 | 62.4 Ų | 62.4 | 28% | 0.277 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -128.2 | 8.6 | 173.8 | -74 | 171.2 | 0 | 0 | 0 | 111.9 | Q219 L223 A287 L288 I289 L293 | Q219-L291 HydrophobicContact CB-CD1 4.24Å; Q219-L291 HydrophobicContact CB-CD2 3.69Å; Q219-L291 HydrophobicContact CB-CG 4.01Å; Q219-L291 HydrophobicContact CG-CD2 4.05Å; Q219-L291 HydrophobicContact CG-CG 4.09Å; L223-L291 HydrophobicContact CD1-CD1 4.09Å; A287-L291 WeakPolarHBondContact O-CG 3.39Å; A287-L291 PolarHBondContact O-N 3.01Å; L288-L291 PolarHBondContact O-N 3.38Å; I289-L291 PolarHBondContact O-N 3.43Å; L291-L293 HydrophobicContact CB-CD1 3.96Å; L291-L293 HydrophobicContact CB-CG 3.91Å; L291-L293 HydrophobicContact CD1-CD1 4.19Å; L291-L293 PolarHBondContact O-N 3.24Å; L291-L293 VanDerWaalsContact O-N 3.11Å |
| 292 | D | 67.3 | Low | 70.1 | Confident | 148 Ų | 148 | 65.4 Ų | 65.4 | 79% | 0.791 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.7 | 22.2 | -175.6 | -54 | -43.2 | 0 | 0 | 0 | 114.4 | I289 | I289-D292 PolarHBondContact O-N 2.98Å; I289-D292 VanDerWaalsContact O-N 3.12Å |
| 293 | L | 66.1 | Low | 69.9 | Low | 120 Ų | 120 | 65.2 Ų | 65.2 | 63% | 0.628 | 34% | 0.34 | S | S | * | . | S | Bend | trans | -85.3 | -14.2 | 179.8 | -63.6 | 176.2 | 0 | 0 | 0 | 113.3 | L288 L291 | L288-L293 HydrophobicContact CD2-CD1 3.88Å; L288-L293 PolarHBondContact O-N 3.09Å; L288-L293 VanDerWaalsContact O-N 3.17Å; L291-L293 HydrophobicContact CB-CD1 3.96Å; L291-L293 HydrophobicContact CB-CG 3.91Å; L291-L293 HydrophobicContact CD1-CD1 4.19Å; L291-L293 PolarHBondContact O-N 3.24Å; L291-L293 VanDerWaalsContact O-N 3.11Å |
| 294 | T | 67.1 | Low | 69.7 | Low | 55 Ų | 55 | 68.4 Ų | 68.4 | 34% | 0.337 | 35% | 0.354 | S | S | . | . | S | Bend | trans | -149.9 | 132.7 | 179.7 | 53.1 | 0 | 0 | 0 | 0 | 110.3 | L288 I289 | L288-T294 HydrophobicContact CB-CG2 4.47Å; I289-T294 VanDerWaalsContact CG1-OG1 3.28Å; I289-T294 WeakPolarHBondContact CG1-OG1 3.4Å; I289-T294 PolarHBondContact N-OG1 3.18Å |
| 295 | E | 71.3 | Confident | 69.3 | Low | 179 Ų | 179 | 69.2 Ų | 69.2 | 84% | 0.836 | 36% | 0.361 | S | S | * | . | trans | -67 | 151 | -179.3 | -65.2 | -179.4 | 176 | 0 | 0 | 113.8 | S297 | E295-S297 PolarHBondContact O-N 2.74Š| ||
| 296 | I | 67.4 | Low | 69 | Low | 76 Ų | 76 | 70.4 Ų | 70.4 | 39% | 0.39 | 37% | 0.366 | S | S | . | . | trans | -73.6 | 108.1 | 174.3 | -62.3 | 156.2 | 0 | 0 | 0 | 108.9 | F13 I289 Y300 Y301 | F13-I296 HydrophobicContact CE1-CD1 3.97Å; F13-I296 HydrophobicContact CE1-CG2 4.39Å; I289-I296 HydrophobicContact CG2-CD1 4.44Å; I289-I296 HydrophobicContact CG2-CG1 3.67Å; I296-Y300 HydrophobicContact CG2-CD1 4.46Å; I296-Y301 HydrophobicContact CG2-CD2 4.43Å; I296-Y301 HydrophobicContact CG2-CE2 3.5Å | ||
| 297 | S | 73.4 | Confident | 69.3 | Low | 39 Ų | 39 | 73.4 Ų | 73.4 | 27% | 0.273 | 38% | 0.38 | S | S | . | . | trans | -105.4 | 154.5 | -178.8 | 39.1 | 0 | 0 | 0 | 0 | 111.9 | E295 S299 Y300 Y301 | E295-S297 PolarHBondContact O-N 2.74Å; S297-S299 PolarHBondContact O-N 3.36Å; S297-S299 VanDerWaalsContact O-N 3.1Å; S297-S299 PolarHBondContact OG-OG 2.97Å; S297-Y300 VanDerWaalsContact O-CB 3.28Å; S297-Y300 WeakPolarHBondContact O-CB 3.25Å; S297-Y300 PolarHBondContact O-N 2.96Å; S297-Y301 WeakPolarHBondContact O-CD2 3.4Å | ||
| 298 | P | 69.7 | Low | 69.6 | Low | 113 Ų | 113 | 76.1 Ų | 76.1 | 73% | 0.734 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -54.7 | -31 | 177.6 | -28.6 | 36.4 | 0 | 0 | 0 | 114.1 | Y300 Y301 F302 | P298-Y300 VanDerWaalsContact C-N 3.33Å; P298-Y300 PolarHBondContact O-N 2.93Å; P298-Y301 PolarHBondContact O-N 3.37Å; P298-F302 PolarHBondContact O-N 3.3Å |
| 299 | S | 70.7 | Confident | 69.7 | Low | 62 Ų | 62 | 73.8 Ų | 73.8 | 43% | 0.434 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -64.4 | -31.9 | 173.7 | 49.3 | 0 | 0 | 0 | 0 | 113.3 | S297 F302 V303 | S297-S299 PolarHBondContact O-N 3.36Å; S297-S299 VanDerWaalsContact O-N 3.1Å; S297-S299 PolarHBondContact OG-OG 2.97Å; S299-F302 PolarHBondContact O-N 2.97Å; S299-V303 WeakPolarHBondContact O-CB 3.41Å; S299-V303 VanDerWaalsContact O-CG2 3.31Å; S299-V303 WeakPolarHBondContact O-CG2 3.32Å; S299-V303 PolarHBondContact O-N 3.03Å |
| 300 | Y | 70.7 | Confident | 70.1 | Confident | 14 Ų | 14 | 77.4 Ų | 77.4 | 6% | 0.055 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -62.9 | -44.4 | 176.6 | 178.6 | -112.9 | 0 | 0 | 0 | 111.6 | W285 S286 I289 I296 S297 P298 F302 V303 Q304 | W285-Y300 HydrophobicContact CD2-CD2 4.07Å; W285-Y300 AromaticContact CE2-CD2 3.92Å; W285-Y300 HydrophobicContact CE3-CD2 4.33Å; W285-Y300 HydrophobicContact CH2-CD2 4.32Å; W285-Y300 HydrophobicContact CZ2-CD2 4.05Å; W285-Y300 HydrophobicContact CZ2-CG 4.44Å; W285-Y300 HydrophobicContact CZ3-CD2 4.46Å; S286-Y300 WeakPolarHBondContact CB-OH 3.13Å; S286-Y300 PolarHBondContact OG-OH 3.06Å; I289-Y300 HydrophobicContact CD1-CD1 3.81Å; I289-Y300 HydrophobicContact CD1-CD2 3.29Å; I289-Y300 HydrophobicContact CD1-CE1 3.89Å; I289-Y300 HydrophobicContact CD1-CE2 3.4Å; I289-Y300 HydrophobicContact CD1-CG 3.51Å; I296-Y300 HydrophobicContact CG2-CD1 4.46Å; S297-Y300 VanDerWaalsContact O-CB 3.28Å; S297-Y300 WeakPolarHBondContact O-CB 3.25Å; S297-Y300 PolarHBondContact O-N 2.96Å; P298-Y300 VanDerWaalsContact C-N 3.33Å; P298-Y300 PolarHBondContact O-N 2.93Å; Y300-F302 PolarHBondContact O-N 3.39Å; Y300-V303 PolarHBondContact O-N 3.21Å; Y300-Q304 WeakPolarHBondContact O-CB 3.45Å; Y300-Q304 PolarHBondContact O-N 3.41Å; Y300-Q304 PolarHBondContact OH-OE1 3.41Å |
| 301 | Y | 65.3 | Low | 70.9 | Confident | 81 Ų | 81 | 74.4 Ų | 74.4 | 32% | 0.318 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -58.8 | -45.7 | 175.8 | -65.9 | -91.6 | 0 | 0 | 0 | 112 | L9 F13 I296 S297 P298 T305 | L9-Y301 HydrophobicContact CD2-CD1 3.98Å; L9-Y301 HydrophobicContact CD2-CE1 4.3Å; F13-Y301 HydrophobicContact CD2-CE1 4.19Å; F13-Y301 HydrophobicContact CE2-CD1 4.23Å; F13-Y301 AromaticContact CE2-CE1 3.39Å; F13-Y301 HydrophobicContact CE2-CE1 3.39Å; F13-Y301 HydrophobicContact CZ-CD1 4.46Å; F13-Y301 AromaticContact CZ-CE1 3.59Å; F13-Y301 HydrophobicContact CZ-CE1 3.59Å; F13-Y301 AromaticContact CZ-CZ 3.84Å; I296-Y301 HydrophobicContact CG2-CD2 4.43Å; I296-Y301 HydrophobicContact CG2-CE2 3.5Å; S297-Y301 WeakPolarHBondContact O-CD2 3.4Å; P298-Y301 PolarHBondContact O-N 3.37Å; Y301-T305 VanDerWaalsContact O-CB 3.25Å; Y301-T305 WeakPolarHBondContact O-CB 3.44Å; Y301-T305 PolarHBondContact O-N 3.22Å; Y301-T305 PolarHBondContact O-OG1 3.13Å |
| 302 | F | 72.5 | Confident | 71.6 | Confident | 118 Ų | 118 | 72.9 Ų | 72.9 | 52% | 0.518 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.9 | -47.8 | 175.8 | 177.6 | -92.8 | 0 | 0 | 0 | 111.5 | P298 S299 Y300 T305 Y306 | P298-F302 PolarHBondContact O-N 3.3Å; S299-F302 PolarHBondContact O-N 2.97Å; Y300-F302 PolarHBondContact O-N 3.39Å; F302-T305 PolarHBondContact O-N 2.97Å; F302-Y306 AromaticContact CD2-CD2 3.45Å; F302-Y306 HydrophobicContact CD2-CD2 3.45Å; F302-Y306 VanDerWaalsContact CD2-CD2 3.45Å; F302-Y306 AromaticContact CD2-CE2 3.78Å; F302-Y306 HydrophobicContact CD2-CE2 3.78Å; F302-Y306 HydrophobicContact CD2-CG 4.48Å; F302-Y306 AromaticContact CE2-CD2 3.57Å; F302-Y306 HydrophobicContact CE2-CD2 3.57Å; F302-Y306 AromaticContact CE2-CE2 3.99Å; F302-Y306 HydrophobicContact CE2-CE2 3.99Å; F302-Y306 HydrophobicContact CE2-CG 4.24Å; F302-Y306 HydrophobicContact CG-CD2 4.06Å; F302-Y306 HydrophobicContact CZ-CD2 4.26Å; F302-Y306 VanDerWaalsContact O-CD2 3.32Å; F302-Y306 WeakPolarHBondContact O-CD2 3.46Å; F302-Y306 PolarHBondContact O-N 3.44Å |
| 303 | V | 71.9 | Confident | 72.4 | Confident | 20 Ų | 20 | 66.4 Ų | 66.4 | 12% | 0.121 | 34% | 0.344 | C | S | . | . | I | π-helix | trans | -66.7 | -40.2 | -178.5 | 169.6 | 0 | 0 | 0 | 0 | 112.1 | L282 W285 S299 Y300 L307 F308 | L282-V303 HydrophobicContact CD1-CG1 4.19Å; L282-V303 HydrophobicContact CD2-CG1 3.35Å; L282-V303 HydrophobicContact CG-CG1 4.38Å; W285-V303 HydrophobicContact CE3-CG1 4.1Å; W285-V303 HydrophobicContact CH2-CB 4.5Å; W285-V303 HydrophobicContact CH2-CG2 4.45Å; W285-V303 HydrophobicContact CZ3-CB 3.81Å; W285-V303 HydrophobicContact CZ3-CG1 3.74Å; W285-V303 HydrophobicContact CZ3-CG2 3.9Å; S299-V303 WeakPolarHBondContact O-CB 3.41Å; S299-V303 VanDerWaalsContact O-CG2 3.31Å; S299-V303 WeakPolarHBondContact O-CG2 3.32Å; S299-V303 PolarHBondContact O-N 3.03Å; Y300-V303 PolarHBondContact O-N 3.21Å; V303-L307 HydrophobicContact CB-CD1 4.49Å; V303-L307 HydrophobicContact CG1-CB 4.13Å; V303-L307 HydrophobicContact CG1-CD1 4.26Å; V303-L307 HydrophobicContact CG2-CD1 3.9Å; V303-L307 HydrophobicContact CG2-CG 4.5Å; V303-L307 CarbonylContact O-C 3.6Å; V303-L307 WeakPolarHBondContact O-CA 3.49Å; V303-L307 WeakPolarHBondContact O-CB 3.37Å; V303-L307 PolarHBondContact O-N 3.24Å; V303-F308 PolarHBondContact O-N 3.11Å |
| 304 | Q | 69 | Low | 73.3 | Confident | 85 Ų | 85 | 64.3 Ų | 64.3 | 40% | 0.397 | 33% | 0.333 | S | S | . | . | I | π-helix | trans | -71.1 | -31.7 | 177.2 | -167.5 | 177.7 | -5.1 | 0 | 0 | 112.4 | Y300 | Y300-Q304 WeakPolarHBondContact O-CB 3.45Å; Y300-Q304 PolarHBondContact O-N 3.41Å; Y300-Q304 PolarHBondContact OH-OE1 3.41Å |
| 305 | T | 65.6 | Low | 74.2 | Confident | 65 Ų | 65 | 61.7 Ų | 61.7 | 40% | 0.399 | 32% | 0.317 | S | S | . | . | I | π-helix | trans | -77 | -44.5 | 178.2 | -56.2 | 0 | 0 | 0 | 0 | 112.3 | Y301 F302 P309 | Y301-T305 VanDerWaalsContact O-CB 3.25Å; Y301-T305 WeakPolarHBondContact O-CB 3.44Å; Y301-T305 PolarHBondContact O-N 3.22Å; Y301-T305 PolarHBondContact O-OG1 3.13Å; F302-T305 PolarHBondContact O-N 2.97Å; T305-P309 WeakPolarHBondContact O-CG 3.36Å |
| 306 | Y | 69.6 | Low | 74.9 | Confident | 95 Ų | 95 | 53.2 Ų | 53.2 | 37% | 0.373 | 28% | 0.278 | S | S | . | . | I | π-helix | trans | -106.2 | -46.6 | -170.2 | -62.2 | -76.6 | 0 | 0 | 0 | 113.9 | L48 F302 L310 | L48-Y306 HydrophobicContact CD2-CD1 3.51Å; L48-Y306 HydrophobicContact CD2-CE1 3.74Å; F302-Y306 AromaticContact CD2-CD2 3.45Å; F302-Y306 HydrophobicContact CD2-CD2 3.45Å; F302-Y306 VanDerWaalsContact CD2-CD2 3.45Å; F302-Y306 AromaticContact CD2-CE2 3.78Å; F302-Y306 HydrophobicContact CD2-CE2 3.78Å; F302-Y306 HydrophobicContact CD2-CG 4.48Å; F302-Y306 AromaticContact CE2-CD2 3.57Å; F302-Y306 HydrophobicContact CE2-CD2 3.57Å; F302-Y306 AromaticContact CE2-CE2 3.99Å; F302-Y306 HydrophobicContact CE2-CE2 3.99Å; F302-Y306 HydrophobicContact CE2-CG 4.24Å; F302-Y306 HydrophobicContact CG-CD2 4.06Å; F302-Y306 HydrophobicContact CZ-CD2 4.26Å; F302-Y306 VanDerWaalsContact O-CD2 3.32Å; F302-Y306 WeakPolarHBondContact O-CD2 3.46Å; F302-Y306 PolarHBondContact O-N 3.44Å; Y306-L310 WeakPolarHBondContact O-CD1 3.38Å; Y306-L310 VanDerWaalsContact O-CG 3.31Å; Y306-L310 WeakPolarHBondContact O-CG 3.27Å |
| 307 | L | 76.1 | Confident | 75.8 | Confident | 78 Ų | 78 | 51.3 Ų | 51.3 | 41% | 0.408 | 27% | 0.27 | S | S | . | . | I | π-helix | trans | -84.4 | -32.4 | -174 | -58.9 | -172.7 | 0 | 0 | 0 | 113.3 | L282 V303 L310 A311 | L282-L307 HydrophobicContact CD1-CB 4.02Å; V303-L307 HydrophobicContact CB-CD1 4.49Å; V303-L307 HydrophobicContact CG1-CB 4.13Å; V303-L307 HydrophobicContact CG1-CD1 4.26Å; V303-L307 HydrophobicContact CG2-CD1 3.9Å; V303-L307 HydrophobicContact CG2-CG 4.5Å; V303-L307 CarbonylContact O-C 3.6Å; V303-L307 WeakPolarHBondContact O-CA 3.49Å; V303-L307 WeakPolarHBondContact O-CB 3.37Å; V303-L307 PolarHBondContact O-N 3.24Å; L307-L310 PolarHBondContact O-N 3.33Å; L307-A311 VanDerWaalsContact O-CB 3.29Å; L307-A311 WeakPolarHBondContact O-CB 3.31Å; L307-A311 PolarHBondContact O-N 3.11Å |
| 308 | F | 75.3 | Confident | 76.3 | Confident | 59 Ų | 59 | 49.5 Ų | 49.5 | 26% | 0.259 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -63.2 | -45.6 | 179.4 | -178.6 | -90.8 | 0 | 0 | 0 | 113 | Y279 L282 V303 L310 A311 N312 | Y279-F308 HydrophobicContact CD2-CE2 4.33Å; Y279-F308 HydrophobicContact CE2-CE2 4.08Å; Y279-F308 AromaticContact CE2-CZ 3.9Å; Y279-F308 HydrophobicContact CE2-CZ 3.9Å; L282-F308 HydrophobicContact CB-CD2 3.99Å; L282-F308 HydrophobicContact CD1-CB 4.17Å; V303-F308 PolarHBondContact O-N 3.11Å; F308-L310 PolarHBondContact O-N 3.02Å; F308-A311 PolarHBondContact O-N 3.26Å; F308-N312 WeakPolarHBondContact O-CB 3.47Å; F308-N312 PolarHBondContact O-N 3.25Å |
| 309 | P | 73.8 | Confident | 77 | Confident | 4 Ų | 4 | 44.1 Ų | 44.1 | 3% | 0.026 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -63.7 | -40.2 | 174.4 | -22.5 | 34.6 | 0 | 0 | 0 | 112.9 | I52 T305 N312 C313 | I52-P309 HydrophobicContact CD1-CB 3.53Å; I52-P309 HydrophobicContact CD1-CG 4.3Å; I52-P309 HydrophobicContact CG1-CB 4.32Å; T305-P309 WeakPolarHBondContact O-CG 3.36Å; P309-N312 CarbonylContact O-C 3.57Å; P309-N312 WeakPolarHBondContact O-CB 3.31Å; P309-N312 PolarHBondContact O-N 3.39Å; P309-N312 VanDerWaalsContact O-N 3.16Å; P309-C313 PolarHBondContact O-N 3.3Å; P309-C313 PolarHBondContact O-SG 3.31Å |
| 310 | L | 77.6 | Confident | 77.6 | Confident | 93 Ų | 93 | 42.3 Ų | 42.3 | 49% | 0.487 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -63.6 | -39.9 | 176.1 | -69.6 | 174.1 | 0 | 0 | 0 | 112.4 | Y306 L307 F308 N312 C313 L314 | Y306-L310 WeakPolarHBondContact O-CD1 3.38Å; Y306-L310 VanDerWaalsContact O-CG 3.31Å; Y306-L310 WeakPolarHBondContact O-CG 3.27Å; L307-L310 PolarHBondContact O-N 3.33Å; F308-L310 PolarHBondContact O-N 3.02Å; L310-N312 VanDerWaalsContact C-N 3.3Å; L310-N312 PolarHBondContact O-N 2.85Å; L310-C313 WeakPolarHBondContact O-CB 3.46Å; L310-C313 PolarHBondContact O-N 2.98Å; L310-L314 PolarHBondContact O-N 2.78Å |
| 311 | A | 83 | Confident | 78 | Confident | 6 Ų | 6 | 44 Ų | 44 | 5% | 0.05 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.9 | -35.6 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | P278 L282 L307 F308 L314 A315 | P278-A311 HydrophobicContact CB-CB 3.95Å; P278-A311 HydrophobicContact CG-CB 4.26Å; L282-A311 HydrophobicContact CD1-CB 3.95Å; L307-A311 VanDerWaalsContact O-CB 3.29Å; L307-A311 WeakPolarHBondContact O-CB 3.31Å; L307-A311 PolarHBondContact O-N 3.11Å; F308-A311 PolarHBondContact O-N 3.26Å; A311-L314 PolarHBondContact O-N 3.28Å; A311-A315 WeakPolarHBondContact O-CB 3.45Å; A311-A315 PolarHBondContact O-N 3.46Å |
| 312 | N | 81.4 | Confident | 78.7 | Confident | 20 Ų | 20 | 40.3 Ų | 40.3 | 11% | 0.107 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -69.7 | -39.8 | 174.4 | -155.2 | 45.6 | 0 | 0 | 0 | 111.6 | Y56 Y279 F308 P309 L310 L314 A315 F316 | Y56-N312 PolarHBondContact OH-ND2 2.97Å; Y279-N312 HydrophobicContact CD2-CB 4.16Å; Y279-N312 WeakPolarHBondContact CD2-OD1 3.35Å; Y279-N312 HydrophobicContact CE2-CB 4.4Å; Y279-N312 WeakPolarHBondContact CE2-OD1 3.44Å; F308-N312 WeakPolarHBondContact O-CB 3.47Å; F308-N312 PolarHBondContact O-N 3.25Å; P309-N312 CarbonylContact O-C 3.57Å; P309-N312 WeakPolarHBondContact O-CB 3.31Å; P309-N312 PolarHBondContact O-N 3.39Å; P309-N312 VanDerWaalsContact O-N 3.16Å; L310-N312 VanDerWaalsContact C-N 3.3Å; L310-N312 PolarHBondContact O-N 2.85Å; N312-L314 VanDerWaalsContact C-N 3.31Å; N312-L314 PolarHBondContact O-N 2.88Å; N312-A315 PolarHBondContact O-N 3.25Å; N312-F316 WeakPolarHBondContact ND2-CE2 3.46Å; N312-F316 WeakPolarHBondContact ND2-CZ 3.47Å; N312-F316 WeakPolarHBondContact O-CD2 3.02Å; N312-F316 VanDerWaalsContact O-CG 3.28Å; N312-F316 WeakPolarHBondContact O-CG 3.49Å; N312-F316 PolarHBondContact O-N 2.87Å |
| 313 | C | 83.2 | Confident | 78.9 | Confident | 12 Ų | 12 | 34.9 Ų | 34.9 | 8% | 0.081 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -54.3 | -47.9 | 168.6 | -61.3 | 0 | 0 | 0 | 0 | 111.3 | V55 Y56 P309 L310 F316 T317 | V55-C313 HydrophobicContact CG1-CB 4.02Å; Y56-C313 HydrophobicContact CE1-CB 4.24Å; Y56-C313 VanDerWaalsContact CE1-SG 3.53Å; P309-C313 PolarHBondContact O-N 3.3Å; P309-C313 PolarHBondContact O-SG 3.31Å; L310-C313 WeakPolarHBondContact O-CB 3.46Å; L310-C313 PolarHBondContact O-N 2.98Å; C313-F316 PolarHBondContact O-N 3.42Å; C313-T317 PolarHBondContact O-N 2.94Å; C313-T317 PolarHBondContact O-OG1 3.29Å |
| 314 | L | 85.6 | Confident | 79 | Confident | 76 Ų | 76 | 37.5 Ų | 37.5 | 40% | 0.398 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -65.8 | -44.1 | -178.1 | -162.9 | 78 | 0 | 0 | 0 | 111.5 | T274 C275 P278 L310 A311 N312 F316 T317 | T274-L314 WeakPolarHBondContact O-CD2 3.49Å; C275-L314 HydrophobicContact CB-CG 4.48Å; C275-L314 VanDerWaalsContact CB-O 3.32Å; C275-L314 WeakPolarHBondContact CB-O 3.34Å; P278-L314 HydrophobicContact CG-CD2 3.76Å; L310-L314 PolarHBondContact O-N 2.78Å; A311-L314 PolarHBondContact O-N 3.28Å; N312-L314 VanDerWaalsContact C-N 3.31Å; N312-L314 PolarHBondContact O-N 2.88Å; L314-F316 PolarHBondContact O-N 2.96Å; L314-T317 WeakPolarHBondContact O-CB 3.29Å; L314-T317 PolarHBondContact O-N 3.49Å |
| 315 | A | 85.1 | Confident | 79.1 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -57.1 | -48.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | C275 W276 Y279 A311 N312 T317 S318 | C275-A315 WeakPolarHBondContact O-CA 3.44Å; C275-A315 PolarHBondContact O-N 3.05Å; W276-A315 HydrophobicContact CD2-CB 3.85Å; W276-A315 HydrophobicContact CE3-CB 3.73Å; W276-A315 HydrophobicContact CG-CB 4.49Å; W276-A315 HydrophobicContact CH2-CB 4.01Å; W276-A315 HydrophobicContact CZ2-CB 4.15Å; W276-A315 HydrophobicContact CZ3-CB 3.81Å; W276-A315 PolarHBondContact NE1-O 3.34Å; Y279-A315 HydrophobicContact CG-CB 4.33Å; A311-A315 WeakPolarHBondContact O-CB 3.45Å; A311-A315 PolarHBondContact O-N 3.46Å; N312-A315 PolarHBondContact O-N 3.25Å; A315-T317 VanDerWaalsContact C-N 3.31Å; A315-T317 PolarHBondContact O-N 3.31Å; A315-S318 VanDerWaalsContact O-CB 3.3Å; A315-S318 WeakPolarHBondContact O-CB 3.35Å; A315-S318 PolarHBondContact O-N 3.02Å; A315-S318 PolarHBondContact O-OG 2.86Å |
| 316 | F | 85.8 | Confident | 79.4 | Confident | 2 Ų | 2 | 31.5 Ų | 31.5 | 1% | 0.009 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -65.2 | -30.7 | 177.2 | -64 | -23.7 | 0 | 0 | 0 | 113.5 | Y56 V59 L99 L103 T130 N312 C313 L314 S318 C319 | Y56-F316 HydrophobicContact CD1-CD2 4.21Å; Y56-F316 HydrophobicContact CD2-CD2 4.47Å; Y56-F316 HydrophobicContact CD2-CE2 4.36Å; Y56-F316 AromaticContact CE1-CD2 3.81Å; Y56-F316 HydrophobicContact CE1-CD2 3.81Å; Y56-F316 HydrophobicContact CE1-CE2 4.19Å; Y56-F316 HydrophobicContact CE2-CD2 4.09Å; Y56-F316 AromaticContact CE2-CE2 3.73Å; Y56-F316 HydrophobicContact CE2-CE2 3.73Å; Y56-F316 AromaticContact CZ-CD2 3.78Å; Y56-F316 AromaticContact CZ-CE2 3.67Å; V59-F316 HydrophobicContact CG1-CB 4.4Å; V59-F316 WeakPolarHBondContact CG1-O 3.37Å; L99-F316 HydrophobicContact CD1-CD1 4.39Å; L99-F316 HydrophobicContact CD1-CE1 4.41Å; L99-F316 HydrophobicContact CD2-CD1 4.35Å; L103-F316 HydrophobicContact CD1-CB 4.39Å; L103-F316 HydrophobicContact CD2-CB 3.83Å; L103-F316 HydrophobicContact CD2-CD1 3.93Å; L103-F316 HydrophobicContact CD2-CD2 3.27Å; L103-F316 HydrophobicContact CD2-CE1 4.27Å; L103-F316 HydrophobicContact CD2-CE2 3.64Å; L103-F316 HydrophobicContact CD2-CG 3.42Å; L103-F316 VanDerWaalsContact CD2-CG 3.42Å; L103-F316 HydrophobicContact CD2-CZ 4.13Å; T130-F316 HydrophobicContact CG2-CE1 3.83Å; T130-F316 HydrophobicContact CG2-CZ 4.32Å; N312-F316 WeakPolarHBondContact ND2-CE2 3.46Å; N312-F316 WeakPolarHBondContact ND2-CZ 3.47Å; N312-F316 WeakPolarHBondContact O-CD2 3.02Å; N312-F316 VanDerWaalsContact O-CG 3.28Å; N312-F316 WeakPolarHBondContact O-CG 3.49Å; N312-F316 PolarHBondContact O-N 2.87Å; C313-F316 PolarHBondContact O-N 3.42Å; L314-F316 PolarHBondContact O-N 2.96Å; F316-S318 PolarHBondContact O-N 3.21Å; F316-C319 PolarHBondContact O-N 3.38Å; F316-C319 VanDerWaalsContact O-N 3.14Å; F316-C319 PolarHBondContact O-SG 3.48Å |
| 317 | T | 86 | Confident | 79.3 | Confident | 36 Ų | 36 | 27.9 Ų | 27.9 | 22% | 0.221 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -60 | -20.1 | 175.9 | -56.4 | 0 | 0 | 0 | 0 | 112.5 | C313 L314 A315 C319 C320 L321 | C313-T317 PolarHBondContact O-N 2.94Å; C313-T317 PolarHBondContact O-OG1 3.29Å; L314-T317 WeakPolarHBondContact O-CB 3.29Å; L314-T317 PolarHBondContact O-N 3.49Å; A315-T317 VanDerWaalsContact C-N 3.31Å; A315-T317 PolarHBondContact O-N 3.31Å; T317-C319 PolarHBondContact O-N 3.22Å; T317-C320 PolarHBondContact O-N 3.2Å; T317-C320 PolarHBondContact O-SG 3.46Å; T317-L321 HydrophobicContact CG2-CD1 3.9Å; T317-L321 HydrophobicContact CG2-CG 4.08Å; T317-L321 WeakPolarHBondContact O-CG 3.49Å; T317-L321 PolarHBondContact O-N 3.35Å; T317-L321 VanDerWaalsContact O-N 3.16Å |
| 318 | S | 85 | Confident | 78.6 | Confident | 1 Ų | 1 | 29.5 Ų | 29.5 | 1% | 0.007 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -56.6 | -33.3 | 173.8 | 66 | 0 | 0 | 0 | 0 | 114 | W276 A315 F316 C320 L321 N322 | W276-S318 PolarHBondContact NE1-OG 2.88Å; A315-S318 VanDerWaalsContact O-CB 3.3Å; A315-S318 WeakPolarHBondContact O-CB 3.35Å; A315-S318 PolarHBondContact O-N 3.02Å; A315-S318 PolarHBondContact O-OG 2.86Å; F316-S318 PolarHBondContact O-N 3.21Å; S318-C320 PolarHBondContact O-N 3.1Å; S318-L321 PolarHBondContact O-N 2.9Å; S318-N322 PolarHBondContact O-N 2.84Å |
| 319 | C | 84.3 | Confident | 78 | Confident | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -73.4 | -24.5 | -175.8 | 80.2 | 0 | 0 | 0 | 0 | 113.6 | N67 D96 L99 F316 T317 P323 | N67-C319 PolarHBondContact ND2-O 3.37Å; D96-C319 HydrophobicContact CB-CB 3.89Å; D96-C319 WeakPolarHBondContact OD1-CB 3.35Å; L99-C319 HydrophobicContact CD2-CB 4.05Å; F316-C319 PolarHBondContact O-N 3.38Å; F316-C319 VanDerWaalsContact O-N 3.14Å; F316-C319 PolarHBondContact O-SG 3.48Å; T317-C319 PolarHBondContact O-N 3.22Å; C319-P323 WeakPolarHBondContact O-CD 3.25Å |
| 320 | C | 83.4 | Confident | 77.6 | Confident | 24 Ų | 24 | 29.5 Ų | 29.5 | 16% | 0.162 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -93.5 | -25.8 | 174.5 | 71.6 | 0 | 0 | 0 | 0 | 112.5 | T317 S318 P323 V324 | T317-C320 PolarHBondContact O-N 3.2Å; T317-C320 PolarHBondContact O-SG 3.46Å; S318-C320 PolarHBondContact O-N 3.1Å; C320-P323 WeakPolarHBondContact O-CD 3.43Å; C320-V324 WeakPolarHBondContact O-CG2 3.48Å |
| 321 | L | 79.5 | Confident | 76.8 | Confident | 48 Ų | 48 | 32.5 Ų | 32.5 | 25% | 0.251 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -66.2 | -36.1 | 174.1 | -73.7 | 168.8 | 0 | 0 | 0 | 112.7 | T317 S318 V324 I325 | T317-L321 HydrophobicContact CG2-CD1 3.9Å; T317-L321 HydrophobicContact CG2-CG 4.08Å; T317-L321 WeakPolarHBondContact O-CG 3.49Å; T317-L321 PolarHBondContact O-N 3.35Å; T317-L321 VanDerWaalsContact O-N 3.16Å; S318-L321 PolarHBondContact O-N 2.9Å; L321-V324 PolarHBondContact O-N 2.84Å; L321-V324 VanDerWaalsContact O-N 3.12Å; L321-I325 HydrophobicContact CB-CD1 4.17Å; L321-I325 VanDerWaalsContact O-CG1 3.25Å; L321-I325 WeakPolarHBondContact O-CG1 3.45Å; L321-I325 PolarHBondContact O-N 3.48Å |
| 322 | N | 79.9 | Confident | 75.9 | Confident | 4 Ų | 4 | 37.4 Ų | 37.4 | 2% | 0.021 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -52.9 | -55.2 | 179.2 | -76 | -18 | 0 | 0 | 0 | 112.6 | D96 V268 S318 V324 I325 Y326 | D96-N322 PolarHBondContact OD2-ND2 3.23Å; V268-N322 VanDerWaalsContact CG1-OD1 3.31Å; V268-N322 WeakPolarHBondContact CG1-OD1 3.36Å; S318-N322 PolarHBondContact O-N 2.84Å; N322-V324 PolarHBondContact O-N 2.97Å; N322-I325 PolarHBondContact O-N 3.05Å; N322-Y326 HydrophobicContact CB-CE2 4.45Å; N322-Y326 WeakPolarHBondContact O-CD2 3.46Å; N322-Y326 PolarHBondContact O-N 3.03Å; N322-Y326 VanDerWaalsContact O-N 3.1Å |
| 323 | P | 75.4 | Confident | 75 | Confident | 4 Ų | 4 | 37 Ų | 37 | 3% | 0.026 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -52.1 | -47.4 | 169.8 | -31.9 | 35.9 | 0 | 0 | 0 | 115.6 | G66 N67 V70 C319 C320 I325 Y326 C327 | G66-P323 VanDerWaalsContact C-CG 3.42Å; N67-P323 HydrophobicContact CB-CG 4.37Å; N67-P323 VanDerWaalsContact CG-CG 3.49Å; N67-P323 WeakPolarHBondContact OD1-CG 3.43Å; V70-P323 HydrophobicContact CG2-CB 3.89Å; V70-P323 HydrophobicContact CG2-CG 4.27Å; C319-P323 WeakPolarHBondContact O-CD 3.25Å; C320-P323 WeakPolarHBondContact O-CD 3.43Å; P323-I325 PolarHBondContact O-N 3.11Å; P323-Y326 PolarHBondContact O-N 2.84Å; P323-C327 WeakPolarHBondContact O-CB 3.22Å; P323-C327 PolarHBondContact O-N 3.15Å; P323-C327 PolarHBondContact O-SG 3.17Å |
| 324 | V | 73.5 | Confident | 74.3 | Confident | 75 Ų | 75 | 41.5 Ų | 41.5 | 46% | 0.455 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -62.1 | -46.4 | -176.8 | 174 | 0 | 0 | 0 | 0 | 110.5 | C320 L321 N322 Y326 C327 L328 | C320-V324 WeakPolarHBondContact O-CG2 3.48Å; L321-V324 PolarHBondContact O-N 2.84Å; L321-V324 VanDerWaalsContact O-N 3.12Å; N322-V324 PolarHBondContact O-N 2.97Å; V324-Y326 PolarHBondContact O-N 3.44Å; V324-C327 PolarHBondContact O-N 3.49Å; V324-L328 HydrophobicContact CG1-CD1 3.81Å; V324-L328 HydrophobicContact CG1-CG 4.34Å; V324-L328 WeakPolarHBondContact O-CB 3.29Å; V324-L328 WeakPolarHBondContact O-CG 3.46Å; V324-L328 PolarHBondContact O-N 3.3Å |
| 325 | I | 72.7 | Confident | 73.4 | Confident | 12 Ų | 12 | 45.6 Ų | 45.6 | 6% | 0.062 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -64.6 | -42 | 179.7 | -62.3 | 163.1 | 0 | 0 | 0 | 110.6 | V267 V268 L321 N322 P323 I329 | V267-I325 HydrophobicContact CB-CG2 4.1Å; V267-I325 HydrophobicContact CG1-CD1 4.22Å; V267-I325 HydrophobicContact CG1-CG1 4.19Å; V267-I325 HydrophobicContact CG1-CG2 3.72Å; V268-I325 HydrophobicContact CG2-CB 4.01Å; V268-I325 HydrophobicContact CG2-CD1 4.37Å; V268-I325 HydrophobicContact CG2-CG2 3.42Å; V268-I325 VanDerWaalsContact CG2-CG2 3.42Å; L321-I325 HydrophobicContact CB-CD1 4.17Å; L321-I325 VanDerWaalsContact O-CG1 3.25Å; L321-I325 WeakPolarHBondContact O-CG1 3.45Å; L321-I325 PolarHBondContact O-N 3.48Å; N322-I325 PolarHBondContact O-N 3.05Å; P323-I325 PolarHBondContact O-N 3.11Å; I325-I329 HydrophobicContact CG2-CD1 3.64Å; I325-I329 HydrophobicContact CG2-CG1 4.38Å; I325-I329 WeakPolarHBondContact O-CB 3.08Å; I325-I329 WeakPolarHBondContact O-CG1 3.44Å; I325-I329 PolarHBondContact O-N 3.48Å |
| 326 | Y | 70.6 | Confident | 72.5 | Confident | 13 Ų | 13 | 46.8 Ų | 46.8 | 5% | 0.051 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.9 | -41.7 | 175.2 | -67.5 | -43.4 | 0 | 0 | 0 | 112.8 | V89 L92 V268 N322 P323 V324 R330 | V89-Y326 HydrophobicContact CG1-CD2 3.92Å; V89-Y326 HydrophobicContact CG1-CE2 3.74Å; V89-Y326 HydrophobicContact CG2-CE1 4.15Å; V89-Y326 HydrophobicContact CG2-CE2 4.18Å; L92-Y326 HydrophobicContact CD2-CE2 4.1Å; L92-Y326 VanDerWaalsContact CD2-OH 3.26Å; L92-Y326 WeakPolarHBondContact CD2-OH 3.41Å; V268-Y326 HydrophobicContact CG2-CD1 4.4Å; V268-Y326 HydrophobicContact CG2-CE1 3.85Å; N322-Y326 HydrophobicContact CB-CE2 4.45Å; N322-Y326 WeakPolarHBondContact O-CD2 3.46Å; N322-Y326 PolarHBondContact O-N 3.03Å; N322-Y326 VanDerWaalsContact O-N 3.1Å; P323-Y326 PolarHBondContact O-N 2.84Å; V324-Y326 PolarHBondContact O-N 3.44Å; Y326-R330 WeakPolarHBondContact O-CB 3.38Å; Y326-R330 PolarHBondContact O-N 3.12Å |
| 327 | C | 67.3 | Low | 71.6 | Confident | 18 Ų | 18 | 49.5 Ų | 49.5 | 12% | 0.122 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -67.4 | -41.1 | 179.4 | -69.8 | 0 | 0 | 0 | 0 | 112.3 | P323 V324 R334 | P323-C327 WeakPolarHBondContact O-CB 3.22Å; P323-C327 PolarHBondContact O-N 3.15Å; P323-C327 PolarHBondContact O-SG 3.17Å; V324-C327 PolarHBondContact O-N 3.49Å; C327-R334 WeakPolarHBondContact O-CG 3.28Å |
| 328 | L | 62.3 | Low | 70.9 | Confident | 112 Ų | 112 | 56.6 Ų | 56.6 | 59% | 0.586 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -69.3 | -43.3 | 177.1 | -70.5 | 175.2 | 0 | 0 | 0 | 112.1 | V324 R334 | V324-L328 HydrophobicContact CG1-CD1 3.81Å; V324-L328 HydrophobicContact CG1-CG 4.34Å; V324-L328 WeakPolarHBondContact O-CB 3.29Å; V324-L328 WeakPolarHBondContact O-CG 3.46Å; V324-L328 PolarHBondContact O-N 3.3Å; L328-R334 VanDerWaalsContact O-CD 3.32Å; L328-R334 WeakPolarHBondContact O-CD 3.37Å; L328-R334 PolarHBondContact O-NE 3.05Å |
| 329 | I | 62.5 | Low | 70.3 | Confident | 26 Ų | 26 | 60.1 Ų | 60.1 | 13% | 0.133 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -88.1 | -37.6 | -169.2 | -55.2 | 179.2 | 0 | 0 | 0 | 112.4 | H260 S264 V267 I325 R331 | H260-I329 PolarHBondContact CE1-O 2.82Å; H260-I329 PolarHBondContact ND1-O 2.78Å; H260-I329 WeakPolarHBondContact O-CG2 3.26Å; S264-I329 VanDerWaalsContact CB-CG2 3.5Å; V267-I329 HydrophobicContact CB-CD1 3.87Å; V267-I329 HydrophobicContact CG1-CD1 4.17Å; V267-I329 HydrophobicContact CG2-CD1 4.03Å; I325-I329 HydrophobicContact CG2-CD1 3.64Å; I325-I329 HydrophobicContact CG2-CG1 4.38Å; I325-I329 WeakPolarHBondContact O-CB 3.08Å; I325-I329 WeakPolarHBondContact O-CG1 3.44Å; I325-I329 PolarHBondContact O-N 3.48Å; I329-R331 PolarHBondContact O-N 2.7Å |
| 330 | R | 64.9 | Low | 69.6 | Low | 37 Ų | 37 | 62.8 Ų | 62.8 | 14% | 0.14 | 30% | 0.296 | C | S | . | . | trans | -77.8 | 110.5 | 178.8 | -66.6 | -171.1 | 178.1 | -147 | 14.9 | 111.5 | N86 Y326 E332 Y333 R334 | N86-R330 PolarHBondContact OD1-NH1 3.1Å; Y326-R330 WeakPolarHBondContact O-CB 3.38Å; Y326-R330 PolarHBondContact O-N 3.12Å; R330-E332 PolarHBondContact O-N 3Å; R330-E332 VanDerWaalsContact O-N 3.13Å; R330-Y333 HydrophobicContact CB-CD2 3.57Å; R330-Y333 HydrophobicContact CB-CE2 4.35Å; R330-Y333 HydrophobicContact CB-CG 4.1Å; R330-Y333 VanDerWaalsContact CD-CE2 3.44Å; R330-Y333 HydrophobicContact CG-CD2 4.21Å; R330-Y333 PolarHBondContact O-N 3.41Å; R330-R334 PolarHBondContact O-N 3.24Å | ||
| 331 | R | 61.6 | Low | 69.2 | Low | 157 Ų | 157 | 65.5 Ų | 65.5 | 59% | 0.592 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -53 | -33.8 | 175.3 | -69.5 | -174.1 | 179.2 | -168.7 | -1.1 | 113.3 | I329 R334 K335 | I329-R331 PolarHBondContact O-N 2.7Å; R331-R334 PolarHBondContact O-N 3.46Å; R331-K335 PolarHBondContact O-N 2.97Å |
| 332 | E | 63.1 | Low | 68.9 | Low | 109 Ų | 109 | 68.4 Ų | 68.4 | 51% | 0.509 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -65.1 | -40.8 | 177 | -70.2 | 153.3 | -161.6 | 0 | 0 | 111.5 | R257 R330 K335 A336 | R257-E332 IonicContact CZ-OE1 3.66Å; R257-E332 IonicContact NH2-OE1 2.76Å; R257-E332 PolarHBondContact NH2-OE1 3.43Å; R330-E332 PolarHBondContact O-N 3Å; R330-E332 VanDerWaalsContact O-N 3.13Å; E332-K335 PolarHBondContact O-N 3.39Å; E332-A336 PolarHBondContact O-N 2.95Å; E332-A336 VanDerWaalsContact O-N 3.09Å |
| 333 | Y | 64.1 | Low | 68.5 | Low | 12 Ų | 12 | 75 Ų | 75 | 5% | 0.047 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -72.5 | -41 | 175.9 | -74.8 | -117.2 | 0 | 0 | 0 | 111.1 | L73 L74 R330 K335 A336 L337 | L73-Y333 HydrophobicContact CB-CE1 4.26Å; L73-Y333 HydrophobicContact CD1-CD1 3.81Å; L73-Y333 HydrophobicContact CD1-CE1 4.3Å; L74-Y333 WeakPolarHBondContact CD2-OH 3.35Å; L74-Y333 WeakPolarHBondContact CG-OH 3.29Å; R330-Y333 HydrophobicContact CB-CD2 3.57Å; R330-Y333 HydrophobicContact CB-CE2 4.35Å; R330-Y333 HydrophobicContact CB-CG 4.1Å; R330-Y333 VanDerWaalsContact CD-CE2 3.44Å; R330-Y333 HydrophobicContact CG-CD2 4.21Å; R330-Y333 PolarHBondContact O-N 3.41Å; Y333-K335 VanDerWaalsContact C-N 3.27Å; Y333-K335 PolarHBondContact O-N 3.41Å; Y333-A336 PolarHBondContact O-N 2.97Å; Y333-L337 VanDerWaalsContact O-CB 3.27Å; Y333-L337 WeakPolarHBondContact O-CB 3.32Å; Y333-L337 PolarHBondContact O-N 3.37Å |
| 334 | R | 68.2 | Low | 68.2 | Low | 105 Ų | 105 | 77.5 Ų | 77.5 | 40% | 0.396 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -57.7 | -37.5 | 172.6 | -72.3 | -163.8 | -89.9 | 162.1 | -8.4 | 113.1 | C327 L328 R330 R331 R338 | C327-R334 WeakPolarHBondContact O-CG 3.28Å; L328-R334 VanDerWaalsContact O-CD 3.32Å; L328-R334 WeakPolarHBondContact O-CD 3.37Å; L328-R334 PolarHBondContact O-NE 3.05Å; R330-R334 PolarHBondContact O-N 3.24Å; R331-R334 PolarHBondContact O-N 3.46Å; R334-R338 WeakPolarHBondContact O-CB 3.31Å; R334-R338 VanDerWaalsContact O-CG 3.31Å; R334-R338 WeakPolarHBondContact O-CG 3.2Å; R334-R338 PolarHBondContact O-N 2.9Å; R334-R338 VanDerWaalsContact O-N 3.11Å |
| 335 | K | 65.9 | Low | 68 | Low | 162 Ų | 162 | 76.8 Ų | 76.8 | 70% | 0.704 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -66.8 | -51.8 | 173.5 | -77.6 | -170.8 | 173.9 | -167.4 | 0 | 111.2 | R331 E332 Y333 L337 R338 T339 | R331-K335 PolarHBondContact O-N 2.97Å; E332-K335 PolarHBondContact O-N 3.39Å; Y333-K335 VanDerWaalsContact C-N 3.27Å; Y333-K335 PolarHBondContact O-N 3.41Å; K335-L337 PolarHBondContact O-N 3.48Å; K335-R338 PolarHBondContact O-N 3.08Å; K335-T339 PolarHBondContact O-N 3.38Å; K335-T339 PolarHBondContact O-OG1 2.82Å |
| 336 | A | 65.9 | Low | 67.8 | Low | 25 Ų | 25 | 82 Ų | 82 | 21% | 0.207 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -60.3 | -43.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L73 E332 Y333 T339 L340 | L73-A336 HydrophobicContact CD2-CB 3.67Å; E332-A336 PolarHBondContact O-N 2.95Å; E332-A336 VanDerWaalsContact O-N 3.09Å; Y333-A336 PolarHBondContact O-N 2.97Å; A336-T339 PolarHBondContact O-N 3.08Å; A336-L340 WeakPolarHBondContact O-CG 3.49Å; A336-L340 PolarHBondContact O-N 3.02Å |
| 337 | L | 68.4 | Low | 67.5 | Low | 59 Ų | 59 | 83.8 Ų | 83.8 | 31% | 0.309 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.5 | -45.9 | 175.7 | -177.9 | 61 | 0 | 0 | 0 | 111.7 | L69 Y333 K335 T339 L340 V341 | L69-L337 HydrophobicContact CD2-CD1 4.16Å; Y333-L337 VanDerWaalsContact O-CB 3.27Å; Y333-L337 WeakPolarHBondContact O-CB 3.32Å; Y333-L337 PolarHBondContact O-N 3.37Å; K335-L337 PolarHBondContact O-N 3.48Å; L337-T339 VanDerWaalsContact C-N 3.32Å; L337-T339 PolarHBondContact O-N 3.39Å; L337-L340 PolarHBondContact O-N 3.27Å; L337-V341 HydrophobicContact CD1-CG2 4.18Å; L337-V341 HydrophobicContact CG-CG2 4.44Å; L337-V341 WeakPolarHBondContact O-CB 3.4Å; L337-V341 WeakPolarHBondContact O-CG2 3.17Å; L337-V341 PolarHBondContact O-N 2.92Å |
| 338 | R | 70.1 | Confident | 67.7 | Low | 186 Ų | 186 | 88.5 Ų | 88.5 | 70% | 0.702 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -59 | -42.4 | 173.6 | -79 | 178.4 | 174.8 | -166.9 | -3.4 | 111.8 | R334 K335 V341 L342 | R334-R338 WeakPolarHBondContact O-CB 3.31Å; R334-R338 VanDerWaalsContact O-CG 3.31Å; R334-R338 WeakPolarHBondContact O-CG 3.2Å; R334-R338 PolarHBondContact O-N 2.9Å; R334-R338 VanDerWaalsContact O-N 3.11Å; K335-R338 PolarHBondContact O-N 3.08Å; R338-V341 PolarHBondContact O-N 3.35Å; R338-L342 VanDerWaalsContact O-CB 3.29Å; R338-L342 WeakPolarHBondContact O-CB 3.4Å; R338-L342 WeakPolarHBondContact O-CD1 3.45Å; R338-L342 VanDerWaalsContact O-CG 3.22Å; R338-L342 WeakPolarHBondContact O-CG 3.36Å; R338-L342 PolarHBondContact O-N 2.95Å |
| 339 | T | 71.6 | Confident | 68 | Low | 75 Ų | 75 | 85.6 Ų | 85.6 | 46% | 0.46 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -66.1 | -35.1 | 176.5 | -57.7 | 0 | 0 | 0 | 0 | 112.6 | K335 A336 L337 K343 | K335-T339 PolarHBondContact O-N 3.38Å; K335-T339 PolarHBondContact O-OG1 2.82Å; A336-T339 PolarHBondContact O-N 3.08Å; L337-T339 VanDerWaalsContact C-N 3.32Å; L337-T339 PolarHBondContact O-N 3.39Å; T339-K343 HydrophobicContact CG2-CD 4.47Å; T339-K343 WeakPolarHBondContact O-CB 3.43Å; T339-K343 VanDerWaalsContact O-CG 3.3Å; T339-K343 WeakPolarHBondContact O-CG 3.28Å; T339-K343 PolarHBondContact O-N 2.97Å; T339-K343 VanDerWaalsContact O-N 3.07Å |
| 340 | L | 70.5 | Confident | 68.2 | Low | 55 Ų | 55 | 87.4 Ų | 87.4 | 29% | 0.288 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -68.8 | -47.1 | 173.8 | -71.9 | 171.8 | 0 | 0 | 0 | 111.7 | L69 Y72 L73 A336 L337 L342 K343 S344 | L69-L340 HydrophobicContact CD1-CD1 4.22Å; Y72-L340 HydrophobicContact CE1-CD1 4.17Å; Y72-L340 HydrophobicContact CE1-CD2 4.24Å; L73-L340 HydrophobicContact CD2-CD1 3.78Å; A336-L340 WeakPolarHBondContact O-CG 3.49Å; A336-L340 PolarHBondContact O-N 3.02Å; L337-L340 PolarHBondContact O-N 3.27Å; L340-L342 PolarHBondContact O-N 2.99Å; L340-K343 PolarHBondContact O-N 3.48Å; L340-K343 VanDerWaalsContact O-N 3.16Å; L340-S344 PolarHBondContact O-N 3.25Å; L340-S344 PolarHBondContact O-OG 3.44Å |
| 341 | V | 76 | Confident | 68.4 | Low | 82 Ų | 82 | 93.1 Ų | 93.1 | 50% | 0.497 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.4 | -40.3 | 178.3 | 172.1 | 0 | 0 | 0 | 0 | 111.8 | L337 R338 K343 S344 S345 | L337-V341 HydrophobicContact CD1-CG2 4.18Å; L337-V341 HydrophobicContact CG-CG2 4.44Å; L337-V341 WeakPolarHBondContact O-CB 3.4Å; L337-V341 WeakPolarHBondContact O-CG2 3.17Å; L337-V341 PolarHBondContact O-N 2.92Å; R338-V341 PolarHBondContact O-N 3.35Å; V341-K343 VanDerWaalsContact C-N 3.34Å; V341-S344 WeakPolarHBondContact CA-OG 3.44Å; V341-S344 PolarHBondContact O-N 2.94Å; V341-S344 PolarHBondContact O-OG 3.23Å; V341-S344 VanDerWaalsContact O-OG 3.06Å; V341-S345 WeakPolarHBondContact O-CB 3.42Å; V341-S345 PolarHBondContact O-N 3.24Å; V341-S345 PolarHBondContact O-OG 3.43Å |
| 342 | L | 72.9 | Confident | 68.7 | Low | 108 Ų | 108 | 88.1 Ų | 88.1 | 57% | 0.565 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -66.5 | -34.9 | 174 | -74 | 166.4 | 0 | 0 | 0 | 112.3 | R338 L340 S345 L346 | R338-L342 VanDerWaalsContact O-CB 3.29Å; R338-L342 WeakPolarHBondContact O-CB 3.4Å; R338-L342 WeakPolarHBondContact O-CD1 3.45Å; R338-L342 VanDerWaalsContact O-CG 3.22Å; R338-L342 WeakPolarHBondContact O-CG 3.36Å; R338-L342 PolarHBondContact O-N 2.95Å; L340-L342 PolarHBondContact O-N 2.99Å; L342-S345 PolarHBondContact O-OG 2.82Å; L342-L346 WeakPolarHBondContact O-CB 3.38Å; L342-L346 PolarHBondContact O-N 3.34Å; L342-L346 VanDerWaalsContact O-N 3.1Å |
| 343 | K | 70.6 | Confident | 68.8 | Low | 143 Ų | 143 | 87 Ų | 87 | 62% | 0.622 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -72.8 | -37.4 | 174.7 | -79.8 | -176.2 | 174.2 | -166.7 | 0 | 112.4 | T339 L340 V341 A347 | T339-K343 HydrophobicContact CG2-CD 4.47Å; T339-K343 WeakPolarHBondContact O-CB 3.43Å; T339-K343 VanDerWaalsContact O-CG 3.3Å; T339-K343 WeakPolarHBondContact O-CG 3.28Å; T339-K343 PolarHBondContact O-N 2.97Å; T339-K343 VanDerWaalsContact O-N 3.07Å; L340-K343 PolarHBondContact O-N 3.48Å; L340-K343 VanDerWaalsContact O-N 3.16Å; V341-K343 VanDerWaalsContact C-N 3.34Å; K343-A347 VanDerWaalsContact O-CB 3.29Å; K343-A347 WeakPolarHBondContact O-CB 3.29Å; K343-A347 PolarHBondContact O-N 3.44Å |
| 344 | S | 69.3 | Low | 68.7 | Low | 57 Ų | 57 | 91.2 Ų | 91.2 | 40% | 0.399 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -71.7 | -38.9 | 176.1 | 60.5 | 0 | 0 | 0 | 0 | 111.7 | L340 V341 A347 I348 | L340-S344 PolarHBondContact O-N 3.25Å; L340-S344 PolarHBondContact O-OG 3.44Å; V341-S344 WeakPolarHBondContact CA-OG 3.44Å; V341-S344 PolarHBondContact O-N 2.94Å; V341-S344 PolarHBondContact O-OG 3.23Å; V341-S344 VanDerWaalsContact O-OG 3.06Å; S344-A347 PolarHBondContact O-N 3.36Å; S344-I348 WeakPolarHBondContact O-CB 3.31Å; S344-I348 WeakPolarHBondContact O-CD1 3.46Å; S344-I348 WeakPolarHBondContact O-CG1 3.45Å; S344-I348 PolarHBondContact O-N 2.96Å |
| 345 | S | 70.4 | Confident | 68.4 | Low | 59 Ų | 59 | 89.5 Ų | 89.5 | 41% | 0.413 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.9 | -41.3 | 173.8 | 66 | 0 | 0 | 0 | 0 | 112.1 | V341 L342 I348 A349 | V341-S345 WeakPolarHBondContact O-CB 3.42Å; V341-S345 PolarHBondContact O-N 3.24Å; V341-S345 PolarHBondContact O-OG 3.43Å; L342-S345 PolarHBondContact O-OG 2.82Å; S345-I348 PolarHBondContact O-N 3.45Å; S345-A349 VanDerWaalsContact O-CB 3.28Å; S345-A349 WeakPolarHBondContact O-CB 3.22Å; S345-A349 PolarHBondContact O-N 3.22Å |
| 346 | L | 67.3 | Low | 68.3 | Low | 121 Ų | 121 | 84.3 Ų | 84.3 | 63% | 0.634 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.1 | -40.7 | 171.2 | -91.4 | 159.5 | 0 | 0 | 0 | 112.8 | L342 S350 | L342-L346 WeakPolarHBondContact O-CB 3.38Å; L342-L346 PolarHBondContact O-N 3.34Å; L342-L346 VanDerWaalsContact O-N 3.1Å; L346-S350 WeakPolarHBondContact O-CB 3.39Å; L346-S350 PolarHBondContact O-N 3.15Å |
| 347 | A | 65.6 | Low | 68.1 | Low | 51 Ų | 51 | 87.1 Ų | 87.1 | 42% | 0.421 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -69.4 | -36 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K343 S344 K351 | K343-A347 VanDerWaalsContact O-CB 3.29Å; K343-A347 WeakPolarHBondContact O-CB 3.29Å; K343-A347 PolarHBondContact O-N 3.44Å; S344-A347 PolarHBondContact O-N 3.36Å; A347-K351 WeakPolarHBondContact O-CB 3.39Å; A347-K351 WeakPolarHBondContact O-CG 3.47Å; A347-K351 PolarHBondContact O-N 3.39Å |
| 348 | I | 69.9 | Low | 67.6 | Low | 118 Ų | 118 | 89.2 Ų | 89.2 | 61% | 0.605 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -69.5 | -46.6 | 174.8 | -69.4 | 162.8 | 0 | 0 | 0 | 110 | S344 S345 S350 K351 A352 | S344-I348 WeakPolarHBondContact O-CB 3.31Å; S344-I348 WeakPolarHBondContact O-CD1 3.46Å; S344-I348 WeakPolarHBondContact O-CG1 3.45Å; S344-I348 PolarHBondContact O-N 2.96Å; S345-I348 PolarHBondContact O-N 3.45Å; I348-S350 PolarHBondContact O-N 2.92Å; I348-K351 PolarHBondContact O-N 3.23Å; I348-A352 WeakPolarHBondContact O-CB 3.35Å; I348-A352 PolarHBondContact O-N 2.84Å |
| 349 | A | 68.6 | Low | 67 | Low | 50 Ų | 50 | 84.2 Ų | 84.2 | 41% | 0.413 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.1 | -43.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S345 K351 A352 C353 | S345-A349 VanDerWaalsContact O-CB 3.28Å; S345-A349 WeakPolarHBondContact O-CB 3.22Å; S345-A349 PolarHBondContact O-N 3.22Å; A349-K351 PolarHBondContact O-N 2.91Å; A349-A352 PolarHBondContact O-N 2.72Å; A349-C353 PolarHBondContact O-N 3.44Å; A349-C353 PolarHBondContact O-SG 3.44Å; A349-C353 VanDerWaalsContact O-SG 3.39Å |
| 350 | S | 68.2 | Low | 66.1 | Low | 65 Ų | 65 | 86.2 Ų | 86.2 | 46% | 0.455 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -60.4 | -43.1 | 175 | 174 | 0 | 0 | 0 | 0 | 112.2 | L346 I348 L354 | L346-S350 WeakPolarHBondContact O-CB 3.39Å; L346-S350 PolarHBondContact O-N 3.15Å; I348-S350 PolarHBondContact O-N 2.92Å; S350-L354 WeakPolarHBondContact O-CB 3.25Å; S350-L354 WeakPolarHBondContact O-CG 3.32Å; S350-L354 PolarHBondContact O-N 3.47Å |
| 351 | K | 69.1 | Low | 65.2 | Low | 156 Ų | 156 | 89.7 Ų | 89.7 | 68% | 0.678 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65.7 | -39.8 | 174.2 | -77.4 | -176.9 | 175.3 | -168 | 0 | 112.7 | A347 I348 A349 L354 S355 | A347-K351 WeakPolarHBondContact O-CB 3.39Å; A347-K351 WeakPolarHBondContact O-CG 3.47Å; A347-K351 PolarHBondContact O-N 3.39Å; I348-K351 PolarHBondContact O-N 3.23Å; A349-K351 PolarHBondContact O-N 2.91Å; K351-L354 PolarHBondContact O-N 3.38Å; K351-S355 PolarHBondContact O-N 3.28Å; K351-S355 PolarHBondContact O-OG 3.1Å |
| 352 | A | 68 | Low | 63.8 | Low | 53 Ų | 53 | 88.9 Ų | 88.9 | 44% | 0.438 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | I348 A349 S355 A356 | I348-A352 WeakPolarHBondContact O-CB 3.35Å; I348-A352 PolarHBondContact O-N 2.84Å; A349-A352 PolarHBondContact O-N 2.72Å; A352-S355 WeakPolarHBondContact CA-OG 3.48Å; A352-S355 PolarHBondContact O-N 3.1Å; A352-S355 PolarHBondContact O-OG 3.22Å; A352-A356 WeakPolarHBondContact O-CB 3.27Å; A352-A356 PolarHBondContact O-N 3.46Å |
| 353 | C | 63.5 | Low | 62.4 | Low | 84 Ų | 84 | 91.9 Ų | 91.9 | 57% | 0.568 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -62.5 | -43.1 | 172.1 | -69.3 | 0 | 0 | 0 | 0 | 112 | A349 A356 V357 | A349-C353 PolarHBondContact O-N 3.44Å; A349-C353 PolarHBondContact O-SG 3.44Å; A349-C353 VanDerWaalsContact O-SG 3.39Å; C353-A356 PolarHBondContact O-N 2.94Å; C353-V357 WeakPolarHBondContact O-CG2 3.37Å; C353-V357 PolarHBondContact O-N 2.98Å |
| 354 | L | 62.8 | Low | 61.1 | Low | 102 Ų | 102 | 92 Ų | 92 | 53% | 0.534 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.9 | -41.8 | 175.7 | -81.5 | 161.3 | 0 | 0 | 0 | 112.3 | S350 K351 N358 | S350-L354 WeakPolarHBondContact O-CB 3.25Å; S350-L354 WeakPolarHBondContact O-CG 3.32Å; S350-L354 PolarHBondContact O-N 3.47Å; K351-L354 PolarHBondContact O-N 3.38Å; L354-N358 WeakPolarHBondContact O-CB 3.35Å; L354-N358 VanDerWaalsContact O-CG 3.26Å; L354-N358 PolarHBondContact O-N 2.88Å; L354-N358 PolarHBondContact O-OD1 3.27Å |
| 355 | S | 62.3 | Low | 59.8 | Low | 69 Ų | 69 | 99.3 Ų | 99.3 | 48% | 0.483 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.2 | -38 | 173.3 | 48.3 | 0 | 0 | 0 | 0 | 112.7 | K351 A352 N358 S359 | K351-S355 PolarHBondContact O-N 3.28Å; K351-S355 PolarHBondContact O-OG 3.1Å; A352-S355 WeakPolarHBondContact CA-OG 3.48Å; A352-S355 PolarHBondContact O-N 3.1Å; A352-S355 PolarHBondContact O-OG 3.22Å; S355-N358 PolarHBondContact O-N 3.34Å; S355-S359 PolarHBondContact O-N 3.1Å; S355-S359 PolarHBondContact O-OG 3.16Å; S355-S359 VanDerWaalsContact O-OG 3.13Å |
| 356 | A | 63.4 | Low | 58.4 | Low | 53 Ų | 53 | 104.5 Ų | 104.5 | 44% | 0.438 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -67.4 | -39.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | A352 C353 N360 | A352-A356 WeakPolarHBondContact O-CB 3.27Å; A352-A356 PolarHBondContact O-N 3.46Å; C353-A356 PolarHBondContact O-N 2.94Å; A356-N360 PolarHBondContact O-N 3.44Å |
| 357 | V | 62 | Low | 57.2 | Low | 84 Ų | 84 | 101.7 Ų | 101.7 | 51% | 0.509 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -64.3 | -47.4 | 174.2 | 170.7 | 0 | 0 | 0 | 0 | 110.8 | C353 S359 N360 E361 | C353-V357 WeakPolarHBondContact O-CG2 3.37Å; C353-V357 PolarHBondContact O-N 2.98Å; V357-S359 VanDerWaalsContact C-N 3.32Å; V357-S359 PolarHBondContact O-N 2.94Å; V357-N360 PolarHBondContact O-N 3.22Å; V357-N360 VanDerWaalsContact O-N 3.11Å; V357-E361 PolarHBondContact O-N 3.07Å |
| 358 | N | 58.3 | Low | 55.8 | Low | 103 Ų | 103 | 108.8 Ų | 108.8 | 55% | 0.551 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -63.8 | -35.8 | -179.9 | -70.2 | 16.4 | 0 | 0 | 0 | 112.6 | L354 S355 N360 G362 | L354-N358 WeakPolarHBondContact O-CB 3.35Å; L354-N358 VanDerWaalsContact O-CG 3.26Å; L354-N358 PolarHBondContact O-N 2.88Å; L354-N358 PolarHBondContact O-OD1 3.27Å; S355-N358 PolarHBondContact O-N 3.34Å; N358-N360 VanDerWaalsContact C-N 3.34Å; N358-G362 PolarHBondContact O-N 3.31Å |
| 359 | S | 56.2 | Low | 54.1 | Low | 81 Ų | 81 | 111.3 Ų | 111.3 | 57% | 0.566 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -63.6 | -39.1 | 173 | -67 | 0 | 0 | 0 | 0 | 112.3 | S355 V357 G362 Q363 | S355-S359 PolarHBondContact O-N 3.1Å; S355-S359 PolarHBondContact O-OG 3.16Å; S355-S359 VanDerWaalsContact O-OG 3.13Å; V357-S359 VanDerWaalsContact C-N 3.32Å; V357-S359 PolarHBondContact O-N 2.94Å; S359-G362 PolarHBondContact O-N 3.45Å; S359-Q363 PolarHBondContact O-N 2.63Å |
| 360 | N | 53.7 | Low | 52.4 | Low | 116 Ų | 116 | 112.4 Ų | 112.4 | 62% | 0.62 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -70.3 | -37.1 | 179 | -73.9 | 4.3 | 0 | 0 | 0 | 112.5 | A356 V357 N358 G362 Q363 N364 | A356-N360 PolarHBondContact O-N 3.44Å; V357-N360 PolarHBondContact O-N 3.22Å; V357-N360 VanDerWaalsContact O-N 3.11Å; N358-N360 VanDerWaalsContact C-N 3.34Å; N360-G362 VanDerWaalsContact C-N 3.3Å; N360-G362 PolarHBondContact O-N 2.87Å; N360-Q363 PolarHBondContact O-N 2.92Å; N360-N364 WeakPolarHBondContact O-CB 3.48Å; N360-N364 PolarHBondContact O-N 3.46Å |
| 361 | E | 50.5 | Low | 50.9 | Low | 129 Ų | 129 | 117.2 Ų | 117.2 | 60% | 0.603 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -64.5 | -34.5 | 171.9 | -79.6 | -159.6 | 97.7 | 0 | 0 | 112.6 | V357 Q363 | V357-E361 PolarHBondContact O-N 3.07Å; E361-Q363 VanDerWaalsContact C-N 3.27Å; E361-Q363 PolarHBondContact O-N 3.23Å |
| 362 | G | 47.2 | Very low | 49.7 | Very low | 65 Ų | 65 | 115.2 Ų | 115.2 | 67% | 0.67 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -65.9 | -25.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | N358 S359 N360 | N358-G362 PolarHBondContact O-N 3.31Å; S359-G362 PolarHBondContact O-N 3.45Å; N360-G362 VanDerWaalsContact C-N 3.3Å; N360-G362 PolarHBondContact O-N 2.87Å |
| 363 | Q | 44.5 | Very low | 48.3 | Very low | 170 Ų | 170 | 120.2 Ų | 120.2 | 79% | 0.794 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -100.1 | -8.6 | -175.9 | -163.1 | 162.3 | 6 | 0 | 0 | 113.8 | S359 N360 E361 | S359-Q363 PolarHBondContact O-N 2.63Å; N360-Q363 PolarHBondContact O-N 2.92Å; E361-Q363 VanDerWaalsContact C-N 3.27Å; E361-Q363 PolarHBondContact O-N 3.23Å |
| 364 | N | 42.5 | Very low | 46.8 | Very low | 145 Ų | 145 | 123.9 Ų | 123.9 | 78% | 0.775 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -105.6 | 24.4 | -171.7 | -144.3 | 49.3 | 0 | 0 | 0 | 113.9 | N360 | N360-N364 WeakPolarHBondContact O-CB 3.48Å; N360-N364 PolarHBondContact O-N 3.46Å |
| 365 | R | 42.2 | Very low | 45.4 | Very low | 211 Ų | 211 | 125.4 Ų | 125.4 | 80% | 0.796 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -104.3 | -19.4 | 178.2 | -78 | -169.1 | 171.4 | -156.3 | -2.9 | 115.3 | ||
| 366 | D | 41.2 | Very low | 43.9 | Very low | 169 Ų | 169 | 130.1 Ų | 130.1 | 90% | 0.904 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -108.5 | 64.3 | -178.2 | -67.5 | -42.6 | 0 | 0 | 0 | 111.9 | ||
| 367 | G | 40.9 | Very low | 42.4 | Very low | 62 Ų | 62 | 136 Ų | 136 | 64% | 0.639 | 75% | 0.747 | S | S | * | * | S | Bend | trans | 174.4 | 120.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 368 | Q | 37.2 | Very low | 40.8 | Very low | 199 Ų | 199 | 137 Ų | 137 | 93% | 0.93 | 76% | 0.758 | S | S | * | * | trans | 60 | 112.7 | 166 | -64.3 | 172.9 | -32.7 | 0 | 0 | 116.5 | ||||
| 369 | L | 34.3 | Very low | 39.4 | Very low | 171 Ų | 171 | 140.4 Ų | 140.4 | 90% | 0.895 | 77% | 0.77 | S | S | * | * | cis | 87.8 | 72.9 | 34.2 | -160.9 | 84 | 0 | 0 | 0 | 115.8 | ||||
| 370 | G | 32 | Very low | 38.2 | Very low | 74 Ų | 74 | 142.9 Ų | 142.9 | 76% | 0.763 | 78% | 0.782 | S | S | * | * | trans | 77.6 | 163.7 | 156.2 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 371 | I | 37.5 | Very low | 36.9 | Very low | 166 Ų | 166 | 141.2 Ų | 141.2 | 85% | 0.851 | 79% | 0.785 | S | S | * | * | cis | -136.8 | -158.1 | -10 | -35.4 | 175.1 | 0 | 0 | 0 | 108.3 | ||||
| 372 | P | 43.7 | Very low | 35.9 | Very low | 114 Ų | 114 | 144 Ų | 144 | 74% | 0.74 | 80% | 0.798 | S | S | * | * | -95.8 | 175.5 | -122.2 | 41.9 | -32 | 0 | 0 | 0 | 116.6 | |||||
| 373 | L | 37.8 | Very low | 35 | Very low | 158 Ų | 158 | 145.3 Ų | 145.3 | 83% | 0.827 | 80% | 0.796 | S | S | * | * | trans | -59.3 | 156 | 162.3 | -68.7 | 82.3 | 0 | 0 | 0 | 111.5 | ||||
| 374 | N | 32 | Very low | 34.3 | Very low | 161 Ų | 161 | 147.2 Ų | 147.2 | 86% | 0.861 | 80% | 0.798 | S | S | * | * | trans | -141.4 | 143.4 | 153.7 | -152.2 | 3.6 | 0 | 0 | 0 | 110.8 | ||||
| 375 | N | 33.6 | Very low | 33.7 | Very low | 133 Ų | 133 | 145.8 Ų | 145.8 | 71% | 0.711 | 80% | 0.795 | S | S | * | * | trans | -83.2 | 137.8 | -176.7 | -80.3 | -9.4 | 0 | 0 | 0 | 111.7 | ||||
| 376 | I | 31.9 | Very low | 33.2 | Very low | 168 Ų | 168 | 145.3 Ų | 145.3 | 86% | 0.862 | 80% | 0.798 | S | S | * | * | trans | -135.6 | 122.4 | 146.1 | -64.1 | -174.5 | 0 | 0 | 0 | 107.8 | ||||
| 377 | E | 31.1 | Very low | 32.6 | Very low | 177 Ų | 177 | 148.5 Ų | 148.5 | 83% | 0.827 | 80% | 0.798 | S | S | * | * | trans | -87.2 | 140.4 | 170.4 | -64.1 | 175.2 | 97.9 | 0 | 0 | 110.5 | ||||
| 378 | S | 28.8 | Very low | 32 | Very low | 104 Ų | 104 | 150.5 Ų | 150.5 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | 176 | 143 | 124.4 | 38.6 | 0 | 0 | 0 | 0 | 112.5 | |||||
| 379 | H | 29.8 | Very low | 31.7 | Very low | 176 Ų | 176 | 146.1 Ų | 146.1 | 82% | 0.815 | 80% | 0.799 | S | S | * | * | trans | 11.4 | 138.7 | 161 | -47 | -62.9 | 0 | 0 | 0 | 119.9 | ||||
| 380 | T | 29.9 | Very low | 31.4 | Very low | 133 Ų | 133 | 145.9 Ų | 145.9 | 82% | 0.816 | 80% | 0.798 | S | S | * | * | -161.1 | 167.5 | 54.1 | -51.8 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 381 | A | 27.1 | Very low | 32.4 | Very low | 81 Ų | 81 | 147.3 Ų | 147.3 | 67% | 0.669 | 79% | 0.794 | S | S | * | * | trans | -32.1 | 155.1 | 171.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 382 | Q | 28.7 | Very low | 31.9 | Very low | 188 Ų | 188 | 145.2 Ų | 145.2 | 88% | 0.879 | 79% | 0.794 | S | S | * | * | cis | -161.1 | 178.2 | 10.4 | -131.6 | -171.4 | 94.4 | 0 | 0 | 108.4 | ||||
| 383 | S | 29.2 | Very low | 31.2 | Very low | 92 Ų | 92 | 145.9 Ų | 145.9 | 64% | 0.643 | 80% | 0.796 | S | S | * | * | cis | -147.1 | -149.8 | 3 | 68.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 384 | Y | 29.4 | Very low | 30.8 | Very low | 209 Ų | 209 | 144.1 Ų | 144.1 | 82% | 0.82 | 79% | 0.792 | S | S | * | * | trans | -139.3 | 137.8 | -166.2 | -115.8 | -107 | 0 | 0 | 0 | 116.7 | ||||
| 385 | T | 30.5 | Very low | 30.6 | Very low | 116 Ų | 116 | 144 Ų | 144 | 71% | 0.712 | 79% | 0.791 | S | S | * | * | trans | 49.5 | 125.3 | 148.5 | 49.4 | 0 | 0 | 0 | 0 | 125.3 | ||||
| 386 | K | 31.4 | Very low | 30.4 | Very low | 200 Ų | 200 | 142.4 Ų | 142.4 | 87% | 0.87 | 79% | 0.79 | S | S | * | * | trans | -12.1 | 135.1 | 135.5 | -64.6 | 170.6 | 173.9 | 172.6 | 0 | 118.9 | ||||
| 387 | R | 27.8 | Very low | 30.2 | Very low | 237 Ų | 237 | 142.6 Ų | 142.6 | 89% | 0.894 | 79% | 0.792 | S | S | * | * | -154.2 | 141.4 | 126.5 | -84.6 | -174.7 | 179 | 170.8 | -0.5 | 106.9 | |||||
| 388 | S | 28.9 | Very low | 29.8 | Very low | 104 Ų | 104 | 137.2 Ų | 137.2 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | cis | 87.3 | 126.8 | 21.4 | 81.8 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 389 | A | 29.8 | Very low | 30.5 | Very low | 106 Ų | 106 | 138.9 Ų | 138.9 | 88% | 0.876 | 79% | 0.792 | S | S | * | * | trans | 105.9 | 154.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 390 | L | 27.8 | Very low | 30.4 | Very low | 166 Ų | 166 | 135.8 Ų | 135.8 | 87% | 0.869 | 79% | 0.79 | S | S | * | * | trans | -145.1 | -168 | -170.5 | -158.3 | 78.8 | 0 | 0 | 0 | 108.6 | ||||
| 391 | P | 54.6 | Low | 31.4 | Very low | 104 Ų | 104 | 134.3 Ų | 134.3 | 68% | 0.675 | 78% | 0.783 | S | S | * | * | -97.4 | -178.6 | -109.7 | 41.4 | -26.7 | 0 | 0 | 0 | 115.2 | |||||
| 392 | S | 25.7 | Very low | 31.5 | Very low | 122 Ų | 122 | 140.4 Ų | 140.4 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | trans | -170.8 | 169 | 134.6 | -85.7 | 0 | 0 | 0 | 0 | 114 | ||||
| 393 | T | 28.7 | Very low | 31.4 | Very low | 129 Ų | 129 | 134.8 Ų | 134.8 | 79% | 0.791 | 79% | 0.786 | S | S | * | * | trans | -113.7 | 163.7 | -171.6 | -31.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 394 | T | 31.1 | Very low | 31.4 | Very low | 120 Ų | 120 | 138.3 Ų | 138.3 | 74% | 0.736 | 80% | 0.797 | S | S | * | * | 161.5 | 135.7 | 122.3 | 45.6 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 395 | L | 27.8 | Very low | 31.4 | Very low | 160 Ų | 160 | 133.8 Ų | 133.8 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | trans | 49.1 | 152.5 | 142.1 | -78.8 | 79.4 | 0 | 0 | 0 | 121.4 | ||||
| 396 | S | 27.6 | Very low | 32.4 | Very low | 98 Ų | 98 | 133.5 Ų | 133.5 | 69% | 0.685 | 80% | 0.795 | S | S | * | * | cis | -164.5 | -164.1 | -3.4 | 50.7 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 397 | L | 28 | Very low | 32.4 | Very low | 173 Ų | 173 | 130.8 Ų | 130.8 | 91% | 0.906 | 79% | 0.789 | S | S | * | * | cis | -151.2 | -98.8 | 9 | -168.2 | 67.6 | 0 | 0 | 0 | 114.5 | ||||
| 398 | G | 23.9 | Very low | 32.5 | Very low | 63 Ų | 63 | 126.6 Ų | 126.6 | 65% | 0.649 | 79% | 0.785 | S | S | * | * | trans | 175.3 | -171.1 | -174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 399 | P | 43.5 | Very low | 32.8 | Very low | 140 Ų | 140 | 128.1 Ų | 128.1 | 91% | 0.909 | 79% | 0.785 | S | S | * | * | cis | -134.9 | -156.4 | 11.2 | 43.6 | -23.5 | 0 | 0 | 0 | 116.4 | ||||
| 400 | S | 27.3 | Very low | 33.1 | Very low | 110 Ų | 110 | 130.7 Ų | 130.7 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | -92.6 | -165.8 | -170.5 | -143.5 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 401 | P | 51.2 | Low | 33.9 | Very low | 102 Ų | 102 | 132.6 Ų | 132.6 | 66% | 0.662 | 80% | 0.802 | S | S | * | * | cis | -142.2 | -179.9 | -7.7 | 41.7 | -22.2 | 0 | 0 | 0 | 118 | ||||
| 402 | K | 28.8 | Very low | 32.8 | Very low | 209 Ų | 209 | 134.1 Ų | 134.1 | 91% | 0.909 | 81% | 0.808 | S | S | * | * | trans | 156.5 | 150.6 | 135.9 | -87.2 | 168.5 | -178 | -179.7 | 0 | 117 | ||||
| 403 | G | 27.6 | Very low | 33.2 | Very low | 70 Ų | 70 | 134.7 Ų | 134.7 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | trans | 104.4 | 103.2 | 162 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 404 | L | 27.9 | Very low | 33.5 | Very low | 167 Ų | 167 | 135 Ų | 135 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | 53.8 | 110.1 | 82.1 | -92.8 | 65.2 | 0 | 0 | 0 | 114.7 | |||||
| 405 | C | 29.8 | Very low | 33.6 | Very low | 114 Ų | 114 | 135.9 Ų | 135.9 | 77% | 0.77 | 81% | 0.811 | S | S | * | * | 97.7 | 156.8 | 62.7 | -83.2 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 406 | P | 50.4 | Low | 34 | Very low | 110 Ų | 110 | 134.4 Ų | 134.4 | 71% | 0.714 | 81% | 0.809 | S | S | * | * | cis | -141.9 | -167 | -28.2 | 40.8 | -21.7 | 0 | 0 | 0 | 114.7 | ||||
| 407 | L | 31.8 | Very low | 34.4 | Very low | 142 Ų | 142 | 136.8 Ų | 136.8 | 74% | 0.743 | 82% | 0.817 | S | S | * | * | trans | 70.1 | 124.1 | 154.2 | -107.6 | 70.6 | 0 | 0 | 0 | 121.9 | ||||
| 408 | N | 31.4 | Very low | 34.9 | Very low | 149 Ų | 149 | 134.2 Ų | 134.2 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | -167.1 | 159.1 | 93.2 | -112.1 | 3.1 | 0 | 0 | 0 | 112.9 | |||||
| 409 | D | 34.1 | Very low | 35.7 | Very low | 137 Ų | 137 | 139.7 Ų | 139.7 | 73% | 0.733 | 82% | 0.823 | S | S | * | * | trans | -102.5 | -174.2 | 179.5 | -77 | -65.7 | 0 | 0 | 0 | 113 | ||||
| 410 | L | 37 | Very low | 35 | Very low | 160 Ų | 160 | 139.7 Ų | 139.7 | 84% | 0.838 | 82% | 0.816 | S | S | * | * | trans | 76.3 | 137.1 | -178.2 | -62 | 87.8 | 0 | 0 | 0 | 114.6 | ||||
| 411 | T | 43.3 | Very low | 35.8 | Very low | 206 Ų | 206 | 142.4 Ų | 142.4 | 100% | 1.264 | 82% | 0.821 | S | S | * | * | cis | -140.5 | 0 | 6.8 | -21.3 | 0 | 0 | 0 | 0 | 111.2 |
Retrieved 411 of 411 residues in 466.8 ms
(Link to these results)