| 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 | 37.2 | Very low | 59 | Low | 244 Ų | 244 | 142.4 Ų | 142.4 | 100% | 1.202 | 71% | 0.714 | S | S | * | * | 0 | 68 | 0 | -81.5 | -166.5 | -96.8 | 0 | 0 | 109.2 | |||||
| 2 | E | 34 | Very low | 61.3 | Low | 188 Ų | 188 | 134.8 Ų | 134.8 | 88% | 0.879 | 67% | 0.671 | S | S | * | * | trans | -119.9 | 72.8 | 156 | -84.2 | -175.5 | 125.9 | 0 | 0 | 105.4 | Y4 | E2-Y4 PolarHBondContact O-N 3Š| ||
| 3 | E | 40.3 | Very low | 63.5 | Low | 197 Ų | 197 | 127.2 Ų | 127.2 | 92% | 0.921 | 63% | 0.634 | S | S | * | * | trans | -81.6 | 61.8 | 168.1 | -160.1 | 163.1 | 141 | 0 | 0 | 107 | ||||
| 4 | Y | 43.6 | Very low | 65.6 | Low | 217 Ų | 217 | 123.8 Ų | 123.8 | 85% | 0.851 | 62% | 0.623 | S | S | * | * | trans | -152.5 | 54.4 | -175.3 | -146.9 | -86 | 0 | 0 | 0 | 110.8 | E2 | E2-Y4 PolarHBondContact O-N 3Š| ||
| 5 | A | 48.5 | Very low | 67.5 | Low | 105 Ų | 105 | 122.1 Ų | 122.1 | 87% | 0.868 | 62% | 0.617 | S | S | * | * | S | Bend | trans | -124.8 | 1.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 6 | R | 54.6 | Low | 69 | Low | 109 Ų | 109 | 117.3 Ų | 117.3 | 41% | 0.411 | 59% | 0.593 | S | S | . | * | S | Bend | trans | -135.5 | 120.5 | 175.3 | -145.8 | 175.5 | 177.9 | 95.4 | -11.6 | 108.8 | R12 D77 | R6-R12 VanDerWaalsContact CZ-NH2 3.28Å; R6-R12 VanDerWaalsContact NE-CZ 3.28Å; R6-R12 VanDerWaalsContact NE-NH1 3.12Å; R6-D77 IonicContact NH2-OD2 2.93Å; R6-D77 PolarHBondContact NH2-OD2 2.92Å |
| 7 | E | 62.5 | Low | 70.5 | Confident | 88 Ų | 88 | 112.5 Ų | 112.5 | 41% | 0.411 | 57% | 0.573 | S | S | . | * | P | Polyproline II helix | trans | -59.1 | 135.3 | 174.9 | -59.4 | -164 | 150.6 | 0 | 0 | 109.8 | W11 | E7-W11 VanDerWaalsContact CD-CD1 3.49Š|
| 8 | P | 74.8 | Confident | 71.8 | Confident | 101 Ų | 101 | 108.2 Ų | 108.2 | 66% | 0.656 | 56% | 0.561 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 141.5 | -179.5 | 25 | -32.8 | 0 | 0 | 0 | 110.6 | W11 | P8-W11 PolarHBondContact O-N 3.04Š|
| 9 | C | 81.1 | Confident | 73.1 | Confident | 68 Ų | 68 | 103.8 Ų | 103.8 | 46% | 0.459 | 54% | 0.544 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -60.1 | 126 | 166 | -46.4 | 0 | 0 | 0 | 0 | 107.2 | C78 | C9-C78 HydrophobicContact CB-CB 3.89Å; C9-C78 WeakPolarHBondContact CB-SG 3.45Å; C9-C78 WeakPolarHBondContact SG-CB 3.46Å; C9-C78 CovalentContact SG-SG 2.04Å; C9-C78 PolarHBondContact SG-SG 3.41Å |
| 10 | P | 85.1 | Confident | 74.2 | Confident | 95 Ų | 95 | 99.3 Ų | 99.3 | 62% | 0.617 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -100.7 | -2.1 | 26.5 | 37.8 | -36.7 | 0 | 0 | 0 | 116.3 | R12 I13 V14 | P10-R12 VanDerWaalsContact C-N 3.33Å; P10-R12 PolarHBondContact O-N 3.39Å; P10-I13 WeakPolarHBondContact O-CB 3.17Å; P10-I13 PolarHBondContact O-N 3.45Å; P10-V14 PolarHBondContact O-N 3.24Å |
| 11 | W | 87.9 | Confident | 75.3 | Confident | 154 Ų | 154 | 98.7 Ų | 98.7 | 58% | 0.583 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.3 | -39.4 | -170.7 | -158.2 | -132.4 | 0 | 0 | 0 | 112.3 | E7 P8 I13 V14 D15 | E7-W11 VanDerWaalsContact CD-CD1 3.49Å; P8-W11 PolarHBondContact O-N 3.04Å; W11-I13 VanDerWaalsContact C-N 3.26Å; W11-I13 PolarHBondContact O-N 2.8Å; W11-V14 HydrophobicContact CE3-CB 4.11Å; W11-V14 HydrophobicContact CE3-CG1 4.43Å; W11-V14 HydrophobicContact CE3-CG2 4.25Å; W11-V14 HydrophobicContact CH2-CG1 4.41Å; W11-V14 HydrophobicContact CZ3-CB 4.13Å; W11-V14 HydrophobicContact CZ3-CG1 3.95Å; W11-V14 HydrophobicContact CZ3-CG2 4.32Å; W11-V14 PolarHBondContact O-N 2.81Å; W11-D15 PolarHBondContact O-N 3.28Å |
| 12 | R | 86.5 | Confident | 78.1 | Confident | 51 Ų | 51 | 90.5 Ų | 90.5 | 19% | 0.192 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -52.3 | -39.2 | 170 | -174.3 | -179.3 | 178.6 | 86.5 | 12.3 | 114 | R6 P10 D16 | R6-R12 VanDerWaalsContact CZ-NH2 3.28Å; R6-R12 VanDerWaalsContact NE-CZ 3.28Å; R6-R12 VanDerWaalsContact NE-NH1 3.12Å; P10-R12 VanDerWaalsContact C-N 3.33Å; P10-R12 PolarHBondContact O-N 3.39Å; R12-D16 WeakPolarHBondContact CG-OD2 3.42Å; R12-D16 IonicContact NE-OD2 3.71Å; R12-D16 VanDerWaalsContact O-CB 3.28Å; R12-D16 WeakPolarHBondContact O-CB 3.48Å; R12-D16 VanDerWaalsContact O-CG 3.24Å; R12-D16 PolarHBondContact O-N 3.39Å |
| 13 | I | 90.2 | Very high | 81.1 | Confident | 37 Ų | 37 | 88.2 Ų | 88.2 | 19% | 0.19 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -67.1 | -42.9 | -179.8 | -62.7 | 162.1 | 0 | 0 | 0 | 109.9 | P10 W11 C17 T75 | P10-I13 WeakPolarHBondContact O-CB 3.17Å; P10-I13 PolarHBondContact O-N 3.45Å; W11-I13 VanDerWaalsContact C-N 3.26Å; W11-I13 PolarHBondContact O-N 2.8Å; I13-C17 VanDerWaalsContact O-CB 3.31Å; I13-C17 WeakPolarHBondContact O-CB 3.36Å; I13-C17 PolarHBondContact O-N 2.69Å; I13-C17 PolarHBondContact O-SG 3.36Å; I13-T75 HydrophobicContact CD1-CG2 3.78Å; I13-T75 HydrophobicContact CG1-CG2 4.13Å; I13-T75 HydrophobicContact CG2-CG2 3.77Å |
| 14 | V | 92.6 | Very high | 83.7 | Confident | 79 Ų | 79 | 78.9 Ų | 78.9 | 48% | 0.479 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -66 | -44.1 | 179.2 | 179.8 | 0 | 0 | 0 | 0 | 110.4 | P10 W11 C17 G18 | P10-V14 PolarHBondContact O-N 3.24Å; W11-V14 HydrophobicContact CE3-CB 4.11Å; W11-V14 HydrophobicContact CE3-CG1 4.43Å; W11-V14 HydrophobicContact CE3-CG2 4.25Å; W11-V14 HydrophobicContact CH2-CG1 4.41Å; W11-V14 HydrophobicContact CZ3-CB 4.13Å; W11-V14 HydrophobicContact CZ3-CG1 3.95Å; W11-V14 HydrophobicContact CZ3-CG2 4.32Å; W11-V14 PolarHBondContact O-N 2.81Å; V14-C17 PolarHBondContact O-N 3.38Å; V14-G18 PolarHBondContact O-N 3.05Å |
| 15 | D | 93.1 | Very high | 86.3 | Confident | 99 Ų | 99 | 70.8 Ų | 70.8 | 53% | 0.529 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -62.9 | -47.8 | 177.2 | -168.7 | 58 | 0 | 0 | 0 | 111.5 | W11 C17 G18 G19 | W11-D15 PolarHBondContact O-N 3.28Å; D15-C17 PolarHBondContact O-N 3.31Å; D15-G18 PolarHBondContact O-N 3.21Å; D15-G19 PolarHBondContact O-N 3.49Å |
| 16 | D | 92.5 | Very high | 88.6 | Confident | 44 Ų | 44 | 71.4 Ų | 71.4 | 24% | 0.235 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -64.6 | -37.3 | 178.1 | -73.7 | -32.8 | 0 | 0 | 0 | 112.2 | R12 A20 S74 | R12-D16 WeakPolarHBondContact CG-OD2 3.42Å; R12-D16 IonicContact NE-OD2 3.71Å; R12-D16 VanDerWaalsContact O-CB 3.28Å; R12-D16 WeakPolarHBondContact O-CB 3.48Å; R12-D16 VanDerWaalsContact O-CG 3.24Å; R12-D16 PolarHBondContact O-N 3.39Å; D16-A20 WeakPolarHBondContact O-CB 3.32Å; D16-A20 PolarHBondContact O-N 2.82Å; D16-S74 WeakPolarHBondContact CB-OG 3.15Å; D16-S74 VanDerWaalsContact OD2-CB 3.31Å; D16-S74 WeakPolarHBondContact OD2-CB 3.31Å; D16-S74 PolarHBondContact OD2-OG 2.97Å |
| 17 | C | 94.1 | Very high | 90.5 | Very high | 37 Ų | 37 | 68.2 Ų | 68.2 | 25% | 0.25 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -61.3 | -49.1 | 172.5 | -74 | 0 | 0 | 0 | 0 | 111.7 | I13 V14 D15 F21 G71 | I13-C17 VanDerWaalsContact O-CB 3.31Å; I13-C17 WeakPolarHBondContact O-CB 3.36Å; I13-C17 PolarHBondContact O-N 2.69Å; I13-C17 PolarHBondContact O-SG 3.36Å; V14-C17 PolarHBondContact O-N 3.38Å; D15-C17 PolarHBondContact O-N 3.31Å; C17-F21 WeakPolarHBondContact O-CB 3.19Å; C17-F21 PolarHBondContact O-N 3.39Å; C17-G71 WeakPolarHBondContact SG-CA 3.37Å |
| 18 | G | 94.8 | Very high | 92 | Very high | 35 Ų | 35 | 64.3 Ų | 64.3 | 36% | 0.361 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -68.2 | -43.5 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | V14 D15 F21 T22 | V14-G18 PolarHBondContact O-N 3.05Å; D15-G18 PolarHBondContact O-N 3.21Å; G18-F21 PolarHBondContact O-N 2.94Å; G18-T22 WeakPolarHBondContact O-CG2 3.47Å; G18-T22 PolarHBondContact O-N 2.88Å; G18-T22 PolarHBondContact O-OG1 2.04Å; G18-T22 VanDerWaalsContact O-OG1 3.07Å |
| 19 | G | 95 | Very high | 93 | Very high | 24 Ų | 24 | 60 Ų | 60 | 25% | 0.247 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -59.1 | -49.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | D15 F21 T22 M23 | D15-G19 PolarHBondContact O-N 3.49Å; G19-F21 PolarHBondContact O-N 3.12Å; G19-T22 PolarHBondContact O-N 2.99Å; G19-T22 PolarHBondContact O-OG1 3.03Å; G19-M23 WeakPolarHBondContact O-CG 3.28Å; G19-M23 PolarHBondContact O-N 2.91Å |
| 20 | A | 95.4 | Very high | 93.7 | Very high | 14 Ų | 14 | 61 Ų | 61 | 12% | 0.116 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -64.5 | -39.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | D16 G24 F66 | D16-A20 WeakPolarHBondContact O-CB 3.32Å; D16-A20 PolarHBondContact O-N 2.82Å; A20-G24 PolarHBondContact O-N 2.99Å; A20-F66 HydrophobicContact CB-CB 4.35Å; A20-F66 VanDerWaalsContact CB-O 3.26Å; A20-F66 WeakPolarHBondContact CB-O 3.28Å; A20-F66 VanDerWaalsContact O-CB 3.28Å; A20-F66 WeakPolarHBondContact O-CB 3.27Å |
| 21 | F | 97.2 | Very high | 94.2 | Very high | 86 Ų | 86 | 62.4 Ų | 62.4 | 38% | 0.377 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -58.3 | -51.1 | 174.9 | -179.4 | -101.7 | 0 | 0 | 0 | 111.7 | C17 G18 G19 G24 V25 G63 A67 | C17-F21 WeakPolarHBondContact O-CB 3.19Å; C17-F21 PolarHBondContact O-N 3.39Å; G18-F21 PolarHBondContact O-N 2.94Å; G19-F21 PolarHBondContact O-N 3.12Å; F21-G24 PolarHBondContact O-N 3.24Å; F21-V25 HydrophobicContact CD1-CG2 4.09Å; F21-V25 HydrophobicContact CD2-CG2 4.34Å; F21-V25 HydrophobicContact CE1-CG2 3.64Å; F21-V25 HydrophobicContact CE2-CG2 3.9Å; F21-V25 HydrophobicContact CG-CG2 4.43Å; F21-V25 HydrophobicContact CZ-CG2 3.53Å; F21-V25 WeakPolarHBondContact O-CG2 3.39Å; F21-V25 PolarHBondContact O-N 2.72Å; F21-G63 WeakPolarHBondContact CD2-O 3Å; F21-A67 HydrophobicContact CB-CB 3.84Å; F21-A67 HydrophobicContact CD2-CB 4.14Å; F21-A67 HydrophobicContact CG-CB 4.48Å |
| 22 | T | 96.8 | Very high | 94.6 | Very high | 72 Ų | 72 | 55.8 Ų | 55.8 | 44% | 0.442 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.1 | -44 | -178.3 | 53.3 | 0 | 0 | 0 | 0 | 111.5 | G18 G19 G24 V25 I26 | G18-T22 WeakPolarHBondContact O-CG2 3.47Å; G18-T22 PolarHBondContact O-N 2.88Å; G18-T22 PolarHBondContact O-OG1 2.04Å; G18-T22 VanDerWaalsContact O-OG1 3.07Å; G19-T22 PolarHBondContact O-N 2.99Å; G19-T22 PolarHBondContact O-OG1 3.03Å; T22-G24 VanDerWaalsContact C-N 3.31Å; T22-G24 PolarHBondContact O-N 3.28Å; T22-V25 PolarHBondContact O-N 2.88Å; T22-I26 WeakPolarHBondContact O-CB 3.15Å; T22-I26 VanDerWaalsContact O-CG1 3.27Å; T22-I26 WeakPolarHBondContact O-CG1 3.29Å; T22-I26 PolarHBondContact O-N 3.06Å |
| 23 | M | 96.1 | Very high | 94.9 | Very high | 140 Ų | 140 | 54.9 Ų | 54.9 | 69% | 0.69 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -57.5 | -43.9 | 172.5 | -70.5 | -164.6 | -143.6 | 0 | 0 | 111.8 | G19 G27 | G19-M23 WeakPolarHBondContact O-CG 3.28Å; G19-M23 PolarHBondContact O-N 2.91Å; M23-G27 PolarHBondContact O-N 2.86Å |
| 24 | G | 95.6 | Very high | 95.1 | Very high | 2 Ų | 2 | 57.7 Ų | 57.7 | 2% | 0.021 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -67.3 | -38.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | A20 F21 T22 G28 | A20-G24 PolarHBondContact O-N 2.99Å; F21-G24 PolarHBondContact O-N 3.24Å; T22-G24 VanDerWaalsContact C-N 3.31Å; T22-G24 PolarHBondContact O-N 3.28Å; G24-G28 VanDerWaalsContact O-CA 3.25Å; G24-G28 WeakPolarHBondContact O-CA 3.45Å; G24-G28 PolarHBondContact O-N 3.14Å |
| 25 | V | 97.1 | Very high | 95.1 | Very high | 46 Ų | 46 | 59 Ų | 59 | 28% | 0.279 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -68.9 | -43.9 | 176.2 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | F21 T22 G29 | F21-V25 HydrophobicContact CD1-CG2 4.09Å; F21-V25 HydrophobicContact CD2-CG2 4.34Å; F21-V25 HydrophobicContact CE1-CG2 3.64Å; F21-V25 HydrophobicContact CE2-CG2 3.9Å; F21-V25 HydrophobicContact CG-CG2 4.43Å; F21-V25 HydrophobicContact CZ-CG2 3.53Å; F21-V25 WeakPolarHBondContact O-CG2 3.39Å; F21-V25 PolarHBondContact O-N 2.72Å; T22-V25 PolarHBondContact O-N 2.88Å; V25-G29 VanDerWaalsContact O-CA 3.29Å; V25-G29 WeakPolarHBondContact O-CA 3.39Å; V25-G29 PolarHBondContact O-N 3.31Å |
| 26 | I | 96.8 | Very high | 95 | Very high | 119 Ų | 119 | 54.7 Ų | 54.7 | 61% | 0.61 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -68.7 | -54.3 | -179.8 | -65.5 | 168.3 | 0 | 0 | 0 | 109.7 | T22 G29 V30 | T22-I26 WeakPolarHBondContact O-CB 3.15Å; T22-I26 VanDerWaalsContact O-CG1 3.27Å; T22-I26 WeakPolarHBondContact O-CG1 3.29Å; T22-I26 PolarHBondContact O-N 3.06Å; I26-G29 PolarHBondContact O-N 2.95Å; I26-V30 WeakPolarHBondContact O-CG2 3.46Å; I26-V30 PolarHBondContact O-N 2.98Å |
| 27 | G | 95.1 | Very high | 95 | Very high | 42 Ų | 42 | 56 Ų | 56 | 43% | 0.433 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63.8 | -46.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | M23 G29 V30 F31 | M23-G27 PolarHBondContact O-N 2.86Å; G27-G29 VanDerWaalsContact C-N 3.34Å; G27-G29 PolarHBondContact O-N 3.42Å; G27-V30 PolarHBondContact O-N 3.38Å; G27-F31 WeakPolarHBondContact O-CB 3.42Å; G27-F31 PolarHBondContact O-N 2.93Å |
| 28 | G | 94.6 | Very high | 94.8 | Very high | 6 Ų | 6 | 63.9 Ų | 63.9 | 6% | 0.062 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -64.2 | -37.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | G24 Q32 | G24-G28 VanDerWaalsContact O-CA 3.25Å; G24-G28 WeakPolarHBondContact O-CA 3.45Å; G24-G28 PolarHBondContact O-N 3.14Å; G28-Q32 VanDerWaalsContact O-CB 3.26Å; G28-Q32 WeakPolarHBondContact O-CB 3.25Å; G28-Q32 WeakPolarHBondContact O-CG 3.29Å; G28-Q32 PolarHBondContact O-N 2.89Å |
| 29 | G | 95.9 | Very high | 94.6 | Very high | 11 Ų | 11 | 69.1 Ų | 69.1 | 11% | 0.113 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -62.1 | -50.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | V25 I26 G27 F31 Q32 A33 V55 | V25-G29 VanDerWaalsContact O-CA 3.29Å; V25-G29 WeakPolarHBondContact O-CA 3.39Å; V25-G29 PolarHBondContact O-N 3.31Å; I26-G29 PolarHBondContact O-N 2.95Å; G27-G29 VanDerWaalsContact C-N 3.34Å; G27-G29 PolarHBondContact O-N 3.42Å; G29-F31 PolarHBondContact O-N 2.89Å; G29-Q32 PolarHBondContact O-N 2.82Å; G29-A33 VanDerWaalsContact O-CB 3.25Å; G29-A33 WeakPolarHBondContact O-CB 3.23Å; G29-A33 PolarHBondContact O-N 3.42Å; G29-V55 WeakPolarHBondContact O-CG2 3.34Å |
| 30 | V | 96.4 | Very high | 94.4 | Very high | 88 Ų | 88 | 68.7 Ų | 68.7 | 53% | 0.533 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -60.8 | -47.7 | 177.3 | 173.8 | 0 | 0 | 0 | 0 | 110.9 | I26 G27 Q32 A33 I34 | I26-V30 WeakPolarHBondContact O-CG2 3.46Å; I26-V30 PolarHBondContact O-N 2.98Å; G27-V30 PolarHBondContact O-N 3.38Å; V30-Q32 PolarHBondContact O-N 3.44Å; V30-A33 WeakPolarHBondContact O-CB 3.36Å; V30-A33 PolarHBondContact O-N 2.97Å; V30-I34 HydrophobicContact CG1-CD1 4.09Å; V30-I34 WeakPolarHBondContact O-CG1 3.13Å; V30-I34 PolarHBondContact O-N 2.92Å; V30-I34 VanDerWaalsContact O-N 3.12Å |
| 31 | F | 94.9 | Very high | 94 | Very high | 124 Ų | 124 | 72.3 Ų | 72.3 | 54% | 0.544 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -61.3 | -44.8 | -179.7 | -177.3 | -99.7 | 0 | 0 | 0 | 112.1 | G27 G29 I34 K35 | G27-F31 WeakPolarHBondContact O-CB 3.42Å; G27-F31 PolarHBondContact O-N 2.93Å; G29-F31 PolarHBondContact O-N 2.89Å; F31-I34 PolarHBondContact O-N 2.93Å; F31-K35 HydrophobicContact CE1-CD 3.98Å; F31-K35 HydrophobicContact CZ-CD 4.41Å; F31-K35 WeakPolarHBondContact O-CB 3.31Å; F31-K35 PolarHBondContact O-N 2.86Å |
| 32 | Q | 95.9 | Very high | 93.4 | Very high | 16 Ų | 16 | 74.1 Ų | 74.1 | 8% | 0.075 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -75.7 | -24 | 179.7 | -60.3 | -65.9 | 37.6 | 0 | 0 | 112.9 | G28 G29 V30 G36 V55 R58 I62 | G28-Q32 VanDerWaalsContact O-CB 3.26Å; G28-Q32 WeakPolarHBondContact O-CB 3.25Å; G28-Q32 WeakPolarHBondContact O-CG 3.29Å; G28-Q32 PolarHBondContact O-N 2.89Å; G29-Q32 PolarHBondContact O-N 2.82Å; V30-Q32 PolarHBondContact O-N 3.44Å; Q32-G36 WeakPolarHBondContact O-CA 3.13Å; Q32-G36 PolarHBondContact O-N 2.73Å; Q32-V55 HydrophobicContact CB-CG2 4.49Å; Q32-R58 HydrophobicContact CG-CB 3.91Å; Q32-I62 HydrophobicContact CG-CD1 3.9Å |
| 33 | A | 93.9 | Very high | 92.9 | Very high | 31 Ų | 31 | 72.4 Ų | 72.4 | 26% | 0.256 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.8 | -49 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | G29 V30 F37 S51 V55 | G29-A33 VanDerWaalsContact O-CB 3.25Å; G29-A33 WeakPolarHBondContact O-CB 3.23Å; G29-A33 PolarHBondContact O-N 3.42Å; V30-A33 WeakPolarHBondContact O-CB 3.36Å; V30-A33 PolarHBondContact O-N 2.97Å; A33-F37 VanDerWaalsContact O-CB 3.28Å; A33-F37 WeakPolarHBondContact O-CB 3.32Å; A33-F37 PolarHBondContact O-N 3.34Å; A33-S51 VanDerWaalsContact CA-OG 3.25Å; A33-S51 WeakPolarHBondContact CA-OG 3.33Å; A33-S51 PolarHBondContact O-OG 3.02Å; A33-V55 HydrophobicContact CB-CG2 3.62Å |
| 34 | I | 93.9 | Very high | 92.6 | Very high | 97 Ų | 97 | 71.8 Ų | 71.8 | 50% | 0.497 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -65 | -49.8 | 178.2 | -62.6 | 166.5 | 0 | 0 | 0 | 110.3 | V30 F31 G36 F37 R38 | V30-I34 HydrophobicContact CG1-CD1 4.09Å; V30-I34 WeakPolarHBondContact O-CG1 3.13Å; V30-I34 PolarHBondContact O-N 2.92Å; V30-I34 VanDerWaalsContact O-N 3.12Å; F31-I34 PolarHBondContact O-N 2.93Å; I34-G36 PolarHBondContact O-N 3.29Å; I34-F37 PolarHBondContact O-N 2.9Å; I34-R38 WeakPolarHBondContact O-CG 3.14Å; I34-R38 PolarHBondContact O-N 3.43Å |
| 35 | K | 92.6 | Very high | 92.3 | Very high | 105 Ų | 105 | 82.3 Ų | 82.3 | 46% | 0.457 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63.2 | -42.7 | -179.8 | -171.4 | 171.6 | -175.9 | 165.4 | 0 | 111.7 | F31 F37 R38 N39 | F31-K35 HydrophobicContact CE1-CD 3.98Å; F31-K35 HydrophobicContact CZ-CD 4.41Å; F31-K35 WeakPolarHBondContact O-CB 3.31Å; F31-K35 PolarHBondContact O-N 2.86Å; K35-F37 VanDerWaalsContact C-N 3.35Å; K35-R38 PolarHBondContact O-N 3.42Å; K35-N39 VanDerWaalsContact O-CB 3.25Å; K35-N39 WeakPolarHBondContact O-CB 3.31Å; K35-N39 PolarHBondContact O-N 2.93Å |
| 36 | G | 90.9 | Very high | 91.9 | Very high | 10 Ų | 10 | 85.4 Ų | 85.4 | 10% | 0.103 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -65.4 | -36.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q32 I34 A40 | Q32-G36 WeakPolarHBondContact O-CA 3.13Å; Q32-G36 PolarHBondContact O-N 2.73Å; I34-G36 PolarHBondContact O-N 3.29Å; G36-A40 VanDerWaalsContact O-CB 3.22Å; G36-A40 WeakPolarHBondContact O-CB 3Å; G36-A40 PolarHBondContact O-N 3.41Å |
| 37 | F | 91.1 | Very high | 91.6 | Very high | 71 Ų | 71 | 83.8 Ų | 83.8 | 31% | 0.311 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -69.3 | -40.4 | 174.7 | -171.3 | -90.9 | 0 | 0 | 0 | 112.3 | A33 I34 K35 R47 L48 | A33-F37 VanDerWaalsContact O-CB 3.28Å; A33-F37 WeakPolarHBondContact O-CB 3.32Å; A33-F37 PolarHBondContact O-N 3.34Å; I34-F37 PolarHBondContact O-N 2.9Å; K35-F37 VanDerWaalsContact C-N 3.35Å; F37-R47 HydrophobicContact CD2-CB 3.56Å; F37-R47 HydrophobicContact CE2-CB 3.48Å; F37-R47 VanDerWaalsContact CE2-CB 3.48Å; F37-R47 HydrophobicContact CE2-CG 4.49Å; F37-R47 HydrophobicContact CG-CB 4.11Å; F37-R47 HydrophobicContact CZ-CB 4Å; F37-L48 HydrophobicContact CD2-CD2 4.35Å; F37-L48 HydrophobicContact CE2-CD2 4.11Å; F37-L48 HydrophobicContact CE2-CG 4.43Å |
| 38 | R | 90.5 | Very high | 91.5 | Very high | 203 Ų | 203 | 86.2 Ų | 86.2 | 77% | 0.766 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -72.7 | -33.8 | 179.7 | -71.7 | 179.2 | 69.7 | 170.2 | 2.1 | 113.5 | I34 K35 | I34-R38 WeakPolarHBondContact O-CG 3.14Å; I34-R38 PolarHBondContact O-N 3.43Å; K35-R38 PolarHBondContact O-N 3.42Å |
| 39 | N | 91.7 | Very high | 91.4 | Very high | 144 Ų | 144 | 95.4 Ų | 95.4 | 77% | 0.77 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -91.2 | -5.2 | -175.9 | -161.2 | 66.5 | 0 | 0 | 0 | 113.8 | K35 | K35-N39 VanDerWaalsContact O-CB 3.25Å; K35-N39 WeakPolarHBondContact O-CB 3.31Å; K35-N39 PolarHBondContact O-N 2.93Å |
| 40 | A | 90.5 | Very high | 91.2 | Very high | 15 Ų | 15 | 96.2 Ų | 96.2 | 12% | 0.124 | 48% | 0.476 | C | S | . | . | S | Bend | trans | -82.6 | 152.9 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G36 R47 | G36-A40 VanDerWaalsContact O-CB 3.22Å; G36-A40 WeakPolarHBondContact O-CB 3Å; G36-A40 PolarHBondContact O-N 3.41Å; A40-R47 HydrophobicContact CB-CB 4.33Å; A40-R47 HydrophobicContact CB-CG 4.09Å |
| 41 | P | 86.1 | Confident | 91 | Very high | 90 Ų | 90 | 92.8 Ų | 92.8 | 58% | 0.584 | 46% | 0.456 | S | S | * | . | P | Polyproline II helix | trans | -60.4 | 158.6 | -178.9 | 21.9 | -29.7 | 0 | 0 | 0 | 112.2 | H46 R47 | P41-H46 HydrophobicContact CG-CB 4.05Å; P41-R47 WeakPolarHBondContact O-CG 3.47Å |
| 42 | V | 84.4 | Confident | 91 | Very high | 124 Ų | 124 | 91.3 Ų | 91.3 | 75% | 0.752 | 46% | 0.458 | S | S | * | . | S | Bend | trans | -56.5 | 139.7 | -176.7 | -62.5 | 0 | 0 | 0 | 0 | 111.6 | ||
| 43 | G | 87.4 | Confident | 90.9 | Very high | 37 Ų | 37 | 95 Ų | 95 | 38% | 0.381 | 48% | 0.478 | S | S | . | . | S | Bend | trans | 114.1 | 127 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | R45 H46 R47 | G43-R45 VanDerWaalsContact C-N 3.29Å; G43-R45 PolarHBondContact O-N 3.38Å; G43-H46 PolarHBondContact O-N 2.92Å; G43-H46 VanDerWaalsContact O-N 3.11Å; G43-R47 WeakPolarHBondContact O-CG 3.22Å; G43-R47 PolarHBondContact O-N 3.46Å |
| 44 | I | 88.9 | Confident | 90.9 | Very high | 127 Ų | 127 | 94.4 Ų | 94.4 | 65% | 0.651 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -56.8 | -41.5 | -174.6 | -67.6 | 170.5 | 0 | 0 | 0 | 111.6 | H46 R47 L48 | I44-H46 PolarHBondContact O-N 3.07Å; I44-R47 PolarHBondContact O-N 3.04Å; I44-L48 HydrophobicContact CG2-CD1 3.85Å; I44-L48 HydrophobicContact CG2-CG 4.27Å; I44-L48 WeakPolarHBondContact O-CB 3.18Å; I44-L48 VanDerWaalsContact O-CG 3.31Å; I44-L48 WeakPolarHBondContact O-CG 3.37Å; I44-L48 PolarHBondContact O-N 2.92Å |
| 45 | R | 89.4 | Confident | 91 | Very high | 222 Ų | 222 | 91.7 Ų | 91.7 | 84% | 0.838 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -61.2 | -44 | 177.4 | -75.4 | -178.1 | 161 | -165.8 | -4.8 | 113 | G43 R49 | G43-R45 VanDerWaalsContact C-N 3.29Å; G43-R45 PolarHBondContact O-N 3.38Å; R45-R49 WeakPolarHBondContact O-CB 3.27Å; R45-R49 PolarHBondContact O-N 3.2Å |
| 46 | H | 89.1 | Confident | 91.1 | Very high | 112 Ų | 112 | 96.4 Ų | 96.4 | 52% | 0.519 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -70.2 | -36.5 | 178.6 | -66.9 | -71.9 | 0 | 0 | 0 | 111.9 | P41 G43 I44 G50 | P41-H46 HydrophobicContact CG-CB 4.05Å; G43-H46 PolarHBondContact O-N 2.92Å; G43-H46 VanDerWaalsContact O-N 3.11Å; I44-H46 PolarHBondContact O-N 3.07Å; H46-G50 PolarHBondContact O-N 3.2Å |
| 47 | R | 91.3 | Very high | 91.3 | Very high | 84 Ų | 84 | 100 Ų | 100 | 32% | 0.317 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.9 | -43.8 | 176.1 | -67.9 | -174.7 | 174.6 | -172.1 | -1.2 | 113.4 | F37 A40 P41 G43 I44 G50 S51 | F37-R47 HydrophobicContact CD2-CB 3.56Å; F37-R47 HydrophobicContact CE2-CB 3.48Å; F37-R47 VanDerWaalsContact CE2-CB 3.48Å; F37-R47 HydrophobicContact CE2-CG 4.49Å; F37-R47 HydrophobicContact CG-CB 4.11Å; F37-R47 HydrophobicContact CZ-CB 4Å; A40-R47 HydrophobicContact CB-CB 4.33Å; A40-R47 HydrophobicContact CB-CG 4.09Å; P41-R47 WeakPolarHBondContact O-CG 3.47Å; G43-R47 WeakPolarHBondContact O-CG 3.22Å; G43-R47 PolarHBondContact O-N 3.46Å; I44-R47 PolarHBondContact O-N 3.04Å; R47-G50 PolarHBondContact O-N 2.9Å; R47-S51 VanDerWaalsContact O-CB 3.23Å; R47-S51 WeakPolarHBondContact O-CB 3.11Å; R47-S51 PolarHBondContact O-N 3.33Å |
| 48 | L | 92.2 | Very high | 91.5 | Very high | 94 Ų | 94 | 102.1 Ų | 102.1 | 49% | 0.492 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.4 | -47.2 | 174.8 | -69.5 | 174.9 | 0 | 0 | 0 | 110.7 | F37 I44 G50 S51 T52 | F37-L48 HydrophobicContact CD2-CD2 4.35Å; F37-L48 HydrophobicContact CE2-CD2 4.11Å; F37-L48 HydrophobicContact CE2-CG 4.43Å; I44-L48 HydrophobicContact CG2-CD1 3.85Å; I44-L48 HydrophobicContact CG2-CG 4.27Å; I44-L48 WeakPolarHBondContact O-CB 3.18Å; I44-L48 VanDerWaalsContact O-CG 3.31Å; I44-L48 WeakPolarHBondContact O-CG 3.37Å; I44-L48 PolarHBondContact O-N 2.92Å; L48-G50 PolarHBondContact O-N 3.39Å; L48-S51 WeakPolarHBondContact O-CB 3.44Å; L48-S51 PolarHBondContact O-N 2.76Å; L48-T52 PolarHBondContact O-N 2.98Å; L48-T52 PolarHBondContact O-OG1 2.52Å |
| 49 | R | 92 | Very high | 91.7 | Very high | 199 Ų | 199 | 92.7 Ų | 92.7 | 75% | 0.751 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -62.5 | -40.8 | 178.1 | -167.9 | 174.5 | 179.9 | -176.9 | -0.4 | 112.6 | R45 N53 | R45-R49 WeakPolarHBondContact O-CB 3.27Å; R45-R49 PolarHBondContact O-N 3.2Å; R49-N53 WeakPolarHBondContact O-CB 3.32Å; R49-N53 PolarHBondContact O-N 2.89Å |
| 50 | G | 91.9 | Very high | 91.8 | Very high | 27 Ų | 27 | 88.9 Ų | 88.9 | 28% | 0.278 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -65 | -42 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | H46 R47 L48 N53 A54 | H46-G50 PolarHBondContact O-N 3.2Å; R47-G50 PolarHBondContact O-N 2.9Å; L48-G50 PolarHBondContact O-N 3.39Å; G50-N53 PolarHBondContact O-N 2.68Å; G50-A54 VanDerWaalsContact O-CB 3.29Å; G50-A54 WeakPolarHBondContact O-CB 3.19Å; G50-A54 PolarHBondContact O-N 2.82Å |
| 51 | S | 93.2 | Very high | 92.1 | Very high | 16 Ų | 16 | 94 Ų | 94 | 11% | 0.112 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -61.1 | -52.7 | 174.1 | -174.9 | 0 | 0 | 0 | 0 | 111.7 | A33 R47 L48 N53 A54 V55 | A33-S51 VanDerWaalsContact CA-OG 3.25Å; A33-S51 WeakPolarHBondContact CA-OG 3.33Å; A33-S51 PolarHBondContact O-OG 3.02Å; R47-S51 VanDerWaalsContact O-CB 3.23Å; R47-S51 WeakPolarHBondContact O-CB 3.11Å; R47-S51 PolarHBondContact O-N 3.33Å; L48-S51 WeakPolarHBondContact O-CB 3.44Å; L48-S51 PolarHBondContact O-N 2.76Å; S51-N53 VanDerWaalsContact C-N 3.3Å; S51-N53 PolarHBondContact O-N 2.93Å; S51-A54 PolarHBondContact O-N 3.43Å; S51-A54 VanDerWaalsContact O-N 3.14Å; S51-V55 WeakPolarHBondContact O-CG2 3.24Å; S51-V55 PolarHBondContact O-N 3.47Å |
| 52 | T | 94.3 | Very high | 92.5 | Very high | 94 Ų | 94 | 91.8 Ų | 91.8 | 58% | 0.577 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -59.5 | -41.3 | 178.9 | -50.2 | 0 | 0 | 0 | 0 | 111.9 | L48 R56 | L48-T52 PolarHBondContact O-N 2.98Å; L48-T52 PolarHBondContact O-OG1 2.52Å; T52-R56 VanDerWaalsContact O-CB 3.27Å; T52-R56 WeakPolarHBondContact O-CB 3.42Å; T52-R56 PolarHBondContact O-N 3.35Å |
| 53 | N | 94.1 | Very high | 93.1 | Very high | 94 Ų | 94 | 85.9 Ų | 85.9 | 50% | 0.503 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -66.9 | -41.5 | 177.4 | -165.5 | 43.6 | 0 | 0 | 0 | 112 | R49 G50 S51 R56 I57 | R49-N53 WeakPolarHBondContact O-CB 3.32Å; R49-N53 PolarHBondContact O-N 2.89Å; G50-N53 PolarHBondContact O-N 2.68Å; S51-N53 VanDerWaalsContact C-N 3.3Å; S51-N53 PolarHBondContact O-N 2.93Å; N53-R56 PolarHBondContact O-N 2.83Å; N53-I57 WeakPolarHBondContact O-CG1 3.31Å; N53-I57 PolarHBondContact O-N 3.35Å; N53-I57 VanDerWaalsContact O-N 3.09Å; N53-I57 WeakPolarHBondContact OD1-CD1 3.5Å |
| 54 | A | 93.9 | Very high | 93.5 | Very high | 17 Ų | 17 | 85.3 Ų | 85.3 | 14% | 0.14 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -62.6 | -44.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | G50 S51 R58 | G50-A54 VanDerWaalsContact O-CB 3.29Å; G50-A54 WeakPolarHBondContact O-CB 3.19Å; G50-A54 PolarHBondContact O-N 2.82Å; S51-A54 PolarHBondContact O-N 3.43Å; S51-A54 VanDerWaalsContact O-N 3.14Å; A54-R58 VanDerWaalsContact O-CB 3.26Å; A54-R58 WeakPolarHBondContact O-CB 3.16Å; A54-R58 WeakPolarHBondContact O-CG 3.23Å; A54-R58 PolarHBondContact O-N 2.74Å |
| 55 | V | 96.1 | Very high | 93.8 | Very high | 41 Ų | 41 | 83.2 Ų | 83.2 | 25% | 0.248 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -61.9 | -51 | 175.3 | 174.9 | 0 | 0 | 0 | 0 | 110.3 | G29 Q32 A33 S51 I57 R58 A59 | G29-V55 WeakPolarHBondContact O-CG2 3.34Å; Q32-V55 HydrophobicContact CB-CG2 4.49Å; A33-V55 HydrophobicContact CB-CG2 3.62Å; S51-V55 WeakPolarHBondContact O-CG2 3.24Å; S51-V55 PolarHBondContact O-N 3.47Å; V55-I57 VanDerWaalsContact C-N 3.29Å; V55-I57 PolarHBondContact O-N 2.88Å; V55-R58 PolarHBondContact O-N 2.67Å; V55-A59 HydrophobicContact CG1-CB 4.15Å; V55-A59 WeakPolarHBondContact O-CB 3.37Å; V55-A59 PolarHBondContact O-N 2.84Å |
| 56 | R | 94.4 | Very high | 94.1 | Very high | 203 Ų | 203 | 77.4 Ų | 77.4 | 77% | 0.766 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -58.1 | -40.3 | -176.2 | -174.9 | 177.4 | -179.7 | 177.3 | 0.6 | 113 | T52 N53 P60 | T52-R56 VanDerWaalsContact O-CB 3.27Å; T52-R56 WeakPolarHBondContact O-CB 3.42Å; T52-R56 PolarHBondContact O-N 3.35Å; N53-R56 PolarHBondContact O-N 2.83Å; R56-P60 WeakPolarHBondContact O-CD 3.46Å; R56-P60 WeakPolarHBondContact O-CG 3.47Å |
| 57 | I | 94.6 | Very high | 94.4 | Very high | 86 Ų | 86 | 73 Ų | 73 | 44% | 0.441 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -81.7 | -42.3 | -177.4 | -62.4 | 169.2 | 0 | 0 | 0 | 110.9 | N53 V55 Q61 | N53-I57 WeakPolarHBondContact O-CG1 3.31Å; N53-I57 PolarHBondContact O-N 3.35Å; N53-I57 VanDerWaalsContact O-N 3.09Å; N53-I57 WeakPolarHBondContact OD1-CD1 3.5Å; V55-I57 VanDerWaalsContact C-N 3.29Å; V55-I57 PolarHBondContact O-N 2.88Å; I57-Q61 WeakPolarHBondContact O-CG 3.26Å; I57-Q61 PolarHBondContact O-OE1 2.96Å |
| 58 | R | 94.9 | Very high | 94.7 | Very high | 115 Ų | 115 | 73.1 Ų | 73.1 | 43% | 0.434 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -98.2 | -29.8 | -166.5 | -59.2 | -172.1 | 179.6 | -178.7 | -4.9 | 114.6 | Q32 A54 V55 Q61 I62 | Q32-R58 HydrophobicContact CG-CB 3.91Å; A54-R58 VanDerWaalsContact O-CB 3.26Å; A54-R58 WeakPolarHBondContact O-CB 3.16Å; A54-R58 WeakPolarHBondContact O-CG 3.23Å; A54-R58 PolarHBondContact O-N 2.74Å; V55-R58 PolarHBondContact O-N 2.67Å; R58-Q61 PolarHBondContact O-N 3.02Å; R58-I62 VanDerWaalsContact O-CG1 3.31Å; R58-I62 WeakPolarHBondContact O-CG1 3.39Å; R58-I62 PolarHBondContact O-N 2.96Å |
| 59 | A | 94.9 | Very high | 94.8 | Very high | 5 Ų | 5 | 72.6 Ų | 72.6 | 4% | 0.041 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -57.2 | -46.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | V55 Q61 I62 G63 | V55-A59 HydrophobicContact CG1-CB 4.15Å; V55-A59 WeakPolarHBondContact O-CB 3.37Å; V55-A59 PolarHBondContact O-N 2.84Å; A59-Q61 VanDerWaalsContact C-N 3.34Å; A59-Q61 PolarHBondContact O-N 3.46Å; A59-I62 PolarHBondContact O-N 3.39Å; A59-G63 PolarHBondContact O-N 2.99Å |
| 60 | P | 94.6 | Very high | 94.9 | Very high | 65 Ų | 65 | 63.3 Ų | 63.3 | 42% | 0.422 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -69.4 | -29.7 | 177.5 | 26.9 | -34.9 | 0 | 0 | 0 | 113.2 | R56 G64 | R56-P60 WeakPolarHBondContact O-CD 3.46Å; R56-P60 WeakPolarHBondContact O-CG 3.47Å; P60-G64 PolarHBondContact O-N 3.41Å |
| 61 | Q | 95.6 | Very high | 95 | Very high | 123 Ų | 123 | 62.4 Ų | 62.4 | 58% | 0.575 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -67.5 | -42.2 | 175.6 | -68.1 | 177.3 | -29.7 | 0 | 0 | 111.8 | I57 R58 A59 S65 | I57-Q61 WeakPolarHBondContact O-CG 3.26Å; I57-Q61 PolarHBondContact O-OE1 2.96Å; R58-Q61 PolarHBondContact O-N 3.02Å; A59-Q61 VanDerWaalsContact C-N 3.34Å; A59-Q61 PolarHBondContact O-N 3.46Å; Q61-S65 PolarHBondContact O-N 3.25Å; Q61-S65 VanDerWaalsContact O-N 3.12Å; Q61-S65 PolarHBondContact O-OG 2.94Å |
| 62 | I | 95.9 | Very high | 95.1 | Very high | 42 Ų | 42 | 63.5 Ų | 63.5 | 22% | 0.215 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -66.1 | -50.1 | 174.7 | -65.3 | 167.1 | 0 | 0 | 0 | 109 | Q32 R58 A59 G64 S65 F66 | Q32-I62 HydrophobicContact CG-CD1 3.9Å; R58-I62 VanDerWaalsContact O-CG1 3.31Å; R58-I62 WeakPolarHBondContact O-CG1 3.39Å; R58-I62 PolarHBondContact O-N 2.96Å; A59-I62 PolarHBondContact O-N 3.39Å; I62-G64 VanDerWaalsContact C-N 3.32Å; I62-G64 PolarHBondContact O-N 3.48Å; I62-S65 WeakPolarHBondContact O-CB 3.45Å; I62-S65 PolarHBondContact O-N 3.43Å; I62-F66 HydrophobicContact CG2-CD2 3.79Å; I62-F66 HydrophobicContact CG2-CE2 3.76Å; I62-F66 WeakPolarHBondContact O-CD2 3.29Å; I62-F66 PolarHBondContact O-N 3.33Å |
| 63 | G | 96.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 60.4 Ų | 60.4 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -51.5 | -48.2 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | F21 A59 S65 F66 A67 | F21-G63 WeakPolarHBondContact CD2-O 3Å; A59-G63 PolarHBondContact O-N 2.99Å; G63-S65 VanDerWaalsContact C-N 3.31Å; G63-S65 PolarHBondContact O-N 3.25Å; G63-F66 PolarHBondContact O-N 3.1Å; G63-A67 WeakPolarHBondContact O-CB 3.2Å; G63-A67 PolarHBondContact O-N 3.48Å |
| 64 | G | 96 | Very high | 95 | Very high | 26 Ų | 26 | 56 Ų | 56 | 27% | 0.268 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -61.1 | -38.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | P60 I62 A67 V68 | P60-G64 PolarHBondContact O-N 3.41Å; I62-G64 VanDerWaalsContact C-N 3.32Å; I62-G64 PolarHBondContact O-N 3.48Å; G64-A67 PolarHBondContact O-N 3.11Å; G64-V68 WeakPolarHBondContact O-CG2 3.32Å; G64-V68 PolarHBondContact O-N 3.46Å |
| 65 | S | 95.1 | Very high | 94.9 | Very high | 82 Ų | 82 | 58 Ų | 58 | 57% | 0.573 | 30% | 0.297 | S | S | * | . | H | α-helix | trans | -65.6 | -40.9 | 176.5 | -54.9 | 0 | 0 | 0 | 0 | 111.8 | Q61 I62 G63 W69 | Q61-S65 PolarHBondContact O-N 3.25Å; Q61-S65 VanDerWaalsContact O-N 3.12Å; Q61-S65 PolarHBondContact O-OG 2.94Å; I62-S65 WeakPolarHBondContact O-CB 3.45Å; I62-S65 PolarHBondContact O-N 3.43Å; G63-S65 VanDerWaalsContact C-N 3.31Å; G63-S65 PolarHBondContact O-N 3.25Å; S65-W69 WeakPolarHBondContact O-CB 3.36Å; S65-W69 PolarHBondContact O-N 3.33Å; S65-W69 VanDerWaalsContact O-N 3.08Å |
| 66 | F | 95.2 | Very high | 94.8 | Very high | 101 Ų | 101 | 57.5 Ų | 57.5 | 44% | 0.443 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -67.2 | -39.6 | 173.8 | -86 | -90.4 | 0 | 0 | 0 | 112.1 | A20 I62 G63 V68 W69 G70 | A20-F66 HydrophobicContact CB-CB 4.35Å; A20-F66 VanDerWaalsContact CB-O 3.26Å; A20-F66 WeakPolarHBondContact CB-O 3.28Å; A20-F66 VanDerWaalsContact O-CB 3.28Å; A20-F66 WeakPolarHBondContact O-CB 3.27Å; I62-F66 HydrophobicContact CG2-CD2 3.79Å; I62-F66 HydrophobicContact CG2-CE2 3.76Å; I62-F66 WeakPolarHBondContact O-CD2 3.29Å; I62-F66 PolarHBondContact O-N 3.33Å; G63-F66 PolarHBondContact O-N 3.1Å; F66-V68 PolarHBondContact O-N 2.84Å; F66-W69 PolarHBondContact O-N 3.07Å; F66-G70 PolarHBondContact O-N 3.33Å |
| 67 | A | 96.3 | Very high | 94.6 | Very high | 19 Ų | 19 | 48 Ų | 48 | 16% | 0.157 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.2 | -46.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | F21 G63 G64 W69 G70 G71 | F21-A67 HydrophobicContact CB-CB 3.84Å; F21-A67 HydrophobicContact CD2-CB 4.14Å; F21-A67 HydrophobicContact CG-CB 4.48Å; G63-A67 WeakPolarHBondContact O-CB 3.2Å; G63-A67 PolarHBondContact O-N 3.48Å; G64-A67 PolarHBondContact O-N 3.11Å; A67-W69 VanDerWaalsContact C-N 3.33Å; A67-W69 PolarHBondContact O-N 3.5Å; A67-G70 PolarHBondContact O-N 2.99Å; A67-G71 PolarHBondContact O-N 2.84Å |
| 68 | V | 96.1 | Very high | 94.4 | Very high | 87 Ų | 87 | 44.5 Ų | 44.5 | 53% | 0.527 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -63.6 | -41.2 | 176.9 | 172.6 | 0 | 0 | 0 | 0 | 110.8 | G64 F66 L72 L103 | G64-V68 WeakPolarHBondContact O-CG2 3.32Å; G64-V68 PolarHBondContact O-N 3.46Å; F66-V68 PolarHBondContact O-N 2.84Å; V68-L72 WeakPolarHBondContact O-CB 3.18Å; V68-L72 PolarHBondContact O-N 3.23Å; V68-L103 HydrophobicContact CG1-CD2 3.73Å |
| 69 | W | 94.6 | Very high | 94 | Very high | 83 Ų | 83 | 40.5 Ų | 40.5 | 31% | 0.314 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.3 | -50.8 | 176.5 | -176.1 | 89.8 | 0 | 0 | 0 | 112 | S65 F66 A67 L72 F73 T99 L103 L123 | S65-W69 WeakPolarHBondContact O-CB 3.36Å; S65-W69 PolarHBondContact O-N 3.33Å; S65-W69 VanDerWaalsContact O-N 3.08Å; F66-W69 PolarHBondContact O-N 3.07Å; A67-W69 VanDerWaalsContact C-N 3.33Å; A67-W69 PolarHBondContact O-N 3.5Å; W69-L72 PolarHBondContact O-N 3.39Å; W69-F73 VanDerWaalsContact O-CB 3.31Å; W69-F73 WeakPolarHBondContact O-CB 3.42Å; W69-F73 PolarHBondContact O-N 3.08Å; W69-T99 HydrophobicContact CG-CG2 4.21Å; W69-L103 HydrophobicContact CB-CD1 4.21Å; W69-L103 HydrophobicContact CG-CD1 4.28Å; W69-L123 HydrophobicContact CH2-CD2 4.41Å |
| 70 | G | 94.1 | Very high | 93.7 | Very high | 4 Ų | 4 | 41.7 Ų | 41.7 | 4% | 0.041 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -62.8 | -44.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | F66 A67 F73 S74 | F66-G70 PolarHBondContact O-N 3.33Å; A67-G70 PolarHBondContact O-N 2.99Å; G70-F73 PolarHBondContact O-N 2.65Å; G70-S74 PolarHBondContact O-N 3.34Å; G70-S74 PolarHBondContact O-OG 2.86Å |
| 71 | G | 94.6 | Very high | 93.3 | Very high | 7 Ų | 7 | 40.1 Ų | 40.1 | 7% | 0.072 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -62.1 | -46.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | C17 A67 S74 T75 | C17-G71 WeakPolarHBondContact SG-CA 3.37Å; A67-G71 PolarHBondContact O-N 2.84Å; G71-S74 PolarHBondContact O-N 3.26Å; G71-T75 WeakPolarHBondContact O-CG2 3.37Å; G71-T75 PolarHBondContact O-N 3.45Å; G71-T75 PolarHBondContact O-OG1 3.32Å |
| 72 | L | 94.5 | Very high | 92.7 | Very high | 39 Ų | 39 | 44 Ų | 44 | 20% | 0.204 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -64.7 | -43.4 | 179 | -177.7 | 60.2 | 0 | 0 | 0 | 111.2 | V68 W69 S74 T75 I76 T99 V102 L103 | V68-L72 WeakPolarHBondContact O-CB 3.18Å; V68-L72 PolarHBondContact O-N 3.23Å; W69-L72 PolarHBondContact O-N 3.39Å; L72-S74 PolarHBondContact O-N 3.45Å; L72-T75 WeakPolarHBondContact CA-OG1 3.5Å; L72-T75 PolarHBondContact O-N 3.49Å; L72-T75 PolarHBondContact O-OG1 3.39Å; L72-I76 HydrophobicContact CD1-CD1 3.82Å; L72-I76 HydrophobicContact CD1-CG1 4.24Å; L72-I76 HydrophobicContact CG-CD1 3.85Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.33Å; L72-I76 PolarHBondContact O-N 3.49Å; L72-T99 HydrophobicContact CB-CG2 4.09Å; L72-T99 HydrophobicContact CD2-CG2 3.95Å; L72-T99 HydrophobicContact CG-CG2 4.02Å; L72-V102 HydrophobicContact CD1-CG1 4.4Å; L72-V102 HydrophobicContact CD2-CB 3.89Å; L72-V102 HydrophobicContact CD2-CG1 3.62Å; L72-L103 HydrophobicContact CD2-CD2 3.87Å; L72-L103 HydrophobicContact CD2-CG 3.9Å |
| 73 | F | 94.5 | Very high | 92.2 | Very high | 30 Ų | 30 | 49 Ų | 49 | 13% | 0.132 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -53.8 | -53.3 | 173.6 | 171.9 | -102.7 | 0 | 0 | 0 | 111.7 | W69 G70 T75 I76 D77 S95 T99 L123 | W69-F73 VanDerWaalsContact O-CB 3.31Å; W69-F73 WeakPolarHBondContact O-CB 3.42Å; W69-F73 PolarHBondContact O-N 3.08Å; G70-F73 PolarHBondContact O-N 2.65Å; F73-T75 PolarHBondContact O-N 2.87Å; F73-I76 PolarHBondContact O-N 3.19Å; F73-D77 PolarHBondContact O-N 3.47Å; F73-S95 WeakPolarHBondContact CE2-OG 3.41Å; F73-T99 VanDerWaalsContact CA-OG1 3.25Å; F73-T99 WeakPolarHBondContact CA-OG1 3.35Å; F73-T99 HydrophobicContact CB-CG2 4.36Å; F73-T99 PolarHBondContact N-OG1 2.83Å; F73-L123 HydrophobicContact CD2-CD1 3.67Å; F73-L123 HydrophobicContact CE2-CD1 3.08Å; F73-L123 HydrophobicContact CZ-CD1 3.79Å |
| 74 | S | 92.6 | Very high | 91.6 | Very high | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -68.4 | -33.2 | -177.4 | -54.5 | 0 | 0 | 0 | 0 | 113 | D16 G70 G71 L72 C78 | D16-S74 WeakPolarHBondContact CB-OG 3.15Å; D16-S74 VanDerWaalsContact OD2-CB 3.31Å; D16-S74 WeakPolarHBondContact OD2-CB 3.31Å; D16-S74 PolarHBondContact OD2-OG 2.97Å; G70-S74 PolarHBondContact O-N 3.34Å; G70-S74 PolarHBondContact O-OG 2.86Å; G71-S74 PolarHBondContact O-N 3.26Å; L72-S74 PolarHBondContact O-N 3.45Å; S74-C78 WeakPolarHBondContact O-CB 3.49Å; S74-C78 PolarHBondContact O-N 3.27Å; S74-C78 PolarHBondContact O-SG 3.36Å; S74-C78 VanDerWaalsContact O-SG 3.38Å |
| 75 | T | 92.5 | Very high | 90.7 | Very high | 60 Ų | 60 | 57.6 Ų | 57.6 | 37% | 0.368 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.1 | -41 | 173.2 | 60 | 0 | 0 | 0 | 0 | 111.9 | I13 G71 L72 F73 G79 | I13-T75 HydrophobicContact CD1-CG2 3.78Å; I13-T75 HydrophobicContact CG1-CG2 4.13Å; I13-T75 HydrophobicContact CG2-CG2 3.77Å; G71-T75 WeakPolarHBondContact O-CG2 3.37Å; G71-T75 PolarHBondContact O-N 3.45Å; G71-T75 PolarHBondContact O-OG1 3.32Å; L72-T75 WeakPolarHBondContact CA-OG1 3.5Å; L72-T75 PolarHBondContact O-N 3.49Å; L72-T75 PolarHBondContact O-OG1 3.39Å; F73-T75 PolarHBondContact O-N 2.87Å; T75-G79 PolarHBondContact O-N 2.84Å |
| 76 | I | 92.8 | Very high | 89.9 | Confident | 30 Ų | 30 | 60.3 Ų | 60.3 | 15% | 0.154 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -72.2 | -43 | 179.6 | -64.1 | 164.8 | 0 | 0 | 0 | 110 | L72 F73 G79 L80 L98 | L72-I76 HydrophobicContact CD1-CD1 3.82Å; L72-I76 HydrophobicContact CD1-CG1 4.24Å; L72-I76 HydrophobicContact CG-CD1 3.85Å; L72-I76 VanDerWaalsContact O-CG1 3.29Å; L72-I76 WeakPolarHBondContact O-CG1 3.33Å; L72-I76 PolarHBondContact O-N 3.49Å; F73-I76 PolarHBondContact O-N 3.19Å; I76-G79 PolarHBondContact O-N 3.44Å; I76-L80 HydrophobicContact CG2-CD1 4.11Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CG 3.33Å; I76-L80 PolarHBondContact O-N 3.49Å; I76-L98 HydrophobicContact CD1-CB 3.94Å; I76-L98 HydrophobicContact CG2-CB 4.17Å; I76-L98 HydrophobicContact CG2-CD1 3.72Å |
| 77 | D | 91.1 | Very high | 89 | Confident | 4 Ų | 4 | 61.6 Ų | 61.6 | 2% | 0.021 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -60.6 | -51.3 | 176.7 | -171.6 | 48.2 | 0 | 0 | 0 | 111.4 | R6 F73 G79 L80 V81 | R6-D77 IonicContact NH2-OD2 2.93Å; R6-D77 PolarHBondContact NH2-OD2 2.92Å; F73-D77 PolarHBondContact O-N 3.47Å; D77-G79 VanDerWaalsContact C-N 3.27Å; D77-G79 PolarHBondContact O-N 2.94Å; D77-L80 PolarHBondContact O-N 3.48Å; D77-L80 VanDerWaalsContact O-N 3.14Å; D77-V81 WeakPolarHBondContact O-CG2 3.22Å; D77-V81 PolarHBondContact O-N 2.91Å |
| 78 | C | 89.6 | Confident | 88.3 | Confident | 13 Ų | 13 | 64.2 Ų | 64.2 | 9% | 0.088 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -54.4 | -42.5 | 173.1 | -82.9 | 0 | 0 | 0 | 0 | 112.3 | C9 S74 R82 | C9-C78 HydrophobicContact CB-CB 3.89Å; C9-C78 WeakPolarHBondContact CB-SG 3.45Å; C9-C78 WeakPolarHBondContact SG-CB 3.46Å; C9-C78 CovalentContact SG-SG 2.04Å; C9-C78 PolarHBondContact SG-SG 3.41Å; S74-C78 WeakPolarHBondContact O-CB 3.49Å; S74-C78 PolarHBondContact O-N 3.27Å; S74-C78 PolarHBondContact O-SG 3.36Å; S74-C78 VanDerWaalsContact O-SG 3.38Å; C78-R82 WeakPolarHBondContact O-CB 3.38Å; C78-R82 PolarHBondContact O-N 3.3Å |
| 79 | G | 87.7 | Confident | 87.7 | Confident | 30 Ų | 30 | 62.7 Ų | 62.7 | 31% | 0.309 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | T75 I76 D77 R82 L83 | T75-G79 PolarHBondContact O-N 2.84Å; I76-G79 PolarHBondContact O-N 3.44Å; D77-G79 VanDerWaalsContact C-N 3.27Å; D77-G79 PolarHBondContact O-N 2.94Å; G79-R82 PolarHBondContact O-N 3.38Å; G79-L83 WeakPolarHBondContact O-CB 3.27Å; G79-L83 VanDerWaalsContact O-CG 3.29Å; G79-L83 WeakPolarHBondContact O-CG 3.45Å; G79-L83 PolarHBondContact O-N 2.97Å |
| 80 | L | 86.9 | Confident | 87.2 | Confident | 31 Ų | 31 | 66.7 Ų | 66.7 | 16% | 0.162 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.4 | -42.9 | 178.1 | -72.8 | 176 | 0 | 0 | 0 | 111.9 | I76 D77 R82 L83 R84 N91 T94 | I76-L80 HydrophobicContact CG2-CD1 4.11Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CG 3.33Å; I76-L80 PolarHBondContact O-N 3.49Å; D77-L80 PolarHBondContact O-N 3.48Å; D77-L80 VanDerWaalsContact O-N 3.14Å; L80-R82 VanDerWaalsContact C-N 3.33Å; L80-R82 PolarHBondContact O-N 3.01Å; L80-L83 PolarHBondContact O-N 3.25Å; L80-R84 WeakPolarHBondContact O-CB 3.39Å; L80-R84 WeakPolarHBondContact O-CG 3.46Å; L80-R84 PolarHBondContact O-N 2.67Å; L80-N91 HydrophobicContact CB-CB 4.5Å; L80-T94 HydrophobicContact CD1-CG2 4.24Å |
| 81 | V | 86.8 | Confident | 87 | Confident | 32 Ų | 32 | 66.6 Ų | 66.6 | 19% | 0.194 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -61.3 | -43.7 | 174.4 | 173.9 | 0 | 0 | 0 | 0 | 110.3 | D77 L83 G85 E87 | D77-V81 WeakPolarHBondContact O-CG2 3.22Å; D77-V81 PolarHBondContact O-N 2.91Å; V81-L83 VanDerWaalsContact C-N 3.33Å; V81-L83 PolarHBondContact O-N 3.39Å; V81-G85 WeakPolarHBondContact O-CA 3.47Å; V81-G85 PolarHBondContact O-N 2.94Å; V81-E87 HydrophobicContact CG1-CG 3.97Å; V81-E87 HydrophobicContact CG2-CG 4.1Å |
| 82 | R | 84.1 | Confident | 86.6 | Confident | 203 Ų | 203 | 66.9 Ų | 66.9 | 77% | 0.766 | 34% | 0.337 | S | S | * | . | H | α-helix | trans | -65.2 | -34.2 | 178.6 | -178.1 | 58.7 | -172.9 | 86.9 | -5.1 | 113.4 | C78 G79 L80 | C78-R82 WeakPolarHBondContact O-CB 3.38Å; C78-R82 PolarHBondContact O-N 3.3Å; G79-R82 PolarHBondContact O-N 3.38Å; L80-R82 VanDerWaalsContact C-N 3.33Å; L80-R82 PolarHBondContact O-N 3.01Å |
| 83 | L | 84.9 | Confident | 86.5 | Confident | 148 Ų | 148 | 66.8 Ų | 66.8 | 78% | 0.775 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -79.2 | -40.4 | 179.4 | -72.9 | 172.2 | 0 | 0 | 0 | 112.7 | G79 L80 V81 | G79-L83 WeakPolarHBondContact O-CB 3.27Å; G79-L83 VanDerWaalsContact O-CG 3.29Å; G79-L83 WeakPolarHBondContact O-CG 3.45Å; G79-L83 PolarHBondContact O-N 2.97Å; L80-L83 PolarHBondContact O-N 3.25Å; V81-L83 VanDerWaalsContact C-N 3.33Å; V81-L83 PolarHBondContact O-N 3.39Å |
| 84 | R | 83.7 | Confident | 86.4 | Confident | 140 Ų | 140 | 67.7 Ų | 67.7 | 53% | 0.528 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -95.7 | -18.5 | -173.2 | -59.7 | -178.2 | 85.7 | -176.1 | 6.7 | 113.5 | L80 K86 N91 | L80-R84 WeakPolarHBondContact O-CB 3.39Å; L80-R84 WeakPolarHBondContact O-CG 3.46Å; L80-R84 PolarHBondContact O-N 2.67Å; R84-K86 PolarHBondContact O-N 2.89Å; R84-K86 VanDerWaalsContact O-N 3.12Å; R84-N91 PolarHBondContact NH1-OD1 3.19Å |
| 85 | G | 77.6 | Confident | 86.4 | Confident | 67 Ų | 67 | 67.7 Ų | 67.7 | 69% | 0.691 | 34% | 0.344 | S | S | * | . | S | Bend | trans | 60.7 | 17.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | V81 | V81-G85 WeakPolarHBondContact O-CA 3.47Å; V81-G85 PolarHBondContact O-N 2.94Å |
| 86 | K | 78 | Confident | 86.4 | Confident | 139 Ų | 139 | 64.8 Ų | 64.8 | 60% | 0.604 | 33% | 0.327 | S | S | * | . | trans | -135 | 138.4 | -177.2 | -70.2 | 178.9 | -179.4 | 165.1 | 0 | 109.2 | R84 N91 | R84-K86 PolarHBondContact O-N 2.89Å; R84-K86 VanDerWaalsContact O-N 3.12Å; K86-N91 PolarHBondContact O-ND2 2.89Å | ||
| 87 | E | 75.4 | Confident | 86.5 | Confident | 128 Ų | 128 | 64.7 Ų | 64.7 | 60% | 0.598 | 33% | 0.33 | S | S | * | . | trans | -105.5 | 95.5 | 176.6 | -60.7 | -164.7 | 162.8 | 0 | 0 | 108.8 | V81 | V81-E87 HydrophobicContact CG1-CG 3.97Å; V81-E87 HydrophobicContact CG2-CG 4.1Å | ||
| 88 | D | 82.3 | Confident | 86.6 | Confident | 74 Ų | 74 | 68.1 Ų | 68.1 | 40% | 0.396 | 35% | 0.348 | S | S | . | . | trans | -116.7 | 153 | 178.1 | -66.3 | -51.4 | 0 | 0 | 0 | 110 | W90 N91 | D88-W90 HydrophobicContact CB-CB 4.39Å; D88-W90 PolarHBondContact O-N 3.13Å; D88-N91 WeakPolarHBondContact O-CB 3.39Å; D88-N91 PolarHBondContact O-N 3.5Å | ||
| 89 | P | 82.9 | Confident | 86.9 | Confident | 54 Ų | 54 | 67.5 Ų | 67.5 | 35% | 0.351 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -54.2 | -23.4 | 173.3 | -26.2 | 34.3 | 0 | 0 | 0 | 113.6 | N91 S92 I93 E127 I131 | P89-N91 PolarHBondContact O-N 3.37Å; P89-S92 PolarHBondContact O-N 3.37Å; P89-I93 WeakPolarHBondContact O-CG1 3.45Å; P89-I93 PolarHBondContact O-N 3.17Å; P89-I93 VanDerWaalsContact O-N 3.13Å; P89-E127 HydrophobicContact CB-CB 4.44Å; P89-I131 HydrophobicContact CG-CD1 4.14Å |
| 90 | W | 84.6 | Confident | 87.2 | Confident | 168 Ų | 168 | 66.4 Ų | 66.4 | 64% | 0.636 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -61.9 | -27.8 | 172.7 | -87 | 108.2 | 0 | 0 | 0 | 113.9 | D88 T94 | D88-W90 HydrophobicContact CB-CB 4.39Å; D88-W90 PolarHBondContact O-N 3.13Å; W90-T94 WeakPolarHBondContact O-CB 3.27Å; W90-T94 PolarHBondContact O-N 3.45Å; W90-T94 PolarHBondContact O-OG1 2.87Å |
| 91 | N | 89.3 | Confident | 87.6 | Confident | 2 Ų | 2 | 65.8 Ų | 65.8 | 1% | 0.011 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -69.1 | -45.9 | 176.6 | -66.7 | -10.8 | 0 | 0 | 0 | 110.4 | L80 R84 K86 D88 P89 T94 S95 | L80-N91 HydrophobicContact CB-CB 4.5Å; R84-N91 PolarHBondContact NH1-OD1 3.19Å; K86-N91 PolarHBondContact O-ND2 2.89Å; D88-N91 WeakPolarHBondContact O-CB 3.39Å; D88-N91 PolarHBondContact O-N 3.5Å; P89-N91 PolarHBondContact O-N 3.37Å; N91-T94 PolarHBondContact O-N 2.91Å; N91-S95 VanDerWaalsContact O-CB 3.22Å; N91-S95 WeakPolarHBondContact O-CB 3.07Å; N91-S95 PolarHBondContact O-N 3.45Å; N91-S95 PolarHBondContact O-OG 3.43Å |
| 92 | S | 87.6 | Confident | 88 | Confident | 13 Ų | 13 | 68 Ų | 68 | 9% | 0.091 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -60 | -46.1 | 173.7 | -59.7 | 0 | 0 | 0 | 0 | 111.8 | P89 T94 S95 G96 L123 E127 | P89-S92 PolarHBondContact O-N 3.37Å; S92-T94 PolarHBondContact O-N 2.91Å; S92-S95 VanDerWaalsContact CA-OG 3.31Å; S92-S95 WeakPolarHBondContact CA-OG 3.39Å; S92-S95 PolarHBondContact O-N 3.5Å; S92-S95 PolarHBondContact O-OG 2.92Å; S92-G96 PolarHBondContact O-N 3.34Å; S92-L123 WeakPolarHBondContact O-CD1 3.1Å; S92-E127 WeakPolarHBondContact CB-OE1 3.47Å; S92-E127 PolarHBondContact OG-OE1 3.14Å |
| 93 | I | 91.6 | Very high | 88.4 | Confident | 37 Ų | 37 | 61.7 Ų | 61.7 | 19% | 0.19 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -64.1 | -46 | -179.8 | -63.6 | 169.2 | 0 | 0 | 0 | 111.1 | P89 G96 A97 A124 | P89-I93 WeakPolarHBondContact O-CG1 3.45Å; P89-I93 PolarHBondContact O-N 3.17Å; P89-I93 VanDerWaalsContact O-N 3.13Å; I93-G96 PolarHBondContact O-N 2.91Å; I93-A97 PolarHBondContact O-N 3.09Å; I93-A124 HydrophobicContact CD1-CB 3.89Å; I93-A124 HydrophobicContact CG1-CB 4Å; I93-A124 HydrophobicContact CG2-CB 4.47Å |
| 94 | T | 92.1 | Very high | 88.9 | Confident | 48 Ų | 48 | 55.2 Ų | 55.2 | 29% | 0.294 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -68.6 | -40.8 | -178.5 | -54.4 | 0 | 0 | 0 | 0 | 111.1 | L80 W90 N91 S92 G96 A97 L98 | L80-T94 HydrophobicContact CD1-CG2 4.24Å; W90-T94 WeakPolarHBondContact O-CB 3.27Å; W90-T94 PolarHBondContact O-N 3.45Å; W90-T94 PolarHBondContact O-OG1 2.87Å; N91-T94 PolarHBondContact O-N 2.91Å; S92-T94 PolarHBondContact O-N 2.91Å; T94-G96 VanDerWaalsContact C-N 3.35Å; T94-A97 PolarHBondContact O-N 2.97Å; T94-L98 HydrophobicContact CG2-CD1 3.95Å; T94-L98 HydrophobicContact CG2-CG 4.33Å; T94-L98 WeakPolarHBondContact O-CB 3.41Å; T94-L98 VanDerWaalsContact O-CG 3.29Å; T94-L98 WeakPolarHBondContact O-CG 3.29Å; T94-L98 PolarHBondContact O-N 3.18Å |
| 95 | S | 92.5 | Very high | 89.3 | Confident | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -65.5 | -37 | 175.7 | 54.6 | 0 | 0 | 0 | 0 | 111.8 | F73 N91 S92 L98 T99 | F73-S95 WeakPolarHBondContact CE2-OG 3.41Å; N91-S95 VanDerWaalsContact O-CB 3.22Å; N91-S95 WeakPolarHBondContact O-CB 3.07Å; N91-S95 PolarHBondContact O-N 3.45Å; N91-S95 PolarHBondContact O-OG 3.43Å; S92-S95 VanDerWaalsContact CA-OG 3.31Å; S92-S95 WeakPolarHBondContact CA-OG 3.39Å; S92-S95 PolarHBondContact O-N 3.5Å; S92-S95 PolarHBondContact O-OG 2.92Å; S95-L98 PolarHBondContact O-N 3.18Å; S95-T99 VanDerWaalsContact O-CB 3.23Å; S95-T99 WeakPolarHBondContact O-CB 3.25Å; S95-T99 PolarHBondContact O-N 3.43Å; S95-T99 PolarHBondContact O-OG1 3.14Å |
| 96 | G | 92.8 | Very high | 90.1 | Very high | 0 Ų | 0 | 59 Ų | 59 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -62.1 | -45.7 | 171.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | S92 I93 T94 T99 G100 L123 | S92-G96 PolarHBondContact O-N 3.34Å; I93-G96 PolarHBondContact O-N 2.91Å; T94-G96 VanDerWaalsContact C-N 3.35Å; G96-T99 PolarHBondContact O-N 3.35Å; G96-G100 PolarHBondContact O-N 3.34Å; G96-L123 VanDerWaalsContact CA-CD1 3.48Å |
| 97 | A | 94.8 | Very high | 90.8 | Very high | 27 Ų | 27 | 56.3 Ų | 56.3 | 22% | 0.223 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -63.6 | -45 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | I93 T94 G100 A101 A116 | I93-A97 PolarHBondContact O-N 3.09Å; T94-A97 PolarHBondContact O-N 2.97Å; A97-G100 PolarHBondContact O-N 3.34Å; A97-A101 WeakPolarHBondContact O-CB 3.4Å; A97-A101 PolarHBondContact O-N 3.39Å; A97-A116 WeakPolarHBondContact CA-O 3.33Å; A97-A116 WeakPolarHBondContact O-CA 3.42Å; A97-A116 WeakPolarHBondContact O-CB 3.38Å |
| 98 | L | 94.3 | Very high | 91.7 | Very high | 76 Ų | 76 | 51.4 Ų | 51.4 | 40% | 0.398 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -64.9 | -42.6 | 177.3 | -73.5 | 172.2 | 0 | 0 | 0 | 111.9 | I76 T94 S95 G100 A101 V102 | I76-L98 HydrophobicContact CD1-CB 3.94Å; I76-L98 HydrophobicContact CG2-CB 4.17Å; I76-L98 HydrophobicContact CG2-CD1 3.72Å; T94-L98 HydrophobicContact CG2-CD1 3.95Å; T94-L98 HydrophobicContact CG2-CG 4.33Å; T94-L98 WeakPolarHBondContact O-CB 3.41Å; T94-L98 VanDerWaalsContact O-CG 3.29Å; T94-L98 WeakPolarHBondContact O-CG 3.29Å; T94-L98 PolarHBondContact O-N 3.18Å; S95-L98 PolarHBondContact O-N 3.18Å; L98-G100 VanDerWaalsContact C-N 3.34Å; L98-G100 PolarHBondContact O-N 3.18Å; L98-A101 PolarHBondContact O-N 3.05Å; L98-V102 WeakPolarHBondContact O-CB 3.36Å; L98-V102 VanDerWaalsContact O-CG2 3.24Å; L98-V102 WeakPolarHBondContact O-CG2 3.25Å; L98-V102 PolarHBondContact O-N 2.88Å |
| 99 | T | 94.8 | Very high | 92.3 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -57.9 | -47.9 | 175.4 | -60.3 | 0 | 0 | 0 | 0 | 110.6 | W69 L72 F73 S95 G96 V102 L103 | W69-T99 HydrophobicContact CG-CG2 4.21Å; L72-T99 HydrophobicContact CB-CG2 4.09Å; L72-T99 HydrophobicContact CD2-CG2 3.95Å; L72-T99 HydrophobicContact CG-CG2 4.02Å; F73-T99 VanDerWaalsContact CA-OG1 3.25Å; F73-T99 WeakPolarHBondContact CA-OG1 3.35Å; F73-T99 HydrophobicContact CB-CG2 4.36Å; F73-T99 PolarHBondContact N-OG1 2.83Å; S95-T99 VanDerWaalsContact O-CB 3.23Å; S95-T99 WeakPolarHBondContact O-CB 3.25Å; S95-T99 PolarHBondContact O-N 3.43Å; S95-T99 PolarHBondContact O-OG1 3.14Å; G96-T99 PolarHBondContact O-N 3.35Å; T99-V102 PolarHBondContact O-N 3.42Å; T99-L103 HydrophobicContact CG2-CD1 4.01Å; T99-L103 VanDerWaalsContact O-CG 3.27Å; T99-L103 WeakPolarHBondContact O-CG 3.29Å; T99-L103 PolarHBondContact O-N 2.89Å |
| 100 | G | 93.5 | Very high | 92.9 | Very high | 8 Ų | 8 | 57.6 Ų | 57.6 | 8% | 0.082 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -57.1 | -51.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | G96 A97 L98 V102 L103 A104 S115 | G96-G100 PolarHBondContact O-N 3.34Å; A97-G100 PolarHBondContact O-N 3.34Å; L98-G100 VanDerWaalsContact C-N 3.34Å; L98-G100 PolarHBondContact O-N 3.18Å; G100-V102 PolarHBondContact O-N 3.06Å; G100-L103 PolarHBondContact O-N 3.38Å; G100-A104 PolarHBondContact O-N 3.27Å; G100-A104 VanDerWaalsContact O-N 3.14Å; G100-S115 VanDerWaalsContact C-OG 3.28Å; G100-S115 WeakPolarHBondContact O-CB 3.39Å; G100-S115 PolarHBondContact O-OG 2.92Å |
| 101 | A | 95.2 | Very high | 93.3 | Very high | 17 Ų | 17 | 51.3 Ų | 51.3 | 14% | 0.14 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -56.6 | -47.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | A97 L98 A104 A105 A116 | A97-A101 WeakPolarHBondContact O-CB 3.4Å; A97-A101 PolarHBondContact O-N 3.39Å; L98-A101 PolarHBondContact O-N 3.05Å; A101-A104 CarbonylContact O-C 3.57Å; A101-A104 PolarHBondContact O-N 2.89Å; A101-A105 PolarHBondContact O-N 2.97Å; A101-A116 HydrophobicContact CB-CB 3.98Å |
| 102 | V | 95.5 | Very high | 93.6 | Very high | 78 Ų | 78 | 54.3 Ų | 54.3 | 47% | 0.473 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -65.9 | -42.6 | -177.3 | 169.3 | 0 | 0 | 0 | 0 | 111 | L72 L98 T99 G100 A104 A105 | L72-V102 HydrophobicContact CD1-CG1 4.4Å; L72-V102 HydrophobicContact CD2-CB 3.89Å; L72-V102 HydrophobicContact CD2-CG1 3.62Å; L98-V102 WeakPolarHBondContact O-CB 3.36Å; L98-V102 VanDerWaalsContact O-CG2 3.24Å; L98-V102 WeakPolarHBondContact O-CG2 3.25Å; L98-V102 PolarHBondContact O-N 2.88Å; T99-V102 PolarHBondContact O-N 3.42Å; G100-V102 PolarHBondContact O-N 3.06Å; V102-A104 VanDerWaalsContact C-N 3.26Å; V102-A104 PolarHBondContact O-N 3.41Å; V102-A105 VanDerWaalsContact O-CB 3.22Å; V102-A105 WeakPolarHBondContact O-CB 3.38Å; V102-A105 PolarHBondContact O-N 2.88Å |
| 103 | L | 93.8 | Very high | 94 | Very high | 71 Ų | 71 | 57.9 Ų | 57.9 | 37% | 0.372 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -66.8 | -29.3 | 179.1 | -66.8 | 175.1 | 0 | 0 | 0 | 113 | V68 W69 L72 T99 G100 | V68-L103 HydrophobicContact CG1-CD2 3.73Å; W69-L103 HydrophobicContact CB-CD1 4.21Å; W69-L103 HydrophobicContact CG-CD1 4.28Å; L72-L103 HydrophobicContact CD2-CD2 3.87Å; L72-L103 HydrophobicContact CD2-CG 3.9Å; T99-L103 HydrophobicContact CG2-CD1 4.01Å; T99-L103 VanDerWaalsContact O-CG 3.27Å; T99-L103 WeakPolarHBondContact O-CG 3.29Å; T99-L103 PolarHBondContact O-N 2.89Å; G100-L103 PolarHBondContact O-N 3.38Å |
| 104 | A | 94.3 | Very high | 94.2 | Very high | 12 Ų | 12 | 57.8 Ų | 57.8 | 10% | 0.099 | 34% | 0.343 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -93.4 | 3.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | G100 A101 V102 R106 S107 A111 S115 | G100-A104 PolarHBondContact O-N 3.27Å; G100-A104 VanDerWaalsContact O-N 3.14Å; A101-A104 CarbonylContact O-C 3.57Å; A101-A104 PolarHBondContact O-N 2.89Å; V102-A104 VanDerWaalsContact C-N 3.26Å; V102-A104 PolarHBondContact O-N 3.41Å; A104-R106 PolarHBondContact O-N 3.12Å; A104-S107 WeakPolarHBondContact O-CA 3.5Å; A104-S107 WeakPolarHBondContact O-CB 3.44Å; A104-S107 PolarHBondContact O-N 3.45Å; A104-A111 HydrophobicContact CB-CB 4.35Å; A104-A111 WeakPolarHBondContact CB-O 3.49Å; A104-S115 WeakPolarHBondContact CB-OG 3.49Å |
| 105 | A | 93.5 | Very high | 94.3 | Very high | 49 Ų | 49 | 57 Ų | 57 | 41% | 0.405 | 34% | 0.34 | S | S | . | . | G | 310 helix | trans | -54.3 | -40.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | A101 V102 S107 G108 M112 | A101-A105 PolarHBondContact O-N 2.97Å; V102-A105 VanDerWaalsContact O-CB 3.22Å; V102-A105 WeakPolarHBondContact O-CB 3.38Å; V102-A105 PolarHBondContact O-N 2.88Å; A105-S107 PolarHBondContact O-N 3.25Å; A105-G108 PolarHBondContact O-N 3.01Å; A105-M112 HydrophobicContact CB-CE 4.21Å; A105-M112 HydrophobicContact CB-CG 4.5Å; A105-M112 HydrophobicContact CB-SD 4.26Å |
| 106 | R | 93.6 | Very high | 94.4 | Very high | 239 Ų | 239 | 58 Ų | 58 | 90% | 0.902 | 35% | 0.348 | S | S | * | . | G | 310 helix | trans | -70.5 | -16.4 | 178.3 | 68.6 | 179.7 | -177.8 | 179.1 | -0.1 | 114.6 | A104 G108 | A104-R106 PolarHBondContact O-N 3.12Å; R106-G108 VanDerWaalsContact C-N 3.32Å |
| 107 | S | 92.9 | Very high | 94.6 | Very high | 81 Ų | 81 | 63.3 Ų | 63.3 | 57% | 0.566 | 37% | 0.374 | S | S | * | . | G | 310 helix | trans | -91.1 | 2.2 | -176.7 | -55.4 | 0 | 0 | 0 | 0 | 112.5 | A104 A105 | A104-S107 WeakPolarHBondContact O-CA 3.5Å; A104-S107 WeakPolarHBondContact O-CB 3.44Å; A104-S107 PolarHBondContact O-N 3.45Å; A105-S107 PolarHBondContact O-N 3.25Å |
| 108 | G | 94.7 | Very high | 94.5 | Very high | 25 Ų | 25 | 68.1 Ų | 68.1 | 26% | 0.258 | 39% | 0.394 | S | S | . | . | trans | 94.6 | 164.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114 | A105 R106 L110 A111 M112 | A105-G108 PolarHBondContact O-N 3.01Å; R106-G108 VanDerWaalsContact C-N 3.32Å; G108-L110 VanDerWaalsContact C-N 3.32Å; G108-L110 PolarHBondContact O-N 3.03Å; G108-A111 PolarHBondContact O-N 2.95Å; G108-A111 VanDerWaalsContact O-N 3.12Å; G108-M112 WeakPolarHBondContact O-CG 3.44Å; G108-M112 PolarHBondContact O-N 3.38Å | ||
| 109 | P | 93.9 | Very high | 94.4 | Very high | 104 Ų | 104 | 65 Ų | 65 | 68% | 0.675 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -62.8 | -34.3 | -169 | 22.9 | -33.5 | 0 | 0 | 0 | 113.5 | M112 V113 | P109-M112 WeakPolarHBondContact O-CB 3.07Å; P109-M112 PolarHBondContact O-N 3.29Å; P109-V113 WeakPolarHBondContact O-CG2 3.21Å; P109-V113 PolarHBondContact O-N 2.88Å |
| 110 | L | 95.1 | Very high | 94.3 | Very high | 154 Ų | 154 | 65.4 Ų | 65.4 | 81% | 0.806 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -65.2 | -41.6 | 177.4 | -173.1 | 66.9 | 0 | 0 | 0 | 111.8 | G108 M112 V113 G114 | G108-L110 VanDerWaalsContact C-N 3.32Å; G108-L110 PolarHBondContact O-N 3.03Å; L110-M112 VanDerWaalsContact C-N 3.34Å; L110-V113 PolarHBondContact O-N 3.39Å; L110-G114 PolarHBondContact O-N 3Å |
| 111 | A | 94.5 | Very high | 94.3 | Very high | 37 Ų | 37 | 70 Ų | 70 | 31% | 0.306 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -68.5 | -34.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | A104 G108 S115 | A104-A111 HydrophobicContact CB-CB 4.35Å; A104-A111 WeakPolarHBondContact CB-O 3.49Å; G108-A111 PolarHBondContact O-N 2.95Å; G108-A111 VanDerWaalsContact O-N 3.12Å; A111-S115 VanDerWaalsContact O-CB 3.32Å; A111-S115 WeakPolarHBondContact O-CB 3.35Å; A111-S115 PolarHBondContact O-N 2.79Å; A111-S115 PolarHBondContact O-OG 3.32Å |
| 112 | M | 95.4 | Very high | 94.2 | Very high | 64 Ų | 64 | 73 Ų | 73 | 32% | 0.315 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -59.7 | -50.2 | 172.6 | -66.2 | 176.3 | 70.9 | 0 | 0 | 111.7 | A105 G108 P109 L110 S115 A116 | A105-M112 HydrophobicContact CB-CE 4.21Å; A105-M112 HydrophobicContact CB-CG 4.5Å; A105-M112 HydrophobicContact CB-SD 4.26Å; G108-M112 WeakPolarHBondContact O-CG 3.44Å; G108-M112 PolarHBondContact O-N 3.38Å; P109-M112 WeakPolarHBondContact O-CB 3.07Å; P109-M112 PolarHBondContact O-N 3.29Å; L110-M112 VanDerWaalsContact C-N 3.34Å; M112-S115 PolarHBondContact O-N 3.48Å; M112-S115 PolarHBondContact O-OG 2.91Å; M112-A116 WeakPolarHBondContact O-CB 3.48Å; M112-A116 PolarHBondContact O-N 2.83Å |
| 113 | V | 95.8 | Very high | 94.1 | Very high | 88 Ų | 88 | 69.9 Ų | 69.9 | 53% | 0.533 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -64.8 | -43.7 | 179.8 | 176 | 0 | 0 | 0 | 0 | 110.8 | P109 L110 S115 A116 M117 | P109-V113 WeakPolarHBondContact O-CG2 3.21Å; P109-V113 PolarHBondContact O-N 2.88Å; L110-V113 PolarHBondContact O-N 3.39Å; V113-S115 PolarHBondContact O-N 3.42Å; V113-A116 PolarHBondContact O-N 3.43Å; V113-M117 HydrophobicContact CG1-CE 4.18Å; V113-M117 WeakPolarHBondContact O-CG 3.45Å; V113-M117 PolarHBondContact O-N 3.3Å |
| 114 | G | 95.1 | Very high | 94 | Very high | 35 Ų | 35 | 68.3 Ų | 68.3 | 36% | 0.361 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -60.2 | -46 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L110 M118 | L110-G114 PolarHBondContact O-N 3Å; G114-M118 PolarHBondContact O-N 3.16Å; G114-M118 VanDerWaalsContact O-N 3.09Å |
| 115 | S | 94.9 | Very high | 94 | Very high | 31 Ų | 31 | 73 Ų | 73 | 22% | 0.217 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -70 | -36.5 | 177.7 | 56.9 | 0 | 0 | 0 | 0 | 113 | G100 A104 A111 M112 V113 M118 G119 | G100-S115 VanDerWaalsContact C-OG 3.28Å; G100-S115 WeakPolarHBondContact O-CB 3.39Å; G100-S115 PolarHBondContact O-OG 2.92Å; A104-S115 WeakPolarHBondContact CB-OG 3.49Å; A111-S115 VanDerWaalsContact O-CB 3.32Å; A111-S115 WeakPolarHBondContact O-CB 3.35Å; A111-S115 PolarHBondContact O-N 2.79Å; A111-S115 PolarHBondContact O-OG 3.32Å; M112-S115 PolarHBondContact O-N 3.48Å; M112-S115 PolarHBondContact O-OG 2.91Å; V113-S115 PolarHBondContact O-N 3.42Å; S115-M118 PolarHBondContact O-N 2.95Å; S115-G119 PolarHBondContact O-N 2.86Å |
| 116 | A | 94.6 | Very high | 93.8 | Very high | 21 Ų | 21 | 75.2 Ų | 75.2 | 17% | 0.174 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62.2 | -45.5 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | A97 A101 M112 V113 G119 G120 | A97-A116 WeakPolarHBondContact CA-O 3.33Å; A97-A116 WeakPolarHBondContact O-CA 3.42Å; A97-A116 WeakPolarHBondContact O-CB 3.38Å; A101-A116 HydrophobicContact CB-CB 3.98Å; M112-A116 WeakPolarHBondContact O-CB 3.48Å; M112-A116 PolarHBondContact O-N 2.83Å; V113-A116 PolarHBondContact O-N 3.43Å; A116-G119 PolarHBondContact O-N 3.06Å; A116-G120 PolarHBondContact O-N 3.12Å |
| 117 | M | 95.9 | Very high | 93.6 | Very high | 112 Ų | 112 | 66.8 Ų | 66.8 | 55% | 0.552 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -60.6 | -47.6 | 175.5 | -73.7 | -170.7 | -60.6 | 0 | 0 | 111.2 | V113 G119 G120 I121 | V113-M117 HydrophobicContact CG1-CE 4.18Å; V113-M117 WeakPolarHBondContact O-CG 3.45Å; V113-M117 PolarHBondContact O-N 3.3Å; M117-G119 PolarHBondContact O-N 2.88Å; M117-G120 PolarHBondContact O-N 3.06Å; M117-I121 WeakPolarHBondContact O-CB 3.32Å; M117-I121 WeakPolarHBondContact O-CD1 3.34Å; M117-I121 WeakPolarHBondContact O-CG1 3.46Å; M117-I121 PolarHBondContact O-N 3.01Å |
| 118 | M | 93.9 | Very high | 93.4 | Very high | 129 Ų | 129 | 64.7 Ų | 64.7 | 64% | 0.635 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -60.8 | -45.1 | 179.1 | -172.4 | 65.4 | -175.6 | 0 | 0 | 111.9 | G114 S115 L122 | G114-M118 PolarHBondContact O-N 3.16Å; G114-M118 VanDerWaalsContact O-N 3.09Å; S115-M118 PolarHBondContact O-N 2.95Å; M118-L122 VanDerWaalsContact O-CB 3.31Å; M118-L122 WeakPolarHBondContact O-CB 3.26Å; M118-L122 PolarHBondContact O-N 2.9Å |
| 119 | G | 91.4 | Very high | 93.2 | Very high | 9 Ų | 9 | 67.2 Ų | 67.2 | 9% | 0.093 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -64 | -44.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | S115 A116 M117 L123 | S115-G119 PolarHBondContact O-N 2.86Å; A116-G119 PolarHBondContact O-N 3.06Å; M117-G119 PolarHBondContact O-N 2.88Å; G119-L123 PolarHBondContact O-N 3.31Å; G119-L123 VanDerWaalsContact O-N 3.16Å |
| 120 | G | 92.8 | Very high | 92.9 | Very high | 10 Ų | 10 | 63.7 Ų | 63.7 | 10% | 0.103 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -65 | -44.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A116 M117 A124 | A116-G120 PolarHBondContact O-N 3.12Å; M117-G120 PolarHBondContact O-N 3.06Å; G120-A124 VanDerWaalsContact O-CB 3.25Å; G120-A124 WeakPolarHBondContact O-CB 3.31Å; G120-A124 PolarHBondContact O-N 2.92Å |
| 121 | I | 94.6 | Very high | 92.6 | Very high | 105 Ų | 105 | 60.1 Ų | 60.1 | 54% | 0.538 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -63.3 | -45.6 | 177.3 | -68.9 | 165.6 | 0 | 0 | 0 | 110.6 | M117 L123 A124 L125 | M117-I121 WeakPolarHBondContact O-CB 3.32Å; M117-I121 WeakPolarHBondContact O-CD1 3.34Å; M117-I121 WeakPolarHBondContact O-CG1 3.46Å; M117-I121 PolarHBondContact O-N 3.01Å; I121-L123 PolarHBondContact O-N 2.77Å; I121-A124 PolarHBondContact O-N 3.03Å; I121-L125 HydrophobicContact CG2-CD1 4.21Å; I121-L125 WeakPolarHBondContact O-CG 3.39Å; I121-L125 PolarHBondContact O-N 3.26Å |
| 122 | L | 92.9 | Very high | 92.2 | Very high | 80 Ų | 80 | 64 Ų | 64 | 42% | 0.419 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -59.2 | -47.4 | -179.1 | -177.1 | 65.6 | 0 | 0 | 0 | 111.3 | M118 L125 I126 | M118-L122 VanDerWaalsContact O-CB 3.31Å; M118-L122 WeakPolarHBondContact O-CB 3.26Å; M118-L122 PolarHBondContact O-N 2.9Å; L122-L125 PolarHBondContact O-N 3.45Å; L122-I126 HydrophobicContact CG-CD1 4.38Å; L122-I126 WeakPolarHBondContact O-CG1 3.34Å; L122-I126 PolarHBondContact O-N 2.91Å |
| 123 | L | 92.5 | Very high | 91.8 | Very high | 11 Ų | 11 | 65.9 Ų | 65.9 | 6% | 0.058 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -74.7 | -30 | 180 | -64.9 | -164.4 | 0 | 0 | 0 | 113.3 | W69 F73 S92 G96 G119 I121 L125 I126 E127 | W69-L123 HydrophobicContact CH2-CD2 4.41Å; F73-L123 HydrophobicContact CD2-CD1 3.67Å; F73-L123 HydrophobicContact CE2-CD1 3.08Å; F73-L123 HydrophobicContact CZ-CD1 3.79Å; S92-L123 WeakPolarHBondContact O-CD1 3.1Å; G96-L123 VanDerWaalsContact CA-CD1 3.48Å; G119-L123 PolarHBondContact O-N 3.31Å; G119-L123 VanDerWaalsContact O-N 3.16Å; I121-L123 PolarHBondContact O-N 2.77Å; L123-L125 PolarHBondContact O-N 2.89Å; L123-I126 HydrophobicContact CD2-CD1 3.8Å; L123-I126 PolarHBondContact O-N 3.47Å; L123-E127 WeakPolarHBondContact O-CB 3.42Å; L123-E127 WeakPolarHBondContact O-CG 3.25Å; L123-E127 PolarHBondContact O-N 3.31Å |
| 124 | A | 92.5 | Very high | 91.4 | Very high | 39 Ų | 39 | 66 Ų | 66 | 32% | 0.322 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -60.3 | -38.1 | 170.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | I93 G120 I121 G128 | I93-A124 HydrophobicContact CD1-CB 3.89Å; I93-A124 HydrophobicContact CG1-CB 4Å; I93-A124 HydrophobicContact CG2-CB 4.47Å; G120-A124 VanDerWaalsContact O-CB 3.25Å; G120-A124 WeakPolarHBondContact O-CB 3.31Å; G120-A124 PolarHBondContact O-N 2.92Å; I121-A124 PolarHBondContact O-N 3.03Å; A124-G128 WeakPolarHBondContact O-CA 3.26Å; A124-G128 PolarHBondContact O-N 3.49Å |
| 125 | L | 92.5 | Very high | 90.8 | Very high | 110 Ų | 110 | 72.9 Ų | 72.9 | 58% | 0.576 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -69 | -43.5 | 174.3 | -68.2 | 173.1 | 0 | 0 | 0 | 112 | I121 L122 L123 G128 V129 | I121-L125 HydrophobicContact CG2-CD1 4.21Å; I121-L125 WeakPolarHBondContact O-CG 3.39Å; I121-L125 PolarHBondContact O-N 3.26Å; L122-L125 PolarHBondContact O-N 3.45Å; L123-L125 PolarHBondContact O-N 2.89Å; L125-G128 PolarHBondContact O-N 3.32Å; L125-V129 WeakPolarHBondContact O-CB 3.25Å; L125-V129 VanDerWaalsContact O-CG2 3.29Å; L125-V129 WeakPolarHBondContact O-CG2 3.31Å; L125-V129 PolarHBondContact O-N 3.45Å |
| 126 | I | 91.3 | Very high | 90.3 | Very high | 96 Ų | 96 | 78.5 Ų | 78.5 | 49% | 0.492 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -62.5 | -49.6 | 179.4 | -67.3 | 178.1 | 0 | 0 | 0 | 110.9 | L122 L123 G128 V129 G130 | L122-I126 HydrophobicContact CG-CD1 4.38Å; L122-I126 WeakPolarHBondContact O-CG1 3.34Å; L122-I126 PolarHBondContact O-N 2.91Å; L123-I126 HydrophobicContact CD2-CD1 3.8Å; L123-I126 PolarHBondContact O-N 3.47Å; I126-G128 VanDerWaalsContact C-N 3.35Å; I126-G128 PolarHBondContact O-N 3.02Å; I126-V129 PolarHBondContact O-N 3.09Å; I126-G130 PolarHBondContact O-N 3.41Å |
| 127 | E | 88.9 | Confident | 89.8 | Confident | 61 Ų | 61 | 80.6 Ų | 80.6 | 29% | 0.285 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -64.9 | -39.7 | 177 | -67.4 | -65.5 | 166.9 | 0 | 0 | 111.5 | P89 S92 L123 V129 G130 I131 | P89-E127 HydrophobicContact CB-CB 4.44Å; S92-E127 WeakPolarHBondContact CB-OE1 3.47Å; S92-E127 PolarHBondContact OG-OE1 3.14Å; L123-E127 WeakPolarHBondContact O-CB 3.42Å; L123-E127 WeakPolarHBondContact O-CG 3.25Å; L123-E127 PolarHBondContact O-N 3.31Å; E127-V129 PolarHBondContact O-N 2.94Å; E127-G130 PolarHBondContact O-N 2.92Å; E127-I131 WeakPolarHBondContact O-CG1 3.38Å; E127-I131 PolarHBondContact O-N 2.92Å |
| 128 | G | 88.1 | Confident | 88.8 | Confident | 38 Ų | 38 | 77.9 Ų | 77.9 | 39% | 0.392 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -60.5 | -42.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | A124 L125 I126 L132 | A124-G128 WeakPolarHBondContact O-CA 3.26Å; A124-G128 PolarHBondContact O-N 3.49Å; L125-G128 PolarHBondContact O-N 3.32Å; I126-G128 VanDerWaalsContact C-N 3.35Å; I126-G128 PolarHBondContact O-N 3.02Å; G128-L132 PolarHBondContact O-N 2.89Å; G128-L132 VanDerWaalsContact O-N 3.09Å |
| 129 | V | 91.1 | Very high | 87.7 | Confident | 77 Ų | 77 | 77.4 Ų | 77.4 | 47% | 0.467 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -68 | -40 | 173.8 | 173.1 | 0 | 0 | 0 | 0 | 110.8 | L125 I126 E127 I131 L132 L133 | L125-V129 WeakPolarHBondContact O-CB 3.25Å; L125-V129 VanDerWaalsContact O-CG2 3.29Å; L125-V129 WeakPolarHBondContact O-CG2 3.31Å; L125-V129 PolarHBondContact O-N 3.45Å; I126-V129 PolarHBondContact O-N 3.09Å; E127-V129 PolarHBondContact O-N 2.94Å; V129-I131 PolarHBondContact O-N 3.37Å; V129-L132 PolarHBondContact O-N 3.39Å; V129-L133 HydrophobicContact CG1-CD1 3.85Å; V129-L133 HydrophobicContact CG1-CG 4.13Å; V129-L133 WeakPolarHBondContact O-CB 3.2Å; V129-L133 WeakPolarHBondContact O-CG 3.47Å; V129-L133 PolarHBondContact O-N 3Å |
| 130 | G | 87 | Confident | 86.5 | Confident | 31 Ų | 31 | 82.9 Ų | 82.9 | 32% | 0.32 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -58 | -45.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | I126 E127 T134 | I126-G130 PolarHBondContact O-N 3.41Å; E127-G130 PolarHBondContact O-N 2.92Å; G130-T134 WeakPolarHBondContact O-CB 3.41Å; G130-T134 PolarHBondContact O-N 2.96Å; G130-T134 PolarHBondContact O-OG1 3.41Å |
| 131 | I | 88 | Confident | 85 | Confident | 78 Ų | 78 | 90.3 Ų | 90.3 | 40% | 0.4 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 175 | -66.5 | 166.6 | 0 | 0 | 0 | 110.6 | P89 E127 V129 T134 R135 | P89-I131 HydrophobicContact CG-CD1 4.14Å; E127-I131 WeakPolarHBondContact O-CG1 3.38Å; E127-I131 PolarHBondContact O-N 2.92Å; V129-I131 PolarHBondContact O-N 3.37Å; I131-T134 PolarHBondContact O-N 2.88Å; I131-R135 WeakPolarHBondContact O-CG 3.37Å; I131-R135 PolarHBondContact O-N 2.89Å |
| 132 | L | 87.6 | Confident | 83.3 | Confident | 119 Ų | 119 | 95.7 Ų | 95.7 | 62% | 0.623 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.8 | -47.5 | 179.7 | -178.6 | 63.1 | 0 | 0 | 0 | 112.1 | G128 V129 T134 R135 Y136 | G128-L132 PolarHBondContact O-N 2.89Å; G128-L132 VanDerWaalsContact O-N 3.09Å; V129-L132 PolarHBondContact O-N 3.39Å; L132-T134 VanDerWaalsContact C-N 3.34Å; L132-T134 PolarHBondContact O-N 2.82Å; L132-R135 PolarHBondContact O-N 3.43Å; L132-Y136 WeakPolarHBondContact O-CB 3.35Å; L132-Y136 PolarHBondContact O-N 3.48Å |
| 133 | L | 87.3 | Confident | 81.5 | Confident | 103 Ų | 103 | 98 Ų | 98 | 54% | 0.539 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -41.3 | 177.9 | -70.6 | 174.8 | 0 | 0 | 0 | 111.6 | V129 R135 Y136 T137 | V129-L133 HydrophobicContact CG1-CD1 3.85Å; V129-L133 HydrophobicContact CG1-CG 4.13Å; V129-L133 WeakPolarHBondContact O-CB 3.2Å; V129-L133 WeakPolarHBondContact O-CG 3.47Å; V129-L133 PolarHBondContact O-N 3Å; L133-R135 VanDerWaalsContact C-N 3.32Å; L133-R135 PolarHBondContact O-N 3.48Å; L133-Y136 PolarHBondContact O-N 3.09Å; L133-T137 WeakPolarHBondContact O-CB 3.29Å; L133-T137 WeakPolarHBondContact O-CG2 3.47Å; L133-T137 PolarHBondContact O-N 2.98Å; L133-T137 PolarHBondContact O-OG1 2.99Å |
| 134 | T | 86 | Confident | 79.6 | Confident | 91 Ų | 91 | 100.7 Ų | 100.7 | 56% | 0.558 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.4 | -41.4 | 175.9 | -55.9 | 0 | 0 | 0 | 0 | 111 | G130 I131 L132 T137 A138 | G130-T134 WeakPolarHBondContact O-CB 3.41Å; G130-T134 PolarHBondContact O-N 2.96Å; G130-T134 PolarHBondContact O-OG1 3.41Å; I131-T134 PolarHBondContact O-N 2.88Å; L132-T134 VanDerWaalsContact C-N 3.34Å; L132-T134 PolarHBondContact O-N 2.82Å; T134-T137 WeakPolarHBondContact CA-OG1 3.33Å; T134-T137 PolarHBondContact O-OG1 3.12Å; T134-A138 WeakPolarHBondContact O-CB 3.47Å; T134-A138 PolarHBondContact O-N 3.27Å |
| 135 | R | 84.1 | Confident | 77.8 | Confident | 179 Ų | 179 | 103.7 Ų | 103.7 | 68% | 0.675 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -67.2 | -42.2 | 176 | -74.9 | -168.5 | 178.9 | -150.8 | 1.7 | 112.7 | I131 L132 L133 A138 Q139 | I131-R135 WeakPolarHBondContact O-CG 3.37Å; I131-R135 PolarHBondContact O-N 2.89Å; L132-R135 PolarHBondContact O-N 3.43Å; L133-R135 VanDerWaalsContact C-N 3.32Å; L133-R135 PolarHBondContact O-N 3.48Å; R135-A138 PolarHBondContact O-N 3.47Å; R135-Q139 VanDerWaalsContact O-CG 3.32Å; R135-Q139 WeakPolarHBondContact O-CG 3.23Å; R135-Q139 PolarHBondContact O-N 3.47Å |
| 136 | Y | 83.6 | Confident | 76.1 | Confident | 150 Ų | 150 | 103.9 Ų | 103.9 | 59% | 0.588 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -64.6 | -45.8 | 179 | -176.5 | -99.1 | 0 | 0 | 0 | 112 | L132 L133 Q139 Q140 | L132-Y136 WeakPolarHBondContact O-CB 3.35Å; L132-Y136 PolarHBondContact O-N 3.48Å; L133-Y136 PolarHBondContact O-N 3.09Å; Y136-Q139 WeakPolarHBondContact O-CB 3.35Å; Y136-Q139 PolarHBondContact O-N 3.06Å; Y136-Q140 PolarHBondContact O-N 3.45Å |
| 137 | T | 83.2 | Confident | 74.3 | Confident | 65 Ų | 65 | 108.5 Ų | 108.5 | 40% | 0.399 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -65.3 | -40 | 176 | 52.5 | 0 | 0 | 0 | 0 | 111.9 | L133 T134 Q139 Q140 F141 | L133-T137 WeakPolarHBondContact O-CB 3.29Å; L133-T137 WeakPolarHBondContact O-CG2 3.47Å; L133-T137 PolarHBondContact O-N 2.98Å; L133-T137 PolarHBondContact O-OG1 2.99Å; T134-T137 WeakPolarHBondContact CA-OG1 3.33Å; T134-T137 PolarHBondContact O-OG1 3.12Å; T137-Q139 VanDerWaalsContact C-N 3.3Å; T137-Q139 PolarHBondContact O-N 3.25Å; T137-Q140 VanDerWaalsContact O-CB 3.27Å; T137-Q140 WeakPolarHBondContact O-CB 3.28Å; T137-Q140 PolarHBondContact O-N 2.99Å; T137-Q140 VanDerWaalsContact O-N 3.07Å; T137-F141 VanDerWaalsContact O-CD2 3.23Å; T137-F141 WeakPolarHBondContact O-CD2 3.22Å; T137-F141 PolarHBondContact O-N 2.89Å |
| 138 | A | 76.1 | Confident | 72.5 | Confident | 55 Ų | 55 | 113.3 Ų | 113.3 | 46% | 0.455 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -62.5 | -35.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | T134 R135 Q140 F141 R142 | T134-A138 WeakPolarHBondContact O-CB 3.47Å; T134-A138 PolarHBondContact O-N 3.27Å; R135-A138 PolarHBondContact O-N 3.47Å; A138-Q140 VanDerWaalsContact C-N 3.29Å; A138-Q140 PolarHBondContact O-N 3.01Å; A138-F141 PolarHBondContact O-N 2.85Å; A138-R142 WeakPolarHBondContact O-CB 3.38Å; A138-R142 PolarHBondContact O-N 3.41Å; A138-R142 VanDerWaalsContact O-N 3.1Å |
| 139 | Q | 70.4 | Confident | 70.8 | Confident | 119 Ų | 119 | 120.2 Ų | 120.2 | 56% | 0.556 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -65.5 | -33 | 173.1 | -74.5 | 175.5 | -45 | 0 | 0 | 112.2 | R135 Y136 T137 F141 R142 N143 | R135-Q139 VanDerWaalsContact O-CG 3.32Å; R135-Q139 WeakPolarHBondContact O-CG 3.23Å; R135-Q139 PolarHBondContact O-N 3.47Å; Y136-Q139 WeakPolarHBondContact O-CB 3.35Å; Y136-Q139 PolarHBondContact O-N 3.06Å; T137-Q139 VanDerWaalsContact C-N 3.3Å; T137-Q139 PolarHBondContact O-N 3.25Å; Q139-F141 VanDerWaalsContact C-N 3.35Å; Q139-F141 PolarHBondContact O-N 2.76Å; Q139-R142 PolarHBondContact O-N 3.31Å; Q139-N143 PolarHBondContact O-N 2.91Å; Q139-N143 PolarHBondContact O-ND2 2.88Å; Q139-N143 VanDerWaalsContact O-ND2 3.11Å |
| 140 | Q | 66.1 | Low | 68.7 | Low | 124 Ų | 124 | 121.3 Ų | 121.3 | 58% | 0.579 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -65.1 | -37.5 | 177.6 | -158.3 | 173.8 | -89.7 | 0 | 0 | 112.2 | Y136 T137 A138 | Y136-Q140 PolarHBondContact O-N 3.45Å; T137-Q140 VanDerWaalsContact O-CB 3.27Å; T137-Q140 WeakPolarHBondContact O-CB 3.28Å; T137-Q140 PolarHBondContact O-N 2.99Å; T137-Q140 VanDerWaalsContact O-N 3.07Å; A138-Q140 VanDerWaalsContact C-N 3.29Å; A138-Q140 PolarHBondContact O-N 3.01Å |
| 141 | F | 60.5 | Low | 66.9 | Low | 165 Ų | 165 | 124.9 Ų | 124.9 | 72% | 0.724 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -82 | -20.9 | 176.1 | -65.5 | -68 | 0 | 0 | 0 | 114 | T137 A138 Q139 N143 | T137-F141 VanDerWaalsContact O-CD2 3.23Å; T137-F141 WeakPolarHBondContact O-CD2 3.22Å; T137-F141 PolarHBondContact O-N 2.89Å; A138-F141 PolarHBondContact O-N 2.85Å; Q139-F141 VanDerWaalsContact C-N 3.35Å; Q139-F141 PolarHBondContact O-N 2.76Å; F141-N143 PolarHBondContact O-N 2.94Å |
| 142 | R | 60.5 | Low | 65.3 | Low | 219 Ų | 219 | 125.3 Ų | 125.3 | 83% | 0.826 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -76.8 | -11.7 | 177.2 | -155.9 | 168 | -175.1 | 153.8 | 0.7 | 113.4 | A138 Q139 | A138-R142 WeakPolarHBondContact O-CB 3.38Å; A138-R142 PolarHBondContact O-N 3.41Å; A138-R142 VanDerWaalsContact O-N 3.1Å; Q139-R142 PolarHBondContact O-N 3.31Å |
| 143 | N | 54.2 | Low | 63.4 | Low | 128 Ų | 128 | 128 Ų | 128 | 68% | 0.684 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.1 | 11.2 | -177 | -68.4 | -30.8 | 0 | 0 | 0 | 114.5 | Q139 F141 P145 | Q139-N143 PolarHBondContact O-N 2.91Å; Q139-N143 PolarHBondContact O-ND2 2.88Å; Q139-N143 VanDerWaalsContact O-ND2 3.11Å; F141-N143 PolarHBondContact O-N 2.94Å; N143-P145 WeakPolarHBondContact O-CD 3.25Å |
| 144 | A | 53 | Low | 61.4 | Low | 67 Ų | 67 | 129.9 Ų | 129.9 | 55% | 0.554 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -67.3 | 112.9 | 158.6 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||
| 145 | P | 53.7 | Low | 59.5 | Low | 102 Ų | 102 | 130.7 Ų | 130.7 | 66% | 0.662 | 67% | 0.672 | S | S | * | * | trans | -54.8 | 135.2 | 173.8 | 23.6 | -31.1 | 0 | 0 | 0 | 106.7 | N143 F147 | N143-P145 WeakPolarHBondContact O-CD 3.25Å; P145-F147 PolarHBondContact O-N 3.48Å | ||
| 146 | P | 56.8 | Low | 57.4 | Low | 115 Ų | 115 | 127.9 Ų | 127.9 | 75% | 0.747 | 68% | 0.676 | S | S | * | * | trans | -50 | 123.2 | 167.7 | 21.6 | -29.7 | 0 | 0 | 0 | 105.5 | L148 | P146-L148 PolarHBondContact O-N 2.77Š| ||
| 147 | F | 54.2 | Low | 55.6 | Low | 192 Ų | 192 | 130.9 Ų | 130.9 | 84% | 0.842 | 69% | 0.693 | S | S | * | * | trans | -44.9 | 116.1 | 168.2 | -53.6 | -87 | 0 | 0 | 0 | 104.7 | P145 E149 | P145-F147 PolarHBondContact O-N 3.48Å; F147-E149 PolarHBondContact O-N 2.92Å | ||
| 148 | L | 51.7 | Low | 53.4 | Low | 162 Ų | 162 | 135.1 Ų | 135.1 | 85% | 0.848 | 71% | 0.713 | S | S | * | * | trans | -56.1 | 98.6 | 179.1 | -158.2 | 90.3 | 0 | 0 | 0 | 104.4 | P146 D150 | P146-L148 PolarHBondContact O-N 2.77Å; L148-D150 PolarHBondContact O-N 3.44Å | ||
| 149 | E | 51.4 | Low | 51.9 | Low | 184 Ų | 184 | 135.9 Ų | 135.9 | 86% | 0.86 | 73% | 0.726 | S | S | * | * | trans | -61.8 | 96.3 | 169.4 | -108 | 163.3 | 114.4 | 0 | 0 | 103.9 | F147 P151 | F147-E149 PolarHBondContact O-N 2.92Å; E149-P151 WeakPolarHBondContact O-CD 3.31Å; E149-P151 VanDerWaalsContact O-N 3.09Å | ||
| 150 | D | 47.6 | Very low | 50.1 | Low | 99 Ų | 99 | 137 Ų | 137 | 53% | 0.529 | 74% | 0.741 | S | S | . | * | trans | -55.5 | 114.4 | 176 | -170.6 | -21.6 | 0 | 0 | 0 | 106.3 | L148 S152 Q153 | L148-D150 PolarHBondContact O-N 3.44Å; D150-S152 PolarHBondContact O-N 3.11Å; D150-S152 WeakPolarHBondContact OD1-CB 3.42Å; D150-S152 PolarHBondContact OD1-N 3.25Å; D150-S152 PolarHBondContact OD1-OG 3.33Å; D150-S152 PolarHBondContact OD2-OG 3.48Å; D150-Q153 PolarHBondContact O-N 2.97Å | ||
| 151 | P | 49.8 | Very low | 48.8 | Very low | 107 Ų | 107 | 136.9 Ų | 136.9 | 70% | 0.695 | 75% | 0.751 | S | S | * | * | G | 310 helix | trans | -59 | -5.1 | -175.6 | -23.6 | 33.3 | 0 | 0 | 0 | 114.2 | E149 | E149-P151 WeakPolarHBondContact O-CD 3.31Å; E149-P151 VanDerWaalsContact O-N 3.09Å |
| 152 | S | 53.1 | Low | 47.8 | Very low | 87 Ų | 87 | 133.4 Ų | 133.4 | 61% | 0.608 | 75% | 0.753 | S | S | * | * | G | 310 helix | trans | -79.4 | -7.8 | 178.8 | 58 | 0 | 0 | 0 | 0 | 115.2 | D150 | D150-S152 PolarHBondContact O-N 3.11Å; D150-S152 WeakPolarHBondContact OD1-CB 3.42Å; D150-S152 PolarHBondContact OD1-N 3.25Å; D150-S152 PolarHBondContact OD1-OG 3.33Å; D150-S152 PolarHBondContact OD2-OG 3.48Å |
| 153 | Q | 47.6 | Very low | 46.7 | Very low | 174 Ų | 174 | 128.8 Ų | 128.8 | 81% | 0.813 | 75% | 0.751 | S | S | * | * | G | 310 helix | trans | -96.6 | 8.3 | 179.4 | -66.9 | -158.3 | -28.3 | 0 | 0 | 115.6 | D150 P155 | D150-Q153 PolarHBondContact O-N 2.97Å; Q153-P155 WeakPolarHBondContact O-CD 3.45Å |
| 154 | L | 46.6 | Very low | 45.8 | Very low | 143 Ų | 143 | 126.2 Ų | 126.2 | 75% | 0.749 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 122.8 | 174 | -75 | 160.1 | 0 | 0 | 0 | 110.6 | ||
| 155 | P | 46 | Very low | 44.8 | Very low | 109 Ų | 109 | 133.9 Ų | 133.9 | 71% | 0.708 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 149.8 | 170.6 | 25.6 | -30.9 | 0 | 0 | 0 | 110.4 | Q153 K157 | Q153-P155 WeakPolarHBondContact O-CD 3.45Å; P155-K157 PolarHBondContact O-N 3.31Å |
| 156 | P | 39.5 | Very low | 44 | Very low | 120 Ų | 120 | 133.9 Ų | 133.9 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 136.6 | -173.5 | -20.3 | 30.7 | 0 | 0 | 0 | 112.2 | D158 | P156-D158 PolarHBondContact O-N 2.95Š|
| 157 | K | 45.4 | Very low | 43.2 | Very low | 213 Ų | 213 | 133.7 Ų | 133.7 | 93% | 0.926 | 77% | 0.772 | S | S | * | * | trans | -68.4 | 93.5 | 170.2 | -87.5 | -177.1 | 170.1 | 171.4 | 0 | 109.7 | P155 | P155-K157 PolarHBondContact O-N 3.31Š| ||
| 158 | D | 37.9 | Very low | 42.3 | Very low | 154 Ų | 154 | 135 Ų | 135 | 82% | 0.824 | 77% | 0.773 | S | S | * | * | trans | -103.9 | 129.9 | 155.1 | -82.5 | -39.5 | 0 | 0 | 0 | 109.6 | P156 | P156-D158 PolarHBondContact O-N 2.95Š| ||
| 159 | G | 44.4 | Very low | 41.6 | Very low | 70 Ų | 70 | 134.2 Ų | 134.2 | 72% | 0.722 | 77% | 0.765 | S | S | * | * | trans | -72.5 | 149.2 | -159.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 160 | T | 32.8 | Very low | 40.9 | Very low | 142 Ų | 142 | 134.4 Ų | 134.4 | 87% | 0.871 | 77% | 0.766 | S | S | * | * | trans | 178.4 | 154.9 | 144 | 23.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 161 | P | 37.1 | Very low | 40.2 | Very low | 122 Ų | 122 | 138.6 Ų | 138.6 | 79% | 0.792 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -77.9 | 144.5 | -147 | 28.7 | -33.7 | 0 | 0 | 0 | 115.1 | ||
| 162 | A | 40.7 | Very low | 39.7 | Very low | 93 Ų | 93 | 145.7 Ų | 145.7 | 77% | 0.769 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -67.3 | 134.3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 163 | P | 36.8 | Very low | 39 | Very low | 122 Ų | 122 | 148.6 Ų | 148.6 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 128.2 | 165.1 | -10.1 | 25.8 | 0 | 0 | 0 | 109.5 | ||
| 164 | G | 35.1 | Very low | 38.6 | Very low | 73 Ų | 73 | 147.3 Ų | 147.3 | 75% | 0.753 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 143.5 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 165 | Y | 32.8 | Very low | 38.1 | Very low | 229 Ų | 229 | 147.5 Ų | 147.5 | 90% | 0.898 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -81.4 | 126.8 | 162.6 | -85.5 | -92.9 | 0 | 0 | 0 | 109.5 | S167 | Y165-S167 PolarHBondContact O-N 3.36Š|
| 166 | P | 37.6 | Very low | 37.7 | Very low | 102 Ų | 102 | 149.8 Ų | 149.8 | 66% | 0.662 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 118.7 | 167.1 | -7.5 | 23.4 | 0 | 0 | 0 | 109.9 | Y168 | P166-Y168 HydrophobicContact CB-CE2 4.32Å; P166-Y168 PolarHBondContact O-N 2.98Å |
| 167 | S | 38.3 | Very low | 37.6 | Very low | 110 Ų | 110 | 151.6 Ų | 151.6 | 77% | 0.769 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 119.1 | 162.8 | 47.6 | 0 | 0 | 0 | 0 | 110.1 | Y165 | Y165-S167 PolarHBondContact O-N 3.36Š|
| 168 | Y | 36.8 | Very low | 37 | Very low | 220 Ų | 220 | 147.5 Ų | 147.5 | 86% | 0.863 | 81% | 0.813 | S | S | * | * | trans | -94.9 | 113 | 169.7 | -92.8 | -84.5 | 0 | 0 | 0 | 111.4 | P166 | P166-Y168 HydrophobicContact CB-CE2 4.32Å; P166-Y168 PolarHBondContact O-N 2.98Å | ||
| 169 | Q | 36.7 | Very low | 37 | Very low | 146 Ų | 146 | 147.1 Ų | 147.1 | 68% | 0.682 | 81% | 0.812 | S | S | * | * | trans | -56.1 | 131.6 | 172.8 | -92.5 | 158.4 | -60.7 | 0 | 0 | 113.2 | Y171 | Q169-Y171 HydrophobicContact CB-CD2 4.17Å; Q169-Y171 HydrophobicContact CB-CE2 4.27Å | ||
| 170 | Q | 35.7 | Very low | 36.4 | Very low | 188 Ų | 188 | 153 Ų | 153 | 88% | 0.879 | 82% | 0.819 | S | S | * | * | trans | -36.4 | 122.7 | 143.1 | -177.4 | 172.1 | -16 | 0 | 0 | 112.9 | ||||
| 171 | Y | 34 | Very low | 36.7 | Very low | 186 Ų | 186 | 153.9 Ų | 153.9 | 73% | 0.729 | 81% | 0.814 | S | S | * | * | trans | -145 | 150.4 | 159.5 | -94.9 | -80.5 | 0 | 0 | 0 | 111.7 | Q169 | Q169-Y171 HydrophobicContact CB-CD2 4.17Å; Q169-Y171 HydrophobicContact CB-CE2 4.27Å | ||
| 172 | H | 39.3 | Very low | 36.7 | Very low | 256 Ų | 256 | 156.8 Ų | 156.8 | 100% | 1.185 | 82% | 0.816 | S | S | * | * | trans | -54.5 | 0 | -168.2 | -70.7 | -95.7 | 0 | 0 | 0 | 117.2 |
Retrieved 172 of 172 residues in 29.7 ms
(Link to these results)