| 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 | 66.3 | Low | 79.5 | Confident | 201 Ų | 201 | 125.2 Ų | 125.2 | 99% | 0.99 | 61% | 0.607 | S | S | * | * | 0 | -51.6 | 0 | -154.5 | -167.7 | -70.5 | 0 | 0 | 111.3 | L5 | M1-L5 PolarHBondContact O-N 2.81Š| |||
| 2 | L | 70.7 | Confident | 80.2 | Confident | 151 Ų | 151 | 122.8 Ų | 122.8 | 79% | 0.791 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -66.5 | -42.1 | 177.4 | -71.5 | 166.9 | 0 | 0 | 0 | 113.8 | T4 L5 R6 | L2-T4 VanDerWaalsContact C-N 3.34Å; L2-T4 PolarHBondContact O-N 3.42Å; L2-L5 PolarHBondContact O-N 3.3Å; L2-L5 VanDerWaalsContact O-N 3.16Å; L2-R6 PolarHBondContact O-N 2.94Å |
| 3 | E | 74.2 | Confident | 80.8 | Confident | 113 Ų | 113 | 123 Ų | 123 | 53% | 0.528 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -59.2 | -43.9 | 177.3 | -144.4 | 67.9 | -140 | 0 | 0 | 112.1 | L5 R6 E7 | E3-L5 VanDerWaalsContact C-N 3.27Å; E3-L5 PolarHBondContact O-N 3.02Å; E3-R6 WeakPolarHBondContact O-CB 3.32Å; E3-R6 PolarHBondContact O-N 2.9Å; E3-R6 IonicContact OE1-NH1 3.44Å; E3-R6 PolarHBondContact OE1-NH1 2.98Å; E3-E7 WeakPolarHBondContact O-CG 3.47Å; E3-E7 PolarHBondContact O-N 3.35Å |
| 4 | T | 77.9 | Confident | 81.3 | Confident | 70 Ų | 70 | 123.3 Ų | 123.3 | 43% | 0.429 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.8 | -31.6 | 178.1 | -38.3 | 0 | 0 | 0 | 0 | 112.7 | L2 R8 | L2-T4 VanDerWaalsContact C-N 3.34Å; L2-T4 PolarHBondContact O-N 3.42Å; T4-R8 WeakPolarHBondContact O-CB 3.43Å; T4-R8 VanDerWaalsContact O-CG 3.3Å; T4-R8 WeakPolarHBondContact O-CG 3.43Å; T4-R8 PolarHBondContact O-N 3.28Å; T4-R8 VanDerWaalsContact O-N 3.14Å |
| 5 | L | 79.4 | Confident | 81.7 | Confident | 118 Ų | 118 | 121.7 Ų | 121.7 | 62% | 0.618 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -78.9 | -35.4 | 178.7 | -150.2 | 144 | 0 | 0 | 0 | 110.8 | M1 L2 E3 L9 | M1-L5 PolarHBondContact O-N 2.81Å; L2-L5 PolarHBondContact O-N 3.3Å; L2-L5 VanDerWaalsContact O-N 3.16Å; E3-L5 VanDerWaalsContact C-N 3.27Å; E3-L5 PolarHBondContact O-N 3.02Å; L5-L9 WeakPolarHBondContact O-CB 3.44Å; L5-L9 PolarHBondContact O-N 3.26Å |
| 6 | R | 82.6 | Confident | 82.3 | Confident | 156 Ų | 156 | 123.9 Ų | 123.9 | 59% | 0.589 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -64.4 | -45.3 | 171.1 | -175.4 | -177.5 | -177.7 | -159.2 | 2.6 | 111.8 | L2 E3 L9 L10 | L2-R6 PolarHBondContact O-N 2.94Å; E3-R6 WeakPolarHBondContact O-CB 3.32Å; E3-R6 PolarHBondContact O-N 2.9Å; E3-R6 IonicContact OE1-NH1 3.44Å; E3-R6 PolarHBondContact OE1-NH1 2.98Å; R6-L9 PolarHBondContact O-N 3.11Å; R6-L10 HydrophobicContact CG-CD1 4.15Å; R6-L10 WeakPolarHBondContact O-CB 3.29Å; R6-L10 PolarHBondContact O-N 2.82Å |
| 7 | E | 83.9 | Confident | 82.8 | Confident | 124 Ų | 124 | 121 Ų | 121 | 58% | 0.579 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -61.7 | -42.9 | 175.3 | -75.1 | 173.6 | 171.1 | 0 | 0 | 112 | E3 L10 S11 | E3-E7 WeakPolarHBondContact O-CG 3.47Å; E3-E7 PolarHBondContact O-N 3.35Å; E7-L10 PolarHBondContact O-N 3.07Å; E7-S11 WeakPolarHBondContact O-CB 3.37Å; E7-S11 PolarHBondContact O-N 3.34Å |
| 8 | R | 84.8 | Confident | 83.2 | Confident | 181 Ų | 181 | 117.2 Ų | 117.2 | 68% | 0.683 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -64.9 | -40.7 | 175.2 | -76.7 | 178.5 | -178.5 | -169 | 0.3 | 112.8 | T4 S11 V12 | T4-R8 WeakPolarHBondContact O-CB 3.43Å; T4-R8 VanDerWaalsContact O-CG 3.3Å; T4-R8 WeakPolarHBondContact O-CG 3.43Å; T4-R8 PolarHBondContact O-N 3.28Å; T4-R8 VanDerWaalsContact O-N 3.14Å; R8-S11 PolarHBondContact O-N 3.03Å; R8-V12 WeakPolarHBondContact O-CB 3.46Å; R8-V12 VanDerWaalsContact O-CG2 3.27Å; R8-V12 WeakPolarHBondContact O-CG2 3.11Å; R8-V12 PolarHBondContact O-N 3.41Å |
| 9 | L | 84.4 | Confident | 83.7 | Confident | 113 Ų | 113 | 112.6 Ų | 112.6 | 59% | 0.592 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -66.8 | -40.6 | 176.7 | -171.6 | 71.6 | 0 | 0 | 0 | 111.3 | L5 R6 V12 Q13 | L5-L9 WeakPolarHBondContact O-CB 3.44Å; L5-L9 PolarHBondContact O-N 3.26Å; R6-L9 PolarHBondContact O-N 3.11Å; L9-V12 PolarHBondContact O-N 2.66Å; L9-Q13 VanDerWaalsContact O-CB 3.25Å; L9-Q13 WeakPolarHBondContact O-CB 3.48Å; L9-Q13 PolarHBondContact O-N 2.88Å |
| 10 | L | 84.8 | Confident | 84.3 | Confident | 97 Ų | 97 | 114.8 Ų | 114.8 | 51% | 0.508 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -62.7 | -43.2 | 173.7 | -109.6 | 133.7 | 0 | 0 | 0 | 111.7 | R6 E7 Q13 Q14 | R6-L10 HydrophobicContact CG-CD1 4.15Å; R6-L10 WeakPolarHBondContact O-CB 3.29Å; R6-L10 PolarHBondContact O-N 2.82Å; E7-L10 PolarHBondContact O-N 3.07Å; L10-Q13 PolarHBondContact O-N 2.94Å; L10-Q14 WeakPolarHBondContact O-CB 3.28Å; L10-Q14 PolarHBondContact O-N 3.3Å |
| 11 | S | 86.1 | Confident | 84.8 | Confident | 53 Ų | 53 | 115.7 Ų | 115.7 | 37% | 0.371 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61 | -50 | 174.7 | -170.4 | 0 | 0 | 0 | 0 | 111.1 | E7 R8 Q13 Q14 D15 | E7-S11 WeakPolarHBondContact O-CB 3.37Å; E7-S11 PolarHBondContact O-N 3.34Å; R8-S11 PolarHBondContact O-N 3.03Å; S11-Q13 VanDerWaalsContact C-N 3.32Å; S11-Q13 PolarHBondContact O-N 3.49Å; S11-Q14 PolarHBondContact O-N 3.48Å; S11-D15 WeakPolarHBondContact O-CB 3.43Å; S11-D15 PolarHBondContact O-N 2.98Å; S11-D15 VanDerWaalsContact O-OD2 3.12Å; S11-D15 PolarHBondContact OG-OD2 3.47Å |
| 12 | V | 87.8 | Confident | 86.1 | Confident | 96 Ų | 96 | 110.9 Ų | 110.9 | 58% | 0.582 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.6 | -39.7 | 179.2 | 170.5 | 0 | 0 | 0 | 0 | 111.6 | R8 L9 F16 | R8-V12 WeakPolarHBondContact O-CB 3.46Å; R8-V12 VanDerWaalsContact O-CG2 3.27Å; R8-V12 WeakPolarHBondContact O-CG2 3.11Å; R8-V12 PolarHBondContact O-N 3.41Å; L9-V12 PolarHBondContact O-N 2.66Å; V12-F16 VanDerWaalsContact O-CB 3.25Å; V12-F16 WeakPolarHBondContact O-CB 3.46Å; V12-F16 PolarHBondContact O-N 3.17Å |
| 13 | Q | 87.3 | Confident | 87.3 | Confident | 126 Ų | 126 | 107.8 Ų | 107.8 | 59% | 0.589 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.7 | -43.5 | 176.1 | -175.4 | 176.9 | -29.1 | 0 | 0 | 111.2 | L9 L10 S11 F16 T17 | L9-Q13 VanDerWaalsContact O-CB 3.25Å; L9-Q13 WeakPolarHBondContact O-CB 3.48Å; L9-Q13 PolarHBondContact O-N 2.88Å; L10-Q13 PolarHBondContact O-N 2.94Å; S11-Q13 VanDerWaalsContact C-N 3.32Å; S11-Q13 PolarHBondContact O-N 3.49Å; Q13-F16 PolarHBondContact O-N 3.33Å; Q13-T17 WeakPolarHBondContact O-CG2 3.34Å; Q13-T17 PolarHBondContact O-N 3.49Å; Q13-T17 PolarHBondContact O-OG1 3.31Å |
| 14 | Q | 87.6 | Confident | 88.3 | Confident | 127 Ų | 127 | 108.8 Ų | 108.8 | 59% | 0.593 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -63.6 | -44.6 | 177.1 | -175.8 | 171 | 1 | 0 | 0 | 111.5 | L10 S11 T17 S18 | L10-Q14 WeakPolarHBondContact O-CB 3.28Å; L10-Q14 PolarHBondContact O-N 3.3Å; S11-Q14 PolarHBondContact O-N 3.48Å; Q14-T17 WeakPolarHBondContact CA-OG1 3.31Å; Q14-T17 PolarHBondContact O-N 2.81Å; Q14-T17 PolarHBondContact O-OG1 2.97Å; Q14-S18 VanDerWaalsContact O-CB 3.29Å; Q14-S18 WeakPolarHBondContact O-CB 3.36Å; Q14-S18 PolarHBondContact O-N 2.93Å |
| 15 | D | 87.9 | Confident | 89.2 | Confident | 100 Ų | 100 | 106.9 Ų | 106.9 | 54% | 0.535 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.6 | -41.1 | 176.9 | -65.6 | -24.9 | 0 | 0 | 0 | 111.1 | S11 G19 | S11-D15 WeakPolarHBondContact O-CB 3.43Å; S11-D15 PolarHBondContact O-N 2.98Å; S11-D15 VanDerWaalsContact O-OD2 3.12Å; S11-D15 PolarHBondContact OG-OD2 3.47Å; D15-G19 PolarHBondContact O-N 3.49Å |
| 16 | F | 90.8 | Very high | 90.1 | Very high | 157 Ų | 157 | 102.6 Ų | 102.6 | 69% | 0.689 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -65 | -44.6 | 175.1 | -177.1 | -96 | 0 | 0 | 0 | 112 | V12 Q13 Y20 | V12-F16 VanDerWaalsContact O-CB 3.25Å; V12-F16 WeakPolarHBondContact O-CB 3.46Å; V12-F16 PolarHBondContact O-N 3.17Å; Q13-F16 PolarHBondContact O-N 3.33Å; F16-Y20 PolarHBondContact O-N 3.36Å |
| 17 | T | 90.7 | Very high | 90.7 | Very high | 74 Ų | 74 | 99.8 Ų | 99.8 | 45% | 0.454 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.7 | -41.1 | 177.2 | 48.9 | 0 | 0 | 0 | 0 | 112.2 | Q13 Q14 Y20 E21 | Q13-T17 WeakPolarHBondContact O-CG2 3.34Å; Q13-T17 PolarHBondContact O-N 3.49Å; Q13-T17 PolarHBondContact O-OG1 3.31Å; Q14-T17 WeakPolarHBondContact CA-OG1 3.31Å; Q14-T17 PolarHBondContact O-N 2.81Å; Q14-T17 PolarHBondContact O-OG1 2.97Å; T17-Y20 PolarHBondContact O-N 3.36Å; T17-E21 WeakPolarHBondContact O-CB 3.42Å; T17-E21 PolarHBondContact O-N 2.88Å |
| 18 | S | 91.3 | Very high | 91.4 | Very high | 52 Ų | 52 | 98.3 Ų | 98.3 | 36% | 0.364 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 176.7 | -170.7 | 0 | 0 | 0 | 0 | 111 | Q14 Y20 E21 D22 | Q14-S18 VanDerWaalsContact O-CB 3.29Å; Q14-S18 WeakPolarHBondContact O-CB 3.36Å; Q14-S18 PolarHBondContact O-N 2.93Å; S18-Y20 VanDerWaalsContact C-N 3.33Å; S18-Y20 PolarHBondContact O-N 2.86Å; S18-E21 PolarHBondContact O-N 3.26Å; S18-D22 WeakPolarHBondContact O-CB 3.47Å; S18-D22 VanDerWaalsContact O-CG 3.28Å; S18-D22 PolarHBondContact O-N 3.49Å |
| 19 | G | 92.3 | Very high | 92 | Very high | 31 Ų | 31 | 97 Ų | 97 | 32% | 0.32 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.8 | -37.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | D15 T23 | D15-G19 PolarHBondContact O-N 3.49Å; G19-T23 WeakPolarHBondContact O-CB 3.39Å; G19-T23 VanDerWaalsContact O-CG2 3.29Å; G19-T23 WeakPolarHBondContact O-CG2 3.4Å; G19-T23 PolarHBondContact O-N 3.26Å; G19-T23 PolarHBondContact O-OG1 3.05Å |
| 20 | Y | 94.4 | Very high | 92.6 | Very high | 155 Ų | 155 | 99.3 Ų | 99.3 | 61% | 0.608 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -67.4 | -43.2 | 173.2 | -175 | -93.8 | 0 | 0 | 0 | 112 | F16 T17 S18 T23 W24 | F16-Y20 PolarHBondContact O-N 3.36Å; T17-Y20 PolarHBondContact O-N 3.36Å; S18-Y20 VanDerWaalsContact C-N 3.33Å; S18-Y20 PolarHBondContact O-N 2.86Å; Y20-T23 WeakPolarHBondContact CA-OG1 3.49Å; Y20-T23 PolarHBondContact O-N 3.42Å; Y20-T23 PolarHBondContact O-OG1 3.37Å; Y20-W24 VanDerWaalsContact O-CB 3.25Å; Y20-W24 WeakPolarHBondContact O-CB 3.4Å; Y20-W24 PolarHBondContact O-N 3.49Å |
| 21 | E | 95 | Very high | 93.3 | Very high | 135 Ų | 135 | 97.3 Ų | 97.3 | 63% | 0.631 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.7 | -45.5 | 176.3 | -173.6 | 175 | 176.1 | 0 | 0 | 111.7 | T17 S18 W24 A25 | T17-E21 WeakPolarHBondContact O-CB 3.42Å; T17-E21 PolarHBondContact O-N 2.88Å; S18-E21 PolarHBondContact O-N 3.26Å; E21-W24 PolarHBondContact O-N 2.88Å; E21-A25 VanDerWaalsContact O-CB 3.31Å; E21-A25 WeakPolarHBondContact O-CB 3.29Å; E21-A25 PolarHBondContact O-N 3.45Å |
| 22 | D | 94.9 | Very high | 93.8 | Very high | 99 Ų | 99 | 101.8 Ų | 101.8 | 53% | 0.529 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.1 | -43.6 | 178.7 | -73.3 | -34.6 | 0 | 0 | 0 | 112.2 | S18 A25 A26 | S18-D22 WeakPolarHBondContact O-CB 3.47Å; S18-D22 VanDerWaalsContact O-CG 3.28Å; S18-D22 PolarHBondContact O-N 3.49Å; D22-A25 PolarHBondContact O-N 3.3Å; D22-A26 VanDerWaalsContact O-CB 3.3Å; D22-A26 WeakPolarHBondContact O-CB 3.35Å; D22-A26 PolarHBondContact O-N 2.97Å |
| 23 | T | 95.6 | Very high | 94.3 | Very high | 86 Ų | 86 | 102.2 Ų | 102.2 | 53% | 0.528 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.5 | -38.5 | 177.3 | 50.5 | 0 | 0 | 0 | 0 | 112 | G19 Y20 A26 L27 | G19-T23 WeakPolarHBondContact O-CB 3.39Å; G19-T23 VanDerWaalsContact O-CG2 3.29Å; G19-T23 WeakPolarHBondContact O-CG2 3.4Å; G19-T23 PolarHBondContact O-N 3.26Å; G19-T23 PolarHBondContact O-OG1 3.05Å; Y20-T23 WeakPolarHBondContact CA-OG1 3.49Å; Y20-T23 PolarHBondContact O-N 3.42Å; Y20-T23 PolarHBondContact O-OG1 3.37Å; T23-A26 PolarHBondContact O-N 3.01Å; T23-L27 WeakPolarHBondContact O-CB 3.44Å; T23-L27 PolarHBondContact O-N 2.88Å |
| 24 | W | 95.9 | Very high | 94.8 | Very high | 134 Ų | 134 | 100.6 Ų | 100.6 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -65.9 | -45.1 | 174.6 | -169.9 | 90 | 0 | 0 | 0 | 111.5 | Y20 E21 A26 L27 H28 | Y20-W24 VanDerWaalsContact O-CB 3.25Å; Y20-W24 WeakPolarHBondContact O-CB 3.4Å; Y20-W24 PolarHBondContact O-N 3.49Å; E21-W24 PolarHBondContact O-N 2.88Å; W24-A26 VanDerWaalsContact C-N 3.34Å; W24-A26 PolarHBondContact O-N 3.45Å; W24-L27 WeakPolarHBondContact O-CB 3.35Å; W24-L27 PolarHBondContact O-N 2.72Å; W24-H28 AromaticContact CD2-CD2 3.36Å; W24-H28 AromaticContact CD2-NE2 3.71Å; W24-H28 AromaticContact CE2-CD2 3.29Å; W24-H28 AromaticContact CE2-NE2 3.07Å; W24-H28 AromaticContact CE3-CD2 3.48Å; W24-H28 VanDerWaalsContact CE3-CD2 3.48Å; W24-H28 AromaticContact CH2-CD2 3.5Å; W24-H28 AromaticContact CH2-CE1 3.99Å; W24-H28 AromaticContact CH2-NE2 3.32Å; W24-H28 VanDerWaalsContact CH2-NE2 3.32Å; W24-H28 WeakPolarHBondContact CH2-NE2 3.48Å; W24-H28 AromaticContact CZ2-CD2 3.42Å; W24-H28 VanDerWaalsContact CZ2-CD2 3.42Å; W24-H28 WeakPolarHBondContact CZ2-CD2 3.4Å; W24-H28 AromaticContact CZ2-CE1 3.81Å; W24-H28 AromaticContact CZ2-NE2 2.9Å; W24-H28 WeakPolarHBondContact CZ2-NE2 3.48Å; W24-H28 AromaticContact CZ3-CD2 3.53Å; W24-H28 AromaticContact CZ3-NE2 3.87Å; W24-H28 AromaticContact NE1-CD2 3.9Å; W24-H28 AromaticContact NE1-NE2 3.56Å; W24-H28 PolarHBondContact O-CD2 2.74Å; W24-H28 PolarHBondContact O-N 2.99Å |
| 25 | A | 96.6 | Very high | 95.3 | Very high | 30 Ų | 30 | 97 Ų | 97 | 25% | 0.248 | 50% | 0.499 | C | S | . | . | H | α-helix | trans | -61.5 | -41.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | E21 D22 H28 R29 | E21-A25 VanDerWaalsContact O-CB 3.31Å; E21-A25 WeakPolarHBondContact O-CB 3.29Å; E21-A25 PolarHBondContact O-N 3.45Å; D22-A25 PolarHBondContact O-N 3.3Å; A25-H28 PolarHBondContact O-N 2.89Å; A25-R29 WeakPolarHBondContact O-CG 3.42Å; A25-R29 PolarHBondContact O-N 3.35Å |
| 26 | A | 96.6 | Very high | 95.7 | Very high | 29 Ų | 29 | 95.1 Ų | 95.1 | 24% | 0.24 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -66.2 | -36.1 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | D22 T23 W24 R30 | D22-A26 VanDerWaalsContact O-CB 3.3Å; D22-A26 WeakPolarHBondContact O-CB 3.35Å; D22-A26 PolarHBondContact O-N 2.97Å; T23-A26 PolarHBondContact O-N 3.01Å; W24-A26 VanDerWaalsContact C-N 3.34Å; W24-A26 PolarHBondContact O-N 3.45Å; A26-R30 WeakPolarHBondContact O-CB 3.44Å; A26-R30 WeakPolarHBondContact O-CG 3.43Å; A26-R30 PolarHBondContact O-N 3.21Å; A26-R30 VanDerWaalsContact O-N 3.07Å; A26-R30 PolarHBondContact O-NE 3.04Å |
| 27 | L | 96.9 | Very high | 96.1 | Very high | 96 Ų | 96 | 90.4 Ų | 90.4 | 50% | 0.503 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.5 | -45.8 | 173.9 | -178.3 | 63.5 | 0 | 0 | 0 | 111.3 | T23 W24 R30 A31 | T23-L27 WeakPolarHBondContact O-CB 3.44Å; T23-L27 PolarHBondContact O-N 2.88Å; W24-L27 WeakPolarHBondContact O-CB 3.35Å; W24-L27 PolarHBondContact O-N 2.72Å; L27-R30 PolarHBondContact O-N 3.14Å; L27-A31 WeakPolarHBondContact O-CB 3.38Å; L27-A31 PolarHBondContact O-N 2.89Å |
| 28 | H | 97.5 | Very high | 96.5 | Very high | 93 Ų | 93 | 88.7 Ų | 88.7 | 43% | 0.431 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.1 | -43.4 | 177.1 | -89.6 | -79.7 | 0 | 0 | 0 | 113 | W24 A25 R30 A31 K32 | W24-H28 AromaticContact CD2-CD2 3.36Å; W24-H28 AromaticContact CD2-NE2 3.71Å; W24-H28 AromaticContact CE2-CD2 3.29Å; W24-H28 AromaticContact CE2-NE2 3.07Å; W24-H28 AromaticContact CE3-CD2 3.48Å; W24-H28 VanDerWaalsContact CE3-CD2 3.48Å; W24-H28 AromaticContact CH2-CD2 3.5Å; W24-H28 AromaticContact CH2-CE1 3.99Å; W24-H28 AromaticContact CH2-NE2 3.32Å; W24-H28 VanDerWaalsContact CH2-NE2 3.32Å; W24-H28 WeakPolarHBondContact CH2-NE2 3.48Å; W24-H28 AromaticContact CZ2-CD2 3.42Å; W24-H28 VanDerWaalsContact CZ2-CD2 3.42Å; W24-H28 WeakPolarHBondContact CZ2-CD2 3.4Å; W24-H28 AromaticContact CZ2-CE1 3.81Å; W24-H28 AromaticContact CZ2-NE2 2.9Å; W24-H28 WeakPolarHBondContact CZ2-NE2 3.48Å; W24-H28 AromaticContact CZ3-CD2 3.53Å; W24-H28 AromaticContact CZ3-NE2 3.87Å; W24-H28 AromaticContact NE1-CD2 3.9Å; W24-H28 AromaticContact NE1-NE2 3.56Å; W24-H28 PolarHBondContact O-CD2 2.74Å; W24-H28 PolarHBondContact O-N 2.99Å; A25-H28 PolarHBondContact O-N 2.89Å; H28-R30 PolarHBondContact O-N 3.14Å; H28-A31 PolarHBondContact O-N 2.87Å; H28-K32 WeakPolarHBondContact O-CB 3.33Å; H28-K32 PolarHBondContact O-N 3.15Å |
| 29 | R | 97.8 | Very high | 96.8 | Very high | 153 Ų | 153 | 92.4 Ų | 92.4 | 58% | 0.577 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -57.1 | -50.7 | 173.3 | -76.3 | -165.3 | -60.1 | -90.2 | 1 | 110.9 | A25 A31 K32 D33 | A25-R29 WeakPolarHBondContact O-CG 3.42Å; A25-R29 PolarHBondContact O-N 3.35Å; R29-A31 VanDerWaalsContact C-N 3.34Å; R29-A31 PolarHBondContact O-N 3.25Å; R29-K32 WeakPolarHBondContact O-CB 3.2Å; R29-K32 PolarHBondContact O-N 2.94Å; R29-K32 VanDerWaalsContact O-N 3.15Å; R29-D33 PolarHBondContact O-N 3.31Å |
| 30 | R | 97.6 | Very high | 97.1 | Very high | 163 Ų | 163 | 95.8 Ų | 95.8 | 62% | 0.615 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -61.6 | -39 | 177.5 | -74.7 | -174.4 | -66.1 | 169.3 | -0.5 | 113.2 | A26 L27 H28 K32 D33 C34 | A26-R30 WeakPolarHBondContact O-CB 3.44Å; A26-R30 WeakPolarHBondContact O-CG 3.43Å; A26-R30 PolarHBondContact O-N 3.21Å; A26-R30 VanDerWaalsContact O-N 3.07Å; A26-R30 PolarHBondContact O-NE 3.04Å; L27-R30 PolarHBondContact O-N 3.14Å; H28-R30 PolarHBondContact O-N 3.14Å; R30-K32 VanDerWaalsContact C-N 3.33Å; R30-D33 PolarHBondContact O-N 3.19Å; R30-C34 WeakPolarHBondContact O-CB 3.16Å; R30-C34 PolarHBondContact O-N 2.8Å |
| 31 | A | 97.8 | Very high | 97.3 | Very high | 55 Ų | 55 | 92.3 Ų | 92.3 | 46% | 0.455 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64.2 | -40.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | L27 H28 R29 C34 A35 | L27-A31 WeakPolarHBondContact O-CB 3.38Å; L27-A31 PolarHBondContact O-N 2.89Å; H28-A31 PolarHBondContact O-N 2.87Å; R29-A31 VanDerWaalsContact C-N 3.34Å; R29-A31 PolarHBondContact O-N 3.25Å; A31-C34 PolarHBondContact O-N 3.1Å; A31-A35 WeakPolarHBondContact O-CB 3.41Å; A31-A35 PolarHBondContact O-N 3.44Å |
| 32 | K | 97.8 | Very high | 97.4 | Very high | 147 Ų | 147 | 90.9 Ų | 90.9 | 64% | 0.639 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -65.7 | -47.6 | 174.8 | -172.7 | 178.7 | -178.8 | 179.4 | 0 | 111.8 | H28 R29 R30 C34 A35 S36 | H28-K32 WeakPolarHBondContact O-CB 3.33Å; H28-K32 PolarHBondContact O-N 3.15Å; R29-K32 WeakPolarHBondContact O-CB 3.2Å; R29-K32 PolarHBondContact O-N 2.94Å; R29-K32 VanDerWaalsContact O-N 3.15Å; R30-K32 VanDerWaalsContact C-N 3.33Å; K32-C34 VanDerWaalsContact C-N 3.28Å; K32-C34 PolarHBondContact O-N 3.18Å; K32-A35 PolarHBondContact O-N 2.94Å; K32-A35 VanDerWaalsContact O-N 3.15Å; K32-S36 PolarHBondContact O-N 3.22Å; K32-S36 PolarHBondContact O-OG 3.25Å |
| 33 | D | 97.6 | Very high | 97.6 | Very high | 105 Ų | 105 | 89.5 Ų | 89.5 | 56% | 0.561 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.4 | -40.2 | 177.7 | -61.8 | -22.7 | 0 | 0 | 0 | 110.8 | R29 R30 S36 A37 | R29-D33 PolarHBondContact O-N 3.31Å; R30-D33 PolarHBondContact O-N 3.19Å; D33-S36 PolarHBondContact O-N 3.41Å; D33-A37 WeakPolarHBondContact O-CB 3.39Å; D33-A37 PolarHBondContact O-N 2.93Å |
| 34 | C | 97.8 | Very high | 97.7 | Very high | 91 Ų | 91 | 91.1 Ų | 91.1 | 62% | 0.615 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -64.1 | -41.4 | 174.4 | -172.8 | 0 | 0 | 0 | 0 | 112.2 | R30 A31 K32 G38 | R30-C34 WeakPolarHBondContact O-CB 3.16Å; R30-C34 PolarHBondContact O-N 2.8Å; A31-C34 PolarHBondContact O-N 3.1Å; K32-C34 VanDerWaalsContact C-N 3.28Å; K32-C34 PolarHBondContact O-N 3.18Å; C34-G38 PolarHBondContact O-N 3.48Å |
| 35 | A | 98.2 | Very high | 97.8 | Very high | 53 Ų | 53 | 88.5 Ų | 88.5 | 44% | 0.438 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.1 | -46.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | A31 K32 A37 G38 E39 | A31-A35 WeakPolarHBondContact O-CB 3.41Å; A31-A35 PolarHBondContact O-N 3.44Å; K32-A35 PolarHBondContact O-N 2.94Å; K32-A35 VanDerWaalsContact O-N 3.15Å; A35-A37 PolarHBondContact O-N 2.92Å; A35-G38 WeakPolarHBondContact O-CA 3.4Å; A35-G38 PolarHBondContact O-N 2.9Å; A35-G38 VanDerWaalsContact O-N 3.1Å; A35-E39 WeakPolarHBondContact O-CG 3.36Å; A35-E39 PolarHBondContact O-N 2.92Å |
| 36 | S | 97.8 | Very high | 97.9 | Very high | 60 Ų | 60 | 91.1 Ų | 91.1 | 42% | 0.42 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64 | -37.9 | 177.3 | -63.3 | 0 | 0 | 0 | 0 | 112.9 | K32 D33 G38 E39 L40 | K32-S36 PolarHBondContact O-N 3.22Å; K32-S36 PolarHBondContact O-OG 3.25Å; D33-S36 PolarHBondContact O-N 3.41Å; S36-G38 VanDerWaalsContact C-N 3.33Å; S36-E39 PolarHBondContact O-N 3.45Å; S36-L40 PolarHBondContact O-N 2.85Å; S36-L40 VanDerWaalsContact O-N 3.16Å |
| 37 | A | 98.1 | Very high | 98 | Very high | 57 Ų | 57 | 96.4 Ų | 96.4 | 47% | 0.471 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.8 | -38.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | D33 A35 L40 V41 | D33-A37 WeakPolarHBondContact O-CB 3.39Å; D33-A37 PolarHBondContact O-N 2.93Å; A35-A37 PolarHBondContact O-N 2.92Å; A37-L40 PolarHBondContact O-N 3.22Å; A37-V41 WeakPolarHBondContact O-CG2 3.42Å; A37-V41 PolarHBondContact O-N 3.29Å; A37-V41 VanDerWaalsContact O-N 3.13Å |
| 38 | G | 98.4 | Very high | 98.1 | Very high | 39 Ų | 39 | 97.6 Ų | 97.6 | 40% | 0.402 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.4 | -44.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | C34 A35 S36 L40 V41 D42 | C34-G38 PolarHBondContact O-N 3.48Å; A35-G38 WeakPolarHBondContact O-CA 3.4Å; A35-G38 PolarHBondContact O-N 2.9Å; A35-G38 VanDerWaalsContact O-N 3.1Å; S36-G38 VanDerWaalsContact C-N 3.33Å; G38-L40 VanDerWaalsContact C-N 3.33Å; G38-L40 PolarHBondContact O-N 3.45Å; G38-V41 PolarHBondContact O-N 2.96Å; G38-D42 WeakPolarHBondContact O-CB 3.32Å; G38-D42 PolarHBondContact O-N 3.21Å |
| 39 | E | 98.2 | Very high | 98.1 | Very high | 129 Ų | 129 | 96.1 Ų | 96.1 | 60% | 0.603 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.5 | -37.5 | 177 | -72.3 | 172.6 | -179.8 | 0 | 0 | 112.7 | A35 S36 S43 | A35-E39 WeakPolarHBondContact O-CG 3.36Å; A35-E39 PolarHBondContact O-N 2.92Å; S36-E39 PolarHBondContact O-N 3.45Å; E39-S43 WeakPolarHBondContact O-CB 3.33Å; E39-S43 PolarHBondContact O-N 3.27Å; E39-S43 PolarHBondContact O-OG 3.46Å |
| 40 | L | 98.1 | Very high | 98.1 | Very high | 103 Ų | 103 | 91.8 Ų | 91.8 | 54% | 0.539 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.9 | -46.6 | 177 | -174.9 | 140.8 | 0 | 0 | 0 | 111.4 | S36 A37 G38 D42 S43 E44 | S36-L40 PolarHBondContact O-N 2.85Å; S36-L40 VanDerWaalsContact O-N 3.16Å; A37-L40 PolarHBondContact O-N 3.22Å; G38-L40 VanDerWaalsContact C-N 3.33Å; G38-L40 PolarHBondContact O-N 3.45Å; L40-D42 VanDerWaalsContact C-N 3.34Å; L40-D42 PolarHBondContact O-N 3.41Å; L40-S43 WeakPolarHBondContact O-CB 3.44Å; L40-S43 PolarHBondContact O-N 3.48Å; L40-E44 WeakPolarHBondContact CD2-OE1 3.39Å; L40-E44 PolarHBondContact O-N 3.08Å |
| 41 | V | 98.4 | Very high | 98.2 | Very high | 81 Ų | 81 | 89 Ų | 89 | 49% | 0.491 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63.3 | -41.7 | 176.6 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | A37 G38 S43 E44 V45 | A37-V41 WeakPolarHBondContact O-CG2 3.42Å; A37-V41 PolarHBondContact O-N 3.29Å; A37-V41 VanDerWaalsContact O-N 3.13Å; G38-V41 PolarHBondContact O-N 2.96Å; V41-S43 VanDerWaalsContact C-N 3.32Å; V41-S43 PolarHBondContact O-N 3.41Å; V41-E44 PolarHBondContact O-N 2.94Å; V41-V45 HydrophobicContact CG1-CG2 4.3Å; V41-V45 VanDerWaalsContact O-CG2 3.31Å; V41-V45 WeakPolarHBondContact O-CG2 3.35Å; V41-V45 PolarHBondContact O-N 3.43Å |
| 42 | D | 98.4 | Very high | 98.2 | Very high | 105 Ų | 105 | 94.2 Ų | 94.2 | 56% | 0.561 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -59.3 | -44.2 | 176 | -172.4 | 63.4 | 0 | 0 | 0 | 111.3 | G38 L40 E44 V45 V46 | G38-D42 WeakPolarHBondContact O-CB 3.32Å; G38-D42 PolarHBondContact O-N 3.21Å; L40-D42 VanDerWaalsContact C-N 3.34Å; L40-D42 PolarHBondContact O-N 3.41Å; D42-E44 PolarHBondContact O-N 3.35Å; D42-V45 PolarHBondContact O-N 3.1Å; D42-V46 WeakPolarHBondContact O-CG2 3.47Å; D42-V46 PolarHBondContact O-N 2.86Å |
| 43 | S | 98.2 | Very high | 98.2 | Very high | 71 Ų | 71 | 91.5 Ų | 91.5 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -60.2 | -43 | 175.9 | -59.3 | 0 | 0 | 0 | 0 | 112.3 | E39 L40 V41 V46 M47 | E39-S43 WeakPolarHBondContact O-CB 3.33Å; E39-S43 PolarHBondContact O-N 3.27Å; E39-S43 PolarHBondContact O-OG 3.46Å; L40-S43 WeakPolarHBondContact O-CB 3.44Å; L40-S43 PolarHBondContact O-N 3.48Å; V41-S43 VanDerWaalsContact C-N 3.32Å; V41-S43 PolarHBondContact O-N 3.41Å; S43-V46 PolarHBondContact O-N 3.4Å; S43-M47 WeakPolarHBondContact O-CB 3.4Å; S43-M47 VanDerWaalsContact O-CG 3.28Å; S43-M47 WeakPolarHBondContact O-CG 3.34Å; S43-M47 PolarHBondContact O-N 3.36Å |
| 44 | E | 98.3 | Very high | 98.3 | Very high | 120 Ų | 120 | 93.4 Ų | 93.4 | 56% | 0.561 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -64.8 | -41.9 | 175.8 | -71.7 | -179 | 176 | 0 | 0 | 112.3 | L40 V41 D42 M47 L48 | L40-E44 WeakPolarHBondContact CD2-OE1 3.39Å; L40-E44 PolarHBondContact O-N 3.08Å; V41-E44 PolarHBondContact O-N 2.94Å; D42-E44 PolarHBondContact O-N 3.35Å; E44-M47 PolarHBondContact O-N 3.08Å; E44-L48 WeakPolarHBondContact O-CB 3.46Å; E44-L48 PolarHBondContact O-N 3.32Å |
| 45 | V | 98.5 | Very high | 98.3 | Very high | 79 Ų | 79 | 95 Ų | 95 | 48% | 0.479 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.5 | -42.7 | 177.4 | 169.6 | 0 | 0 | 0 | 0 | 111.1 | V41 D42 L48 S49 | V41-V45 HydrophobicContact CG1-CG2 4.3Å; V41-V45 VanDerWaalsContact O-CG2 3.31Å; V41-V45 WeakPolarHBondContact O-CG2 3.35Å; V41-V45 PolarHBondContact O-N 3.43Å; D42-V45 PolarHBondContact O-N 3.1Å; V45-L48 PolarHBondContact O-N 3.06Å; V45-S49 WeakPolarHBondContact O-CB 3.47Å; V45-S49 PolarHBondContact O-N 2.96Å; V45-S49 PolarHBondContact O-OG 3.3Å |
| 46 | V | 98.6 | Very high | 98.3 | Very high | 85 Ų | 85 | 97.2 Ų | 97.2 | 52% | 0.515 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.3 | -46.6 | 176 | 169.9 | 0 | 0 | 0 | 0 | 110.7 | D42 S43 L48 S49 A50 | D42-V46 WeakPolarHBondContact O-CG2 3.47Å; D42-V46 PolarHBondContact O-N 2.86Å; S43-V46 PolarHBondContact O-N 3.4Å; V46-L48 PolarHBondContact O-N 2.91Å; V46-S49 PolarHBondContact O-N 2.99Å; V46-A50 PolarHBondContact O-N 3.43Å |
| 47 | M | 98.4 | Very high | 98.4 | Very high | 140 Ų | 140 | 97.7 Ų | 97.7 | 69% | 0.69 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.2 | -44.7 | 177.8 | -75.6 | -67.6 | -65.9 | 0 | 0 | 112.1 | S43 E44 S49 A50 H51 | S43-M47 WeakPolarHBondContact O-CB 3.4Å; S43-M47 VanDerWaalsContact O-CG 3.28Å; S43-M47 WeakPolarHBondContact O-CG 3.34Å; S43-M47 PolarHBondContact O-N 3.36Å; E44-M47 PolarHBondContact O-N 3.08Å; M47-S49 VanDerWaalsContact C-N 3.34Å; M47-S49 PolarHBondContact O-N 3.29Å; M47-A50 PolarHBondContact O-N 2.97Å; M47-H51 PolarHBondContact O-N 3.26Å |
| 48 | L | 98.4 | Very high | 98.4 | Very high | 120 Ų | 120 | 97.6 Ų | 97.6 | 63% | 0.628 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -64.5 | -40.1 | 177.6 | -176.5 | 60.8 | 0 | 0 | 0 | 111.6 | E44 V45 V46 H51 W52 | E44-L48 WeakPolarHBondContact O-CB 3.46Å; E44-L48 PolarHBondContact O-N 3.32Å; V45-L48 PolarHBondContact O-N 3.06Å; V46-L48 PolarHBondContact O-N 2.91Å; L48-H51 PolarHBondContact O-N 2.89Å; L48-W52 WeakPolarHBondContact O-CB 3.47Å; L48-W52 PolarHBondContact O-N 3.08Å |
| 49 | S | 98.1 | Very high | 98.4 | Very high | 62 Ų | 62 | 101.1 Ų | 101.1 | 43% | 0.434 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.4 | -42.9 | 176.8 | -58.5 | 0 | 0 | 0 | 0 | 111.5 | V45 V46 M47 W52 E53 | V45-S49 WeakPolarHBondContact O-CB 3.47Å; V45-S49 PolarHBondContact O-N 2.96Å; V45-S49 PolarHBondContact O-OG 3.3Å; V46-S49 PolarHBondContact O-N 2.99Å; M47-S49 VanDerWaalsContact C-N 3.34Å; M47-S49 PolarHBondContact O-N 3.29Å; S49-W52 PolarHBondContact O-N 3.34Å; S49-E53 PolarHBondContact O-N 2.93Å |
| 50 | A | 98.4 | Very high | 98.4 | Very high | 62 Ų | 62 | 98.8 Ų | 98.8 | 51% | 0.512 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.9 | -42.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112 | V46 M47 E53 K54 | V46-A50 PolarHBondContact O-N 3.43Å; M47-A50 PolarHBondContact O-N 2.97Å; A50-E53 PolarHBondContact O-N 3.45Å; A50-K54 PolarHBondContact O-N 3.44Å |
| 51 | H | 98.3 | Very high | 98.4 | Very high | 104 Ų | 104 | 99.4 Ų | 99.4 | 48% | 0.481 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.3 | -41.3 | 175.7 | -177.7 | -101.4 | 0 | 0 | 0 | 111.9 | M47 L48 K54 K55 | M47-H51 PolarHBondContact O-N 3.26Å; L48-H51 PolarHBondContact O-N 2.89Å; H51-K54 PolarHBondContact O-N 2.88Å; H51-K55 WeakPolarHBondContact O-CG 3.44Å; H51-K55 PolarHBondContact O-N 3.21Å |
| 52 | W | 98.3 | Very high | 98.4 | Very high | 165 Ų | 165 | 100.2 Ų | 100.2 | 63% | 0.625 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62 | -48.2 | 176.2 | 173.8 | -105 | 0 | 0 | 0 | 112.2 | L48 S49 K54 K55 K56 | L48-W52 WeakPolarHBondContact O-CB 3.47Å; L48-W52 PolarHBondContact O-N 3.08Å; S49-W52 PolarHBondContact O-N 3.34Å; W52-K54 VanDerWaalsContact C-N 3.31Å; W52-K54 PolarHBondContact O-N 2.98Å; W52-K55 PolarHBondContact O-N 3.42Å; W52-K55 VanDerWaalsContact O-N 3.14Å; W52-K56 WeakPolarHBondContact O-CB 3.35Å; W52-K56 PolarHBondContact O-N 3.37Å |
| 53 | E | 98.6 | Very high | 98.4 | Very high | 90 Ų | 90 | 101 Ų | 101 | 42% | 0.421 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.8 | -39.7 | 177.9 | -73.3 | -58.5 | 139 | 0 | 0 | 111.4 | S49 A50 K55 K56 T57 | S49-E53 PolarHBondContact O-N 2.93Å; A50-E53 PolarHBondContact O-N 3.45Å; E53-K55 PolarHBondContact O-N 2.88Å; E53-K56 WeakPolarHBondContact O-CB 3.49Å; E53-K56 PolarHBondContact O-N 3.4Å; E53-K56 IonicContact OE1-NZ 3.8Å; E53-K56 IonicContact OE2-NZ 2.72Å; E53-K56 PolarHBondContact OE2-NZ 2.85Å; E53-T57 WeakPolarHBondContact O-CG2 3.34Å; E53-T57 PolarHBondContact O-N 2.98Å; E53-T57 PolarHBondContact O-OG1 3.45Å |
| 54 | K | 98.5 | Very high | 98.4 | Very high | 146 Ų | 146 | 103.2 Ų | 103.2 | 64% | 0.635 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -60.7 | -43.1 | 173.3 | -176.2 | 177 | -178.8 | 176.8 | 0 | 112.6 | A50 H51 W52 K56 T57 S58 | A50-K54 PolarHBondContact O-N 3.44Å; H51-K54 PolarHBondContact O-N 2.88Å; W52-K54 VanDerWaalsContact C-N 3.31Å; W52-K54 PolarHBondContact O-N 2.98Å; K54-K56 VanDerWaalsContact C-N 3.33Å; K54-T57 PolarHBondContact O-N 3.16Å; K54-T57 PolarHBondContact O-OG1 3.29Å; K54-S58 PolarHBondContact O-N 2.91Å; K54-S58 VanDerWaalsContact O-N 3.11Å; K54-S58 PolarHBondContact O-OG 2.88Å |
| 55 | K | 98.4 | Very high | 98.3 | Very high | 124 Ų | 124 | 103.5 Ų | 103.5 | 54% | 0.539 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.5 | -39.6 | 177.4 | -73.7 | -69 | -174.9 | 175.8 | 0 | 111.5 | H51 W52 E53 S58 L59 | H51-K55 WeakPolarHBondContact O-CG 3.44Å; H51-K55 PolarHBondContact O-N 3.21Å; W52-K55 PolarHBondContact O-N 3.42Å; W52-K55 VanDerWaalsContact O-N 3.14Å; E53-K55 PolarHBondContact O-N 2.88Å; K55-S58 PolarHBondContact O-N 2.91Å; K55-L59 WeakPolarHBondContact O-CB 3.4Å; K55-L59 PolarHBondContact O-N 3.41Å |
| 56 | K | 98.4 | Very high | 98.3 | Very high | 100 Ų | 100 | 104.4 Ų | 104.4 | 44% | 0.435 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.7 | -45.1 | 176.2 | 178 | -177 | 166.5 | -166.2 | 0 | 111.8 | W52 E53 K54 L59 V60 | W52-K56 WeakPolarHBondContact O-CB 3.35Å; W52-K56 PolarHBondContact O-N 3.37Å; E53-K56 WeakPolarHBondContact O-CB 3.49Å; E53-K56 PolarHBondContact O-N 3.4Å; E53-K56 IonicContact OE1-NZ 3.8Å; E53-K56 IonicContact OE2-NZ 2.72Å; E53-K56 PolarHBondContact OE2-NZ 2.85Å; K54-K56 VanDerWaalsContact C-N 3.33Å; K56-L59 PolarHBondContact O-N 2.77Å; K56-V60 WeakPolarHBondContact O-CG2 3.37Å; K56-V60 PolarHBondContact O-N 3.48Å |
| 57 | T | 98.4 | Very high | 98.2 | Very high | 69 Ų | 69 | 107.2 Ų | 107.2 | 42% | 0.423 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.4 | -46.2 | 176.4 | 55.9 | 0 | 0 | 0 | 0 | 111.1 | E53 K54 L59 V60 E61 | E53-T57 WeakPolarHBondContact O-CG2 3.34Å; E53-T57 PolarHBondContact O-N 2.98Å; E53-T57 PolarHBondContact O-OG1 3.45Å; K54-T57 PolarHBondContact O-N 3.16Å; K54-T57 PolarHBondContact O-OG1 3.29Å; T57-L59 VanDerWaalsContact C-N 3.28Å; T57-L59 PolarHBondContact O-N 3.02Å; T57-V60 PolarHBondContact O-N 3.26Å; T57-V60 VanDerWaalsContact O-N 3.15Å; T57-E61 WeakPolarHBondContact O-CG 3.38Å; T57-E61 PolarHBondContact O-N 3.31Å |
| 58 | S | 98.4 | Very high | 98.2 | Very high | 56 Ų | 56 | 105.6 Ų | 105.6 | 39% | 0.392 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.4 | -34.4 | 176.1 | -62.1 | 0 | 0 | 0 | 0 | 113.3 | K54 K55 L62 | K54-S58 PolarHBondContact O-N 2.91Å; K54-S58 VanDerWaalsContact O-N 3.11Å; K54-S58 PolarHBondContact O-OG 2.88Å; K55-S58 PolarHBondContact O-N 2.91Å; S58-L62 PolarHBondContact O-N 2.96Å; S58-L62 VanDerWaalsContact O-N 3.09Å |
| 59 | L | 98.6 | Very high | 98.2 | Very high | 113 Ų | 113 | 104 Ų | 104 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -69.3 | -39 | 175.9 | -177.4 | 66.2 | 0 | 0 | 0 | 111.8 | K55 K56 T57 L62 Q63 | K55-L59 WeakPolarHBondContact O-CB 3.4Å; K55-L59 PolarHBondContact O-N 3.41Å; K56-L59 PolarHBondContact O-N 2.77Å; T57-L59 VanDerWaalsContact C-N 3.28Å; T57-L59 PolarHBondContact O-N 3.02Å; L59-L62 PolarHBondContact O-N 2.85Å; L59-Q63 WeakPolarHBondContact O-CB 3.4Å; L59-Q63 PolarHBondContact O-N 3.45Å |
| 60 | V | 98.4 | Very high | 98.2 | Very high | 79 Ų | 79 | 104.9 Ų | 104.9 | 48% | 0.479 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65 | -43.3 | 176.1 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | K56 T57 L62 Q63 E64 | K56-V60 WeakPolarHBondContact O-CG2 3.37Å; K56-V60 PolarHBondContact O-N 3.48Å; T57-V60 PolarHBondContact O-N 3.26Å; T57-V60 VanDerWaalsContact O-N 3.15Å; V60-L62 VanDerWaalsContact C-N 3.34Å; V60-L62 PolarHBondContact O-N 2.87Å; V60-Q63 WeakPolarHBondContact O-CB 3.46Å; V60-Q63 PolarHBondContact O-N 3.13Å; V60-E64 PolarHBondContact O-N 3.44Å |
| 61 | E | 98.4 | Very high | 98.2 | Very high | 116 Ų | 116 | 104.7 Ų | 104.7 | 54% | 0.542 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.1 | -44.9 | 174.7 | -70.9 | 166.4 | -173.3 | 0 | 0 | 111.5 | T57 Q63 E64 Q65 | T57-E61 WeakPolarHBondContact O-CG 3.38Å; T57-E61 PolarHBondContact O-N 3.31Å; E61-Q63 VanDerWaalsContact C-N 3.35Å; E61-Q63 PolarHBondContact O-N 3.5Å; E61-E64 PolarHBondContact O-N 3.01Å; E61-Q65 VanDerWaalsContact O-CG 3.24Å; E61-Q65 WeakPolarHBondContact O-CG 3.49Å; E61-Q65 PolarHBondContact O-N 3.18Å |
| 62 | L | 98.3 | Very high | 98.1 | Very high | 98 Ų | 98 | 104.3 Ų | 104.3 | 51% | 0.513 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.3 | -41.1 | 175.7 | 179.3 | 63.2 | 0 | 0 | 0 | 111.9 | S58 L59 V60 E64 Q65 L66 | S58-L62 PolarHBondContact O-N 2.96Å; S58-L62 VanDerWaalsContact O-N 3.09Å; L59-L62 PolarHBondContact O-N 2.85Å; V60-L62 VanDerWaalsContact C-N 3.34Å; V60-L62 PolarHBondContact O-N 2.87Å; L62-E64 VanDerWaalsContact C-N 3.32Å; L62-E64 PolarHBondContact O-N 2.89Å; L62-Q65 WeakPolarHBondContact O-CB 3.3Å; L62-Q65 PolarHBondContact O-N 3.5Å; L62-L66 HydrophobicContact CD1-CG 4.46Å; L62-L66 HydrophobicContact CG-CD1 4.21Å; L62-L66 WeakPolarHBondContact O-CG 3.45Å; L62-L66 PolarHBondContact O-N 2.97Å |
| 63 | Q | 98.1 | Very high | 98.1 | Very high | 121 Ų | 121 | 100.7 Ų | 100.7 | 57% | 0.565 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -61.7 | -42 | 176.6 | -179.8 | -178 | -18 | 0 | 0 | 111.3 | L59 V60 E61 L66 Q67 | L59-Q63 WeakPolarHBondContact O-CB 3.4Å; L59-Q63 PolarHBondContact O-N 3.45Å; V60-Q63 WeakPolarHBondContact O-CB 3.46Å; V60-Q63 PolarHBondContact O-N 3.13Å; E61-Q63 VanDerWaalsContact C-N 3.35Å; E61-Q63 PolarHBondContact O-N 3.5Å; Q63-L66 PolarHBondContact O-N 3.14Å; Q63-Q67 WeakPolarHBondContact O-CB 3.39Å; Q63-Q67 PolarHBondContact O-N 3.21Å |
| 64 | E | 97.6 | Very high | 98.1 | Very high | 118 Ų | 118 | 98.7 Ų | 98.7 | 55% | 0.551 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.6 | -42.7 | 176.3 | -175.2 | 176.4 | -173.2 | 0 | 0 | 111.4 | V60 E61 L62 Q67 Q68 | V60-E64 PolarHBondContact O-N 3.44Å; E61-E64 PolarHBondContact O-N 3.01Å; L62-E64 VanDerWaalsContact C-N 3.32Å; L62-E64 PolarHBondContact O-N 2.89Å; E64-Q67 PolarHBondContact O-N 3.39Å; E64-Q68 PolarHBondContact O-N 3.45Å |
| 65 | Q | 97.6 | Very high | 98.2 | Very high | 127 Ų | 127 | 96.9 Ų | 96.9 | 59% | 0.593 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.7 | -45.9 | 174.4 | -66.2 | -89.5 | -68 | 0 | 0 | 111.5 | E61 L62 Q67 Q68 | E61-Q65 VanDerWaalsContact O-CG 3.24Å; E61-Q65 WeakPolarHBondContact O-CG 3.49Å; E61-Q65 PolarHBondContact O-N 3.18Å; L62-Q65 WeakPolarHBondContact O-CB 3.3Å; L62-Q65 PolarHBondContact O-N 3.5Å; Q65-Q67 VanDerWaalsContact C-N 3.25Å; Q65-Q67 PolarHBondContact O-N 2.87Å; Q65-Q68 WeakPolarHBondContact O-CB 3.49Å; Q65-Q68 PolarHBondContact O-N 3.36Å; Q65-Q68 VanDerWaalsContact O-N 3.13Å |
| 66 | L | 98.1 | Very high | 98.2 | Very high | 97 Ų | 97 | 95.1 Ų | 95.1 | 51% | 0.508 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.7 | -32.7 | 177.5 | -73.2 | 172 | 0 | 0 | 0 | 112.2 | L62 Q63 Q68 L69 | L62-L66 HydrophobicContact CD1-CG 4.46Å; L62-L66 HydrophobicContact CG-CD1 4.21Å; L62-L66 WeakPolarHBondContact O-CG 3.45Å; L62-L66 PolarHBondContact O-N 2.97Å; Q63-L66 PolarHBondContact O-N 3.14Å; L66-Q68 PolarHBondContact O-N 3.11Å; L66-L69 HydrophobicContact CD2-CD1 3.68Å; L66-L69 WeakPolarHBondContact O-CB 3.4Å; L66-L69 PolarHBondContact O-N 3.43Å |
| 67 | Q | 97.3 | Very high | 98.2 | Very high | 145 Ų | 145 | 96.4 Ų | 96.4 | 68% | 0.678 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -68.8 | -17 | 177.9 | -165.8 | 168.3 | 12.8 | 0 | 0 | 113.1 | Q63 E64 Q65 P70 | Q63-Q67 WeakPolarHBondContact O-CB 3.39Å; Q63-Q67 PolarHBondContact O-N 3.21Å; E64-Q67 PolarHBondContact O-N 3.39Å; Q65-Q67 VanDerWaalsContact C-N 3.25Å; Q65-Q67 PolarHBondContact O-N 2.87Å; Q67-P70 WeakPolarHBondContact O-CD 3.46Å |
| 68 | Q | 97.4 | Very high | 98.2 | Very high | 105 Ų | 105 | 96.2 Ų | 96.2 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -83.5 | -19.6 | 175.2 | -63.1 | 172.2 | 37.1 | 0 | 0 | 113.2 | E64 Q65 L66 P70 A71 L72 | E64-Q68 PolarHBondContact O-N 3.45Å; Q65-Q68 WeakPolarHBondContact O-CB 3.49Å; Q65-Q68 PolarHBondContact O-N 3.36Å; Q65-Q68 VanDerWaalsContact O-N 3.13Å; L66-Q68 PolarHBondContact O-N 3.11Å; Q68-P70 VanDerWaalsContact C-CD 3.48Å; Q68-A71 WeakPolarHBondContact O-CB 3.31Å; Q68-A71 PolarHBondContact O-N 3.41Å; Q68-L72 PolarHBondContact O-N 3.42Å |
| 69 | L | 97.8 | Very high | 98.2 | Very high | 86 Ų | 86 | 99.2 Ų | 99.2 | 45% | 0.45 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -55.3 | -41 | -178.7 | -73.1 | 173 | 0 | 0 | 0 | 114.2 | L66 A71 L72 I73 | L66-L69 HydrophobicContact CD2-CD1 3.68Å; L66-L69 WeakPolarHBondContact O-CB 3.4Å; L66-L69 PolarHBondContact O-N 3.43Å; L69-A71 VanDerWaalsContact C-N 3.28Å; L69-A71 PolarHBondContact O-N 3.03Å; L69-L72 PolarHBondContact O-N 3.31Å; L69-I73 VanDerWaalsContact O-CG1 3.3Å; L69-I73 WeakPolarHBondContact O-CG1 3.35Å; L69-I73 PolarHBondContact O-N 3.34Å |
| 70 | P | 98.4 | Very high | 98.2 | Very high | 82 Ų | 82 | 97.9 Ų | 97.9 | 53% | 0.532 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.6 | -34.1 | 176.6 | -24.4 | 35.7 | 0 | 0 | 0 | 113.6 | Q67 Q68 I73 A74 | Q67-P70 WeakPolarHBondContact O-CD 3.46Å; Q68-P70 VanDerWaalsContact C-CD 3.48Å; P70-I73 PolarHBondContact O-N 2.89Å; P70-A74 PolarHBondContact O-N 3.41Å |
| 71 | A | 98 | Very high | 98.2 | Very high | 58 Ų | 58 | 96.5 Ų | 96.5 | 48% | 0.479 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.8 | -44.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q68 L69 I73 A74 D75 | Q68-A71 WeakPolarHBondContact O-CB 3.31Å; Q68-A71 PolarHBondContact O-N 3.41Å; L69-A71 VanDerWaalsContact C-N 3.28Å; L69-A71 PolarHBondContact O-N 3.03Å; A71-I73 VanDerWaalsContact C-N 3.29Å; A71-I73 PolarHBondContact O-N 2.95Å; A71-A74 WeakPolarHBondContact O-CB 3.36Å; A71-A74 PolarHBondContact O-N 2.88Å; A71-A74 VanDerWaalsContact O-N 3.15Å; A71-D75 PolarHBondContact O-N 2.84Å |
| 72 | L | 97.9 | Very high | 98.2 | Very high | 95 Ų | 95 | 96 Ų | 96 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.6 | -40.2 | 174.1 | -179.7 | 65.9 | 0 | 0 | 0 | 112.1 | Q68 L69 D75 L76 | Q68-L72 PolarHBondContact O-N 3.42Å; L69-L72 PolarHBondContact O-N 3.31Å; L72-D75 PolarHBondContact O-N 3.49Å; L72-L76 HydrophobicContact CG-CD1 4.47Å; L72-L76 WeakPolarHBondContact O-CG 3.42Å; L72-L76 PolarHBondContact O-N 2.97Å |
| 73 | I | 98.4 | Very high | 98.3 | Very high | 89 Ų | 89 | 95.9 Ų | 95.9 | 46% | 0.456 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.2 | -45.9 | 175.5 | -69.1 | 165.5 | 0 | 0 | 0 | 110.3 | L69 P70 A71 D75 L76 E77 | L69-I73 VanDerWaalsContact O-CG1 3.3Å; L69-I73 WeakPolarHBondContact O-CG1 3.35Å; L69-I73 PolarHBondContact O-N 3.34Å; P70-I73 PolarHBondContact O-N 2.89Å; A71-I73 VanDerWaalsContact C-N 3.29Å; A71-I73 PolarHBondContact O-N 2.95Å; I73-D75 VanDerWaalsContact C-N 3.31Å; I73-D75 PolarHBondContact O-N 3.35Å; I73-L76 PolarHBondContact O-N 2.94Å; I73-E77 HydrophobicContact CG2-CG 4.33Å; I73-E77 WeakPolarHBondContact O-CG 3.33Å; I73-E77 PolarHBondContact O-N 2.91Å |
| 74 | A | 98.6 | Very high | 98.3 | Very high | 48 Ų | 48 | 93.6 Ų | 93.6 | 40% | 0.397 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62 | -38.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | P70 A71 E77 S78 | P70-A74 PolarHBondContact O-N 3.41Å; A71-A74 WeakPolarHBondContact O-CB 3.36Å; A71-A74 PolarHBondContact O-N 2.88Å; A71-A74 VanDerWaalsContact O-N 3.15Å; A74-E77 PolarHBondContact O-N 3.33Å; A74-S78 WeakPolarHBondContact O-CB 3.4Å; A74-S78 PolarHBondContact O-N 3.16Å |
| 75 | D | 98.6 | Very high | 98.3 | Very high | 108 Ų | 108 | 94.5 Ų | 94.5 | 58% | 0.578 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.5 | -41.5 | 175.5 | -69.1 | -22.2 | 0 | 0 | 0 | 111.6 | A71 L72 I73 S78 M79 | A71-D75 PolarHBondContact O-N 2.84Å; L72-D75 PolarHBondContact O-N 3.49Å; I73-D75 VanDerWaalsContact C-N 3.31Å; I73-D75 PolarHBondContact O-N 3.35Å; D75-S78 PolarHBondContact O-N 2.87Å; D75-M79 WeakPolarHBondContact O-CB 3.43Å; D75-M79 PolarHBondContact O-N 2.92Å |
| 76 | L | 98.6 | Very high | 98.4 | Very high | 87 Ų | 87 | 92.5 Ų | 92.5 | 46% | 0.455 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.8 | -45.7 | 174.2 | -73.5 | 174.6 | 0 | 0 | 0 | 111.6 | L72 I73 S78 M79 T80 | L72-L76 HydrophobicContact CG-CD1 4.47Å; L72-L76 WeakPolarHBondContact O-CG 3.42Å; L72-L76 PolarHBondContact O-N 2.97Å; I73-L76 PolarHBondContact O-N 2.94Å; L76-S78 VanDerWaalsContact C-N 3.31Å; L76-S78 PolarHBondContact O-N 3.34Å; L76-M79 HydrophobicContact CD2-CE 3.87Å; L76-M79 PolarHBondContact O-N 2.91Å; L76-T80 WeakPolarHBondContact O-CB 3.49Å; L76-T80 PolarHBondContact O-N 2.97Å; L76-T80 PolarHBondContact O-OG1 2.72Å |
| 77 | E | 98.7 | Very high | 98.4 | Very high | 128 Ų | 128 | 93.1 Ų | 93.1 | 60% | 0.598 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60 | -41.7 | 176.4 | -73.5 | 174.4 | 169.6 | 0 | 0 | 111.6 | I73 A74 T80 A81 | I73-E77 HydrophobicContact CG2-CG 4.33Å; I73-E77 WeakPolarHBondContact O-CG 3.33Å; I73-E77 PolarHBondContact O-N 2.91Å; A74-E77 PolarHBondContact O-N 3.33Å; E77-T80 PolarHBondContact O-N 3.42Å; E77-A81 PolarHBondContact O-N 2.96Å |
| 78 | S | 98.7 | Very high | 98.5 | Very high | 64 Ų | 64 | 88.9 Ų | 88.9 | 45% | 0.448 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.4 | -46 | 174.1 | 178 | 0 | 0 | 0 | 0 | 112 | A74 D75 L76 T80 A81 N82 | A74-S78 WeakPolarHBondContact O-CB 3.4Å; A74-S78 PolarHBondContact O-N 3.16Å; D75-S78 PolarHBondContact O-N 2.87Å; L76-S78 VanDerWaalsContact C-N 3.31Å; L76-S78 PolarHBondContact O-N 3.34Å; S78-T80 VanDerWaalsContact C-N 3.34Å; S78-T80 PolarHBondContact O-N 3.27Å; S78-A81 PolarHBondContact O-N 2.72Å; S78-N82 VanDerWaalsContact O-CG 3.28Å; S78-N82 PolarHBondContact O-N 2.92Å; S78-N82 PolarHBondContact O-ND2 3.48Å |
| 79 | M | 98.7 | Very high | 98.6 | Very high | 119 Ų | 119 | 85.6 Ų | 85.6 | 59% | 0.586 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64 | -39.5 | 176.9 | -171.2 | 172.6 | 63.9 | 0 | 0 | 111.7 | D75 L76 N82 L83 | D75-M79 WeakPolarHBondContact O-CB 3.43Å; D75-M79 PolarHBondContact O-N 2.92Å; L76-M79 HydrophobicContact CD2-CE 3.87Å; L76-M79 PolarHBondContact O-N 2.91Å; M79-N82 PolarHBondContact O-N 3.31Å; M79-L83 PolarHBondContact O-N 3.42Å |
| 80 | T | 98.8 | Very high | 98.6 | Very high | 85 Ų | 85 | 87.2 Ų | 87.2 | 52% | 0.521 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.2 | -45 | 172.4 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | L76 E77 S78 N82 L83 T84 | L76-T80 WeakPolarHBondContact O-CB 3.49Å; L76-T80 PolarHBondContact O-N 2.97Å; L76-T80 PolarHBondContact O-OG1 2.72Å; E77-T80 PolarHBondContact O-N 3.42Å; S78-T80 VanDerWaalsContact C-N 3.34Å; S78-T80 PolarHBondContact O-N 3.27Å; T80-N82 PolarHBondContact O-N 3.39Å; T80-L83 WeakPolarHBondContact O-CB 3.29Å; T80-L83 PolarHBondContact O-N 2.94Å; T80-T84 WeakPolarHBondContact O-CG2 3.43Å; T80-T84 PolarHBondContact O-N 2.91Å |
| 81 | A | 98.7 | Very high | 98.6 | Very high | 51 Ų | 51 | 89.2 Ų | 89.2 | 42% | 0.421 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.2 | -43.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | E77 S78 L83 T84 H85 | E77-A81 PolarHBondContact O-N 2.96Å; S78-A81 PolarHBondContact O-N 2.72Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 3.32Å; A81-T84 PolarHBondContact O-N 3.48Å; A81-T84 PolarHBondContact O-OG1 3.45Å; A81-H85 PolarHBondContact O-N 2.88Å |
| 82 | N | 98.7 | Very high | 98.7 | Very high | 104 Ų | 104 | 92.4 Ų | 92.4 | 56% | 0.556 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.2 | -40.1 | 176.3 | -68.1 | -28.9 | 0 | 0 | 0 | 112.2 | S78 M79 T80 H85 L86 | S78-N82 VanDerWaalsContact O-CG 3.28Å; S78-N82 PolarHBondContact O-N 2.92Å; S78-N82 PolarHBondContact O-ND2 3.48Å; M79-N82 PolarHBondContact O-N 3.31Å; T80-N82 PolarHBondContact O-N 3.39Å; N82-H85 PolarHBondContact O-N 3.31Å; N82-L86 WeakPolarHBondContact O-CB 3.5Å; N82-L86 PolarHBondContact O-N 3.32Å |
| 83 | L | 98.8 | Very high | 98.7 | Very high | 97 Ų | 97 | 92.2 Ų | 92.2 | 51% | 0.508 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.7 | -48.8 | 174.7 | -170.1 | 104 | 0 | 0 | 0 | 110.7 | M79 T80 A81 H85 L86 E87 | M79-L83 PolarHBondContact O-N 3.42Å; T80-L83 WeakPolarHBondContact O-CB 3.29Å; T80-L83 PolarHBondContact O-N 2.94Å; A81-L83 VanDerWaalsContact C-N 3.33Å; A81-L83 PolarHBondContact O-N 3.32Å; L83-H85 VanDerWaalsContact C-N 3.29Å; L83-H85 PolarHBondContact O-N 2.92Å; L83-L86 WeakPolarHBondContact O-CB 3.47Å; L83-L86 PolarHBondContact O-N 3.32Å; L83-L86 VanDerWaalsContact O-N 3.08Å; L83-E87 WeakPolarHBondContact CD2-OE1 3.44Å; L83-E87 WeakPolarHBondContact O-CG 3.48Å; L83-E87 PolarHBondContact O-N 3.47Å |
| 84 | T | 98.6 | Very high | 98.7 | Very high | 73 Ų | 73 | 94.5 Ų | 94.5 | 45% | 0.448 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.1 | -36.5 | 179.2 | 60 | 0 | 0 | 0 | 0 | 112.8 | T80 A81 A88 | T80-T84 WeakPolarHBondContact O-CG2 3.43Å; T80-T84 PolarHBondContact O-N 2.91Å; A81-T84 PolarHBondContact O-N 3.48Å; A81-T84 PolarHBondContact O-OG1 3.45Å; T84-A88 PolarHBondContact O-N 3.24Å; T84-A88 VanDerWaalsContact O-N 3.12Å |
| 85 | H | 98.8 | Very high | 98.7 | Very high | 137 Ų | 137 | 96.6 Ų | 96.6 | 63% | 0.634 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66.7 | -41.9 | 173.9 | 175.7 | -80.8 | 0 | 0 | 0 | 111.5 | A81 N82 L83 A88 S89 | A81-H85 PolarHBondContact O-N 2.88Å; N82-H85 PolarHBondContact O-N 3.31Å; L83-H85 VanDerWaalsContact C-N 3.29Å; L83-H85 PolarHBondContact O-N 2.92Å; H85-A88 PolarHBondContact O-N 2.95Å; H85-S89 PolarHBondContact O-N 3.45Å |
| 86 | L | 98.8 | Very high | 98.7 | Very high | 84 Ų | 84 | 95.8 Ų | 95.8 | 44% | 0.44 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.6 | -42.3 | 178.3 | -174.1 | 65.3 | 0 | 0 | 0 | 111.2 | N82 L83 A88 S89 F90 | N82-L86 WeakPolarHBondContact O-CB 3.5Å; N82-L86 PolarHBondContact O-N 3.32Å; L83-L86 WeakPolarHBondContact O-CB 3.47Å; L83-L86 PolarHBondContact O-N 3.32Å; L83-L86 VanDerWaalsContact O-N 3.08Å; L86-A88 PolarHBondContact O-N 2.95Å; L86-S89 WeakPolarHBondContact CA-OG 3.48Å; L86-S89 PolarHBondContact O-N 2.92Å; L86-S89 PolarHBondContact O-OG 3.3Å; L86-F90 HydrophobicContact CD1-CD2 4.39Å; L86-F90 HydrophobicContact CD1-CE2 3.82Å; L86-F90 HydrophobicContact CD1-CZ 3.95Å; L86-F90 HydrophobicContact CD2-CE2 3.78Å; L86-F90 HydrophobicContact CD2-CZ 4.32Å; L86-F90 HydrophobicContact CG-CD2 3.93Å; L86-F90 HydrophobicContact CG-CE2 3.43Å; L86-F90 VanDerWaalsContact CG-CE2 3.43Å; L86-F90 HydrophobicContact CG-CZ 4.06Å; L86-F90 VanDerWaalsContact O-CD2 3.27Å; L86-F90 WeakPolarHBondContact O-CD2 3.49Å; L86-F90 PolarHBondContact O-N 3.44Å |
| 87 | E | 98.8 | Very high | 98.8 | Very high | 110 Ų | 110 | 97.1 Ų | 97.1 | 51% | 0.514 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -55.9 | -49.3 | 173 | -72.7 | 171.9 | 168.9 | 0 | 0 | 111.6 | L83 S89 F90 E91 | L83-E87 WeakPolarHBondContact CD2-OE1 3.44Å; L83-E87 WeakPolarHBondContact O-CG 3.48Å; L83-E87 PolarHBondContact O-N 3.47Å; E87-S89 VanDerWaalsContact C-N 3.3Å; E87-S89 PolarHBondContact O-N 3.16Å; E87-F90 PolarHBondContact O-N 3.36Å; E87-E91 PolarHBondContact O-N 2.97Å |
| 88 | A | 98.8 | Very high | 98.8 | Very high | 56 Ų | 56 | 95.7 Ų | 95.7 | 46% | 0.463 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.2 | -38.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | T84 H85 L86 E91 E92 | T84-A88 PolarHBondContact O-N 3.24Å; T84-A88 VanDerWaalsContact O-N 3.12Å; H85-A88 PolarHBondContact O-N 2.95Å; L86-A88 PolarHBondContact O-N 2.95Å; A88-E91 PolarHBondContact O-N 2.99Å; A88-E92 PolarHBondContact O-N 3.46Å |
| 89 | S | 98.8 | Very high | 98.8 | Very high | 36 Ų | 36 | 98.3 Ų | 98.3 | 25% | 0.252 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.9 | -34.7 | 177 | 74.6 | 0 | 0 | 0 | 0 | 112.9 | H85 L86 E87 E92 V93 | H85-S89 PolarHBondContact O-N 3.45Å; L86-S89 WeakPolarHBondContact CA-OG 3.48Å; L86-S89 PolarHBondContact O-N 2.92Å; L86-S89 PolarHBondContact O-OG 3.3Å; E87-S89 VanDerWaalsContact C-N 3.3Å; E87-S89 PolarHBondContact O-N 3.16Å; S89-E92 PolarHBondContact O-N 3.38Å; S89-V93 WeakPolarHBondContact O-CG2 3.48Å; S89-V93 PolarHBondContact O-N 2.99Å |
| 90 | F | 98.8 | Very high | 98.8 | Very high | 120 Ų | 120 | 97.1 Ų | 97.1 | 53% | 0.526 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -68 | -42.5 | 174 | -74.5 | -50.5 | 0 | 0 | 0 | 111.3 | L86 E87 E92 V93 E94 | L86-F90 HydrophobicContact CD1-CD2 4.39Å; L86-F90 HydrophobicContact CD1-CE2 3.82Å; L86-F90 HydrophobicContact CD1-CZ 3.95Å; L86-F90 HydrophobicContact CD2-CE2 3.78Å; L86-F90 HydrophobicContact CD2-CZ 4.32Å; L86-F90 HydrophobicContact CG-CD2 3.93Å; L86-F90 HydrophobicContact CG-CE2 3.43Å; L86-F90 VanDerWaalsContact CG-CE2 3.43Å; L86-F90 HydrophobicContact CG-CZ 4.06Å; L86-F90 VanDerWaalsContact O-CD2 3.27Å; L86-F90 WeakPolarHBondContact O-CD2 3.49Å; L86-F90 PolarHBondContact O-N 3.44Å; E87-F90 PolarHBondContact O-N 3.36Å; F90-E92 VanDerWaalsContact C-N 3.28Å; F90-E92 PolarHBondContact O-N 2.99Å; F90-V93 PolarHBondContact O-N 3.43Å; F90-V93 VanDerWaalsContact O-N 3.13Å; F90-E94 WeakPolarHBondContact O-CG 3.48Å; F90-E94 PolarHBondContact O-N 2.9Å |
| 91 | E | 98.8 | Very high | 98.8 | Very high | 124 Ų | 124 | 99.4 Ų | 99.4 | 58% | 0.579 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.6 | -39.8 | 174.5 | -172 | 176.1 | -172.4 | 0 | 0 | 111.4 | E87 A88 E94 N95 | E87-E91 PolarHBondContact O-N 2.97Å; A88-E91 PolarHBondContact O-N 2.99Å; E91-E94 PolarHBondContact O-N 3.32Å; E91-N95 WeakPolarHBondContact O-CB 3.48Å; E91-N95 VanDerWaalsContact O-CG 3.31Å; E91-N95 PolarHBondContact O-N 2.96Å; E91-N95 PolarHBondContact O-ND2 3.01Å |
| 92 | E | 98.8 | Very high | 98.8 | Very high | 125 Ų | 125 | 101.3 Ų | 101.3 | 58% | 0.584 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.5 | -43.8 | 173.7 | -174 | -179.2 | 177.7 | 0 | 0 | 112.2 | A88 S89 F90 N95 N96 | A88-E92 PolarHBondContact O-N 3.46Å; S89-E92 PolarHBondContact O-N 3.38Å; F90-E92 VanDerWaalsContact C-N 3.28Å; F90-E92 PolarHBondContact O-N 2.99Å; E92-N95 PolarHBondContact O-N 3.4Å; E92-N96 WeakPolarHBondContact O-CB 3.48Å; E92-N96 VanDerWaalsContact O-CG 3.29Å; E92-N96 PolarHBondContact O-N 3.47Å; E92-N96 PolarHBondContact O-ND2 3.22Å |
| 93 | V | 98.9 | Very high | 98.8 | Very high | 92 Ų | 92 | 100.1 Ų | 100.1 | 56% | 0.558 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.2 | -42.3 | 177 | 170.2 | 0 | 0 | 0 | 0 | 111.6 | S89 F90 N96 L97 | S89-V93 WeakPolarHBondContact O-CG2 3.48Å; S89-V93 PolarHBondContact O-N 2.99Å; F90-V93 PolarHBondContact O-N 3.43Å; F90-V93 VanDerWaalsContact O-N 3.13Å; V93-N96 PolarHBondContact O-N 3.45Å; V93-L97 WeakPolarHBondContact O-CB 3.46Å; V93-L97 PolarHBondContact O-N 3.33Å |
| 94 | E | 98.8 | Very high | 98.8 | Very high | 136 Ų | 136 | 98.5 Ų | 98.5 | 64% | 0.636 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -60.7 | -44.8 | 176.1 | -73.7 | 178 | -178.4 | 0 | 0 | 111.4 | F90 E91 N96 L97 L98 | F90-E94 WeakPolarHBondContact O-CG 3.48Å; F90-E94 PolarHBondContact O-N 2.9Å; E91-E94 PolarHBondContact O-N 3.32Å; E94-N96 PolarHBondContact O-N 3.01Å; E94-L97 PolarHBondContact O-N 3.39Å; E94-L98 PolarHBondContact O-N 3.43Å |
| 95 | N | 98.8 | Very high | 98.8 | Very high | 92 Ų | 92 | 96.9 Ų | 96.9 | 49% | 0.492 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.7 | -42.3 | 175.5 | -76 | -51.6 | 0 | 0 | 0 | 112.3 | E91 E92 L97 L98 H99 | E91-N95 WeakPolarHBondContact O-CB 3.48Å; E91-N95 VanDerWaalsContact O-CG 3.31Å; E91-N95 PolarHBondContact O-N 2.96Å; E91-N95 PolarHBondContact O-ND2 3.01Å; E92-N95 PolarHBondContact O-N 3.4Å; N95-L97 VanDerWaalsContact C-N 3.34Å; N95-L97 PolarHBondContact O-N 3.16Å; N95-L98 PolarHBondContact O-N 3.35Å; N95-H99 PolarHBondContact O-N 3.02Å |
| 96 | N | 98.8 | Very high | 98.8 | Very high | 92 Ų | 92 | 95.9 Ų | 95.9 | 49% | 0.492 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.1 | -37.5 | 176.6 | -74.6 | -38.9 | 0 | 0 | 0 | 112.2 | E92 V93 E94 H99 L100 | E92-N96 WeakPolarHBondContact O-CB 3.48Å; E92-N96 VanDerWaalsContact O-CG 3.29Å; E92-N96 PolarHBondContact O-N 3.47Å; E92-N96 PolarHBondContact O-ND2 3.22Å; V93-N96 PolarHBondContact O-N 3.45Å; E94-N96 PolarHBondContact O-N 3.01Å; N96-H99 PolarHBondContact O-N 3.45Å; N96-L100 WeakPolarHBondContact O-CB 3.5Å; N96-L100 PolarHBondContact O-N 3.25Å |
| 97 | L | 98.9 | Very high | 98.8 | Very high | 115 Ų | 115 | 95.7 Ų | 95.7 | 60% | 0.602 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.1 | -43.2 | 177 | -174.9 | 63.5 | 0 | 0 | 0 | 111.4 | V93 E94 N95 H99 L100 E101 | V93-L97 WeakPolarHBondContact O-CB 3.46Å; V93-L97 PolarHBondContact O-N 3.33Å; E94-L97 PolarHBondContact O-N 3.39Å; N95-L97 VanDerWaalsContact C-N 3.34Å; N95-L97 PolarHBondContact O-N 3.16Å; L97-H99 VanDerWaalsContact C-N 3.33Å; L97-H99 PolarHBondContact O-N 2.91Å; L97-L100 WeakPolarHBondContact O-CB 3.39Å; L97-L100 PolarHBondContact O-N 2.94Å; L97-E101 PolarHBondContact O-N 3.18Å |
| 98 | L | 98.8 | Very high | 98.7 | Very high | 98 Ų | 98 | 96 Ų | 96 | 51% | 0.513 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -59.7 | -44.8 | 174.9 | -172 | 71.7 | 0 | 0 | 0 | 111.1 | E94 N95 L100 E101 D102 | E94-L98 PolarHBondContact O-N 3.43Å; N95-L98 PolarHBondContact O-N 3.35Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L98-L100 PolarHBondContact O-N 3.5Å; L98-E101 WeakPolarHBondContact O-CB 3.39Å; L98-E101 PolarHBondContact O-N 3.4Å; L98-D102 PolarHBondContact O-N 3.31Å |
| 99 | H | 98.8 | Very high | 98.7 | Very high | 118 Ų | 118 | 98.8 Ų | 98.8 | 55% | 0.546 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62.1 | -38.1 | 176.1 | -178.3 | 53 | 0 | 0 | 0 | 112.8 | N95 N96 L97 D102 L103 | N95-H99 PolarHBondContact O-N 3.02Å; N96-H99 PolarHBondContact O-N 3.45Å; L97-H99 VanDerWaalsContact C-N 3.33Å; L97-H99 PolarHBondContact O-N 2.91Å; H99-D102 PolarHBondContact O-N 3.07Å; H99-L103 WeakPolarHBondContact O-CB 3.27Å; H99-L103 PolarHBondContact O-N 3.01Å |
| 100 | L | 98.8 | Very high | 98.7 | Very high | 95 Ų | 95 | 101.9 Ų | 101.9 | 50% | 0.497 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -66.2 | -40.2 | 175.9 | -178.6 | 62.4 | 0 | 0 | 0 | 111.6 | N96 L97 L98 L103 C104 | N96-L100 WeakPolarHBondContact O-CB 3.5Å; N96-L100 PolarHBondContact O-N 3.25Å; L97-L100 WeakPolarHBondContact O-CB 3.39Å; L97-L100 PolarHBondContact O-N 2.94Å; L98-L100 VanDerWaalsContact C-N 3.31Å; L98-L100 PolarHBondContact O-N 3.5Å; L100-L103 PolarHBondContact O-N 3.38Å; L100-C104 WeakPolarHBondContact O-CB 3.37Å; L100-C104 PolarHBondContact O-N 3.27Å; L100-C104 PolarHBondContact O-SG 2.9Å |
| 101 | E | 98.8 | Very high | 98.7 | Very high | 133 Ų | 133 | 103 Ų | 103 | 62% | 0.621 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.4 | -46.2 | 174.6 | -175.3 | 172.2 | -165.7 | 0 | 0 | 111.3 | L97 L98 L103 C104 G105 | L97-E101 PolarHBondContact O-N 3.18Å; L98-E101 WeakPolarHBondContact O-CB 3.39Å; L98-E101 PolarHBondContact O-N 3.4Å; E101-L103 VanDerWaalsContact C-N 3.33Å; E101-L103 PolarHBondContact O-N 3.28Å; E101-C104 WeakPolarHBondContact O-CB 3.47Å; E101-C104 PolarHBondContact O-N 2.99Å; E101-G105 PolarHBondContact O-N 3.28Å |
| 102 | D | 98.8 | Very high | 98.7 | Very high | 90 Ų | 90 | 100.3 Ų | 100.3 | 48% | 0.481 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -57.8 | -44.9 | 174.8 | -75.6 | -22.4 | 0 | 0 | 0 | 111.8 | L98 H99 G105 Q106 | L98-D102 PolarHBondContact O-N 3.31Å; H99-D102 PolarHBondContact O-N 3.07Å; D102-G105 PolarHBondContact O-N 2.82Å; D102-Q106 VanDerWaalsContact O-CG 3.29Å; D102-Q106 WeakPolarHBondContact O-CG 3.46Å; D102-Q106 PolarHBondContact O-N 3.43Å |
| 103 | L | 98.8 | Very high | 98.7 | Very high | 80 Ų | 80 | 100.1 Ų | 100.1 | 42% | 0.419 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.7 | -39.6 | 179.9 | -169.9 | 66.4 | 0 | 0 | 0 | 111.6 | H99 L100 E101 Q106 C107 | H99-L103 WeakPolarHBondContact O-CB 3.27Å; H99-L103 PolarHBondContact O-N 3.01Å; L100-L103 PolarHBondContact O-N 3.38Å; E101-L103 VanDerWaalsContact C-N 3.33Å; E101-L103 PolarHBondContact O-N 3.28Å; L103-Q106 PolarHBondContact O-N 2.97Å; L103-C107 PolarHBondContact O-N 3.25Å; L103-C107 PolarHBondContact O-SG 3.12Å |
| 104 | C | 98.6 | Very high | 98.7 | Very high | 62 Ų | 62 | 101.7 Ų | 101.7 | 42% | 0.419 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.9 | -47.3 | 173.6 | -74.8 | 0 | 0 | 0 | 0 | 111.1 | L100 E101 Q106 C107 E108 | L100-C104 WeakPolarHBondContact O-CB 3.37Å; L100-C104 PolarHBondContact O-N 3.27Å; L100-C104 PolarHBondContact O-SG 2.9Å; E101-C104 WeakPolarHBondContact O-CB 3.47Å; E101-C104 PolarHBondContact O-N 2.99Å; C104-Q106 VanDerWaalsContact C-N 3.31Å; C104-Q106 PolarHBondContact O-N 2.99Å; C104-C107 WeakPolarHBondContact O-CB 3.46Å; C104-C107 PolarHBondContact O-N 3.37Å; C104-C107 VanDerWaalsContact O-N 3.16Å; C104-E108 WeakPolarHBondContact O-CG 3.49Å; C104-E108 PolarHBondContact O-N 3.49Å |
| 105 | G | 98.6 | Very high | 98.7 | Very high | 40 Ų | 40 | 99.3 Ų | 99.3 | 41% | 0.412 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.3 | -41.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | E101 D102 E108 L109 | E101-G105 PolarHBondContact O-N 3.28Å; D102-G105 PolarHBondContact O-N 2.82Å; G105-E108 PolarHBondContact O-N 3.47Å; G105-L109 WeakPolarHBondContact O-CB 3.42Å; G105-L109 PolarHBondContact O-N 3.39Å |
| 106 | Q | 98.7 | Very high | 98.7 | Very high | 115 Ų | 115 | 101.5 Ų | 101.5 | 54% | 0.537 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.2 | -43.2 | 174.8 | -71.2 | 170.8 | 35.5 | 0 | 0 | 112.5 | D102 L103 C104 E108 L109 E110 | D102-Q106 VanDerWaalsContact O-CG 3.29Å; D102-Q106 WeakPolarHBondContact O-CG 3.46Å; D102-Q106 PolarHBondContact O-N 3.43Å; L103-Q106 PolarHBondContact O-N 2.97Å; C104-Q106 VanDerWaalsContact C-N 3.31Å; C104-Q106 PolarHBondContact O-N 2.99Å; Q106-E108 VanDerWaalsContact C-N 3.33Å; Q106-E108 PolarHBondContact O-N 2.9Å; Q106-L109 PolarHBondContact O-N 3.43Å; Q106-E110 PolarHBondContact O-N 2.97Å |
| 107 | C | 98.5 | Very high | 98.7 | Very high | 80 Ų | 80 | 100.5 Ų | 100.5 | 54% | 0.541 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61 | -43.1 | 177.1 | -70.4 | 0 | 0 | 0 | 0 | 111.7 | L103 C104 R111 | L103-C107 PolarHBondContact O-N 3.25Å; L103-C107 PolarHBondContact O-SG 3.12Å; C104-C107 WeakPolarHBondContact O-CB 3.46Å; C104-C107 PolarHBondContact O-N 3.37Å; C104-C107 VanDerWaalsContact O-N 3.16Å; C107-R111 WeakPolarHBondContact O-CB 3.36Å; C107-R111 PolarHBondContact O-N 3.18Å |
| 108 | E | 98.6 | Very high | 98.6 | Very high | 116 Ų | 116 | 99.3 Ų | 99.3 | 54% | 0.542 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.1 | -42.5 | 177.1 | -72.3 | -175.2 | 177.7 | 0 | 0 | 112.2 | C104 G105 Q106 R111 C112 | C104-E108 WeakPolarHBondContact O-CG 3.49Å; C104-E108 PolarHBondContact O-N 3.49Å; G105-E108 PolarHBondContact O-N 3.47Å; Q106-E108 VanDerWaalsContact C-N 3.33Å; Q106-E108 PolarHBondContact O-N 2.9Å; E108-R111 WeakPolarHBondContact O-CB 3.5Å; E108-R111 PolarHBondContact O-N 3.37Å; E108-C112 WeakPolarHBondContact O-CB 3.38Å; E108-C112 PolarHBondContact O-N 2.97Å; E108-C112 PolarHBondContact O-SG 3.4Å; E108-C112 VanDerWaalsContact O-SG 3.33Å |
| 109 | L | 98.6 | Very high | 98.6 | Very high | 116 Ų | 116 | 100.5 Ų | 100.5 | 61% | 0.607 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -60.2 | -49.3 | 177 | 179.1 | 61.9 | 0 | 0 | 0 | 111.7 | G105 Q106 R111 C112 K113 | G105-L109 WeakPolarHBondContact O-CB 3.42Å; G105-L109 PolarHBondContact O-N 3.39Å; Q106-L109 PolarHBondContact O-N 3.43Å; L109-R111 VanDerWaalsContact C-N 3.31Å; L109-R111 PolarHBondContact O-N 2.86Å; L109-C112 PolarHBondContact O-N 3.02Å; L109-K113 WeakPolarHBondContact O-CB 3.32Å; L109-K113 PolarHBondContact O-N 2.94Å |
| 110 | E | 98.6 | Very high | 98.6 | Very high | 100 Ų | 100 | 99.2 Ų | 99.2 | 47% | 0.467 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.7 | -36.5 | 178.1 | -78.4 | -61 | 136.9 | 0 | 0 | 111.8 | Q106 K113 H114 | Q106-E110 PolarHBondContact O-N 2.97Å; E110-K113 PolarHBondContact O-N 3.19Å; E110-K113 IonicContact OE1-NZ 2.97Å; E110-K113 PolarHBondContact OE1-NZ 2.96Å; E110-K113 IonicContact OE2-NZ 3.31Å; E110-K113 PolarHBondContact OE2-NZ 3.24Å; E110-H114 VanDerWaalsContact O-CB 3.31Å; E110-H114 WeakPolarHBondContact O-CB 3.34Å; E110-H114 PolarHBondContact O-N 3.05Å |
| 111 | R | 98.6 | Very high | 98.6 | Very high | 145 Ų | 145 | 100.6 Ų | 100.6 | 55% | 0.547 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.6 | -45.6 | 172.8 | -177 | -176 | 64.3 | 89.3 | 2.3 | 111.8 | C107 E108 L109 H114 M115 | C107-R111 WeakPolarHBondContact O-CB 3.36Å; C107-R111 PolarHBondContact O-N 3.18Å; E108-R111 WeakPolarHBondContact O-CB 3.5Å; E108-R111 PolarHBondContact O-N 3.37Å; L109-R111 VanDerWaalsContact C-N 3.31Å; L109-R111 PolarHBondContact O-N 2.86Å; R111-H114 PolarHBondContact O-N 2.92Å; R111-M115 WeakPolarHBondContact O-CB 3.44Å; R111-M115 PolarHBondContact O-N 3.27Å |
| 112 | C | 98.6 | Very high | 98.6 | Very high | 67 Ų | 67 | 98.6 Ų | 98.6 | 45% | 0.453 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.7 | -46.5 | 178.4 | -75.2 | 0 | 0 | 0 | 0 | 111.7 | E108 L109 H114 M115 Q116 | E108-C112 WeakPolarHBondContact O-CB 3.38Å; E108-C112 PolarHBondContact O-N 2.97Å; E108-C112 PolarHBondContact O-SG 3.4Å; E108-C112 VanDerWaalsContact O-SG 3.33Å; L109-C112 PolarHBondContact O-N 3.02Å; C112-H114 PolarHBondContact O-N 3.37Å; C112-M115 PolarHBondContact O-N 2.98Å; C112-Q116 PolarHBondContact O-N 3.13Å |
| 113 | K | 98.7 | Very high | 98.6 | Very high | 120 Ų | 120 | 100.9 Ų | 100.9 | 52% | 0.522 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.5 | -45.1 | 175.3 | 177.7 | -176.8 | 165 | -160.3 | 0 | 111.8 | L109 E110 Q116 S117 | L109-K113 WeakPolarHBondContact O-CB 3.32Å; L109-K113 PolarHBondContact O-N 2.94Å; E110-K113 PolarHBondContact O-N 3.19Å; E110-K113 IonicContact OE1-NZ 2.97Å; E110-K113 PolarHBondContact OE1-NZ 2.96Å; E110-K113 IonicContact OE2-NZ 3.31Å; E110-K113 PolarHBondContact OE2-NZ 3.24Å; K113-Q116 PolarHBondContact O-N 2.72Å; K113-S117 WeakPolarHBondContact O-CB 3.36Å; K113-S117 PolarHBondContact O-N 3.44Å |
| 114 | H | 98.6 | Very high | 98.6 | Very high | 125 Ų | 125 | 102.9 Ų | 102.9 | 58% | 0.579 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.9 | -46.3 | 176.8 | -175.5 | 71.6 | 0 | 0 | 0 | 111.8 | E110 R111 C112 Q116 S117 Q118 | E110-H114 VanDerWaalsContact O-CB 3.31Å; E110-H114 WeakPolarHBondContact O-CB 3.34Å; E110-H114 PolarHBondContact O-N 3.05Å; R111-H114 PolarHBondContact O-N 2.92Å; C112-H114 PolarHBondContact O-N 3.37Å; H114-Q116 PolarHBondContact O-N 3.45Å; H114-S117 PolarHBondContact O-N 2.9Å; H114-Q118 WeakPolarHBondContact O-CB 3.37Å; H114-Q118 PolarHBondContact O-N 3.08Å |
| 115 | M | 98.6 | Very high | 98.6 | Very high | 86 Ų | 86 | 104.9 Ų | 104.9 | 42% | 0.424 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -57.7 | -47.8 | 177 | -172.4 | 72.2 | 67.3 | 0 | 0 | 111.5 | R111 C112 Q118 Q119 | R111-M115 WeakPolarHBondContact O-CB 3.44Å; R111-M115 PolarHBondContact O-N 3.27Å; C112-M115 PolarHBondContact O-N 2.98Å; M115-Q118 PolarHBondContact O-N 3.39Å; M115-Q119 WeakPolarHBondContact O-CG 3.3Å; M115-Q119 PolarHBondContact O-N 3.22Å |
| 116 | Q | 98.4 | Very high | 98.6 | Very high | 139 Ų | 139 | 107.1 Ų | 107.1 | 65% | 0.65 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.4 | -42.7 | 179.2 | -171.6 | -176.5 | 15.8 | 0 | 0 | 111.8 | C112 K113 H114 Q118 Q119 L120 | C112-Q116 PolarHBondContact O-N 3.13Å; K113-Q116 PolarHBondContact O-N 2.72Å; H114-Q116 PolarHBondContact O-N 3.45Å; Q116-Q118 VanDerWaalsContact C-N 3.33Å; Q116-Q118 PolarHBondContact O-N 3.34Å; Q116-Q119 PolarHBondContact O-N 3Å; Q116-L120 WeakPolarHBondContact O-CB 3.44Å; Q116-L120 PolarHBondContact O-N 2.91Å |
| 117 | S | 98.5 | Very high | 98.6 | Very high | 71 Ų | 71 | 105.4 Ų | 105.4 | 50% | 0.497 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.7 | -44.4 | 175.7 | -174 | 0 | 0 | 0 | 0 | 111.3 | K113 H114 L120 E121 | K113-S117 WeakPolarHBondContact O-CB 3.36Å; K113-S117 PolarHBondContact O-N 3.44Å; H114-S117 PolarHBondContact O-N 2.9Å; S117-L120 PolarHBondContact O-N 2.86Å; S117-E121 WeakPolarHBondContact O-CB 3.43Å; S117-E121 PolarHBondContact O-N 2.92Å |
| 118 | Q | 98.6 | Very high | 98.6 | Very high | 90 Ų | 90 | 109.4 Ų | 109.4 | 42% | 0.421 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.2 | -42.1 | 177.9 | -174.3 | -178.5 | 63.9 | 0 | 0 | 111.9 | H114 M115 Q116 L120 E121 N122 | H114-Q118 WeakPolarHBondContact O-CB 3.37Å; H114-Q118 PolarHBondContact O-N 3.08Å; M115-Q118 PolarHBondContact O-N 3.39Å; Q116-Q118 VanDerWaalsContact C-N 3.33Å; Q116-Q118 PolarHBondContact O-N 3.34Å; Q118-L120 VanDerWaalsContact C-N 3.33Å; Q118-L120 PolarHBondContact O-N 2.69Å; Q118-E121 PolarHBondContact O-N 3.39Å; Q118-N122 WeakPolarHBondContact O-CB 3.44Å; Q118-N122 VanDerWaalsContact O-CG 3.28Å; Q118-N122 PolarHBondContact O-N 3.22Å; Q118-N122 PolarHBondContact O-ND2 3.21Å |
| 119 | Q | 98.4 | Very high | 98.5 | Very high | 122 Ų | 122 | 109.2 Ų | 109.2 | 57% | 0.57 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -59.4 | -44.6 | 174.7 | -75.5 | 178.4 | -10.1 | 0 | 0 | 111.6 | M115 Q116 N122 Y123 | M115-Q119 WeakPolarHBondContact O-CG 3.3Å; M115-Q119 PolarHBondContact O-N 3.22Å; Q116-Q119 PolarHBondContact O-N 3Å; Q119-N122 PolarHBondContact O-N 3.47Å; Q119-Y123 WeakPolarHBondContact O-CB 3.42Å; Q119-Y123 PolarHBondContact O-N 2.86Å |
| 120 | L | 98.6 | Very high | 98.5 | Very high | 91 Ų | 91 | 107.4 Ų | 107.4 | 48% | 0.476 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.8 | -41.9 | 178.1 | -177 | 62 | 0 | 0 | 0 | 111.9 | Q116 S117 Q118 Y123 K124 | Q116-L120 WeakPolarHBondContact O-CB 3.44Å; Q116-L120 PolarHBondContact O-N 2.91Å; S117-L120 PolarHBondContact O-N 2.86Å; Q118-L120 VanDerWaalsContact C-N 3.33Å; Q118-L120 PolarHBondContact O-N 2.69Å; L120-Y123 PolarHBondContact O-N 3.42Å; L120-K124 HydrophobicContact CG-CD 4.44Å; L120-K124 WeakPolarHBondContact O-CG 3.36Å; L120-K124 PolarHBondContact O-N 3.43Å |
| 121 | E | 98.5 | Very high | 98.5 | Very high | 125 Ų | 125 | 108.4 Ų | 108.4 | 58% | 0.584 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -63.5 | -44.8 | 176.6 | -170 | -178.5 | 173.6 | 0 | 0 | 111.7 | S117 Q118 Y123 K124 K125 | S117-E121 WeakPolarHBondContact O-CB 3.43Å; S117-E121 PolarHBondContact O-N 2.92Å; Q118-E121 PolarHBondContact O-N 3.39Å; E121-Y123 PolarHBondContact O-N 3.43Å; E121-K124 PolarHBondContact O-N 3.27Å; E121-K125 WeakPolarHBondContact O-CB 3.5Å; E121-K125 PolarHBondContact O-N 2.91Å |
| 122 | N | 98.5 | Very high | 98.5 | Very high | 90 Ų | 90 | 108.3 Ų | 108.3 | 48% | 0.481 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.5 | -43.6 | 176.2 | -76.4 | -25.8 | 0 | 0 | 0 | 111.7 | Q118 Q119 K125 N126 | Q118-N122 WeakPolarHBondContact O-CB 3.44Å; Q118-N122 VanDerWaalsContact O-CG 3.28Å; Q118-N122 PolarHBondContact O-N 3.22Å; Q118-N122 PolarHBondContact O-ND2 3.21Å; Q119-N122 PolarHBondContact O-N 3.47Å; N122-K125 PolarHBondContact O-N 3.06Å; N122-N126 PolarHBondContact O-N 2.99Å |
| 123 | Y | 98.7 | Very high | 98.5 | Very high | 139 Ų | 139 | 108.7 Ų | 108.7 | 55% | 0.545 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.1 | -49.1 | 175.4 | 179.1 | -94.8 | 0 | 0 | 0 | 111.6 | Q119 L120 E121 K125 N126 K127 | Q119-Y123 WeakPolarHBondContact O-CB 3.42Å; Q119-Y123 PolarHBondContact O-N 2.86Å; L120-Y123 PolarHBondContact O-N 3.42Å; E121-Y123 PolarHBondContact O-N 3.43Å; Y123-K125 VanDerWaalsContact C-N 3.28Å; Y123-K125 PolarHBondContact O-N 3.35Å; Y123-N126 PolarHBondContact O-N 3.37Å; Y123-N126 VanDerWaalsContact O-N 3.16Å; Y123-K127 HydrophobicContact CD1-CG 4.25Å; Y123-K127 HydrophobicContact CE1-CG 3.78Å; Y123-K127 HydrophobicContact CE2-CG 4.31Å; Y123-K127 PolarHBondContact O-N 3.01Å; Y123-K127 VanDerWaalsContact OH-CE 3.3Å; Y123-K127 WeakPolarHBondContact OH-CE 3.46Å |
| 124 | K | 98.6 | Very high | 98.4 | Very high | 121 Ų | 121 | 109 Ų | 109 | 53% | 0.526 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.4 | -38.8 | 176.2 | -73.7 | 177.1 | 179.4 | -178.9 | 0 | 112 | L120 E121 R128 | L120-K124 HydrophobicContact CG-CD 4.44Å; L120-K124 WeakPolarHBondContact O-CG 3.36Å; L120-K124 PolarHBondContact O-N 3.43Å; E121-K124 PolarHBondContact O-N 3.27Å; K124-R128 WeakPolarHBondContact O-CG 3.38Å; K124-R128 PolarHBondContact O-N 2.83Å; K124-R128 VanDerWaalsContact O-N 3.11Å; K124-R128 PolarHBondContact O-NE 2.96Å |
| 125 | K | 98.6 | Very high | 98.4 | Very high | 105 Ų | 105 | 109.6 Ų | 109.6 | 46% | 0.457 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.4 | -42.7 | 175.6 | -174.2 | 178.5 | -178.9 | 177.2 | 0 | 111.6 | E121 N122 Y123 R128 K129 | E121-K125 WeakPolarHBondContact O-CB 3.5Å; E121-K125 PolarHBondContact O-N 2.91Å; N122-K125 PolarHBondContact O-N 3.06Å; Y123-K125 VanDerWaalsContact C-N 3.28Å; Y123-K125 PolarHBondContact O-N 3.35Å; K125-R128 PolarHBondContact O-N 3.15Å; K125-K129 WeakPolarHBondContact O-CG 3.46Å; K125-K129 PolarHBondContact O-N 3.24Å; K125-K129 VanDerWaalsContact O-N 3.14Å |
| 126 | N | 98.5 | Very high | 98.4 | Very high | 86 Ų | 86 | 108.2 Ų | 108.2 | 46% | 0.46 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.8 | -44.7 | 177.7 | -151.8 | 65.6 | 0 | 0 | 0 | 111.3 | N122 Y123 R128 K129 E130 | N122-N126 PolarHBondContact O-N 2.99Å; Y123-N126 PolarHBondContact O-N 3.37Å; Y123-N126 VanDerWaalsContact O-N 3.16Å; N126-R128 VanDerWaalsContact C-N 3.35Å; N126-R128 PolarHBondContact O-N 3.36Å; N126-K129 WeakPolarHBondContact O-CB 3.46Å; N126-K129 PolarHBondContact O-N 3.22Å; N126-K129 VanDerWaalsContact O-N 3.13Å; N126-E130 PolarHBondContact ND2-OE1 2.93Å; N126-E130 WeakPolarHBondContact O-CG 3.47Å; N126-E130 PolarHBondContact O-N 3.24Å |
| 127 | K | 98.6 | Very high | 98.4 | Very high | 79 Ų | 79 | 107.6 Ų | 107.6 | 34% | 0.343 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.9 | -39.4 | 177.4 | -72.5 | -68.9 | 166.6 | -156.7 | 0 | 113.2 | Y123 K129 E130 L131 | Y123-K127 HydrophobicContact CD1-CG 4.25Å; Y123-K127 HydrophobicContact CE1-CG 3.78Å; Y123-K127 HydrophobicContact CE2-CG 4.31Å; Y123-K127 PolarHBondContact O-N 3.01Å; Y123-K127 VanDerWaalsContact OH-CE 3.3Å; Y123-K127 WeakPolarHBondContact OH-CE 3.46Å; K127-K129 VanDerWaalsContact C-N 3.34Å; K127-K129 PolarHBondContact O-N 2.94Å; K127-E130 IonicContact NZ-OE1 3.46Å; K127-E130 IonicContact NZ-OE2 3.63Å; K127-E130 PolarHBondContact NZ-OE2 3.13Å; K127-E130 PolarHBondContact O-N 3.29Å; K127-L131 WeakPolarHBondContact O-CG 3.41Å; K127-L131 PolarHBondContact O-N 3.44Å |
| 128 | R | 98.4 | Very high | 98.4 | Very high | 164 Ų | 164 | 108.6 Ų | 108.6 | 62% | 0.619 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.5 | -42.5 | 173.1 | -77 | -175.9 | -70.2 | 155.8 | -6.4 | 112.3 | K124 K125 N126 L131 E132 | K124-R128 WeakPolarHBondContact O-CG 3.38Å; K124-R128 PolarHBondContact O-N 2.83Å; K124-R128 VanDerWaalsContact O-N 3.11Å; K124-R128 PolarHBondContact O-NE 2.96Å; K125-R128 PolarHBondContact O-N 3.15Å; N126-R128 VanDerWaalsContact C-N 3.35Å; N126-R128 PolarHBondContact O-N 3.36Å; R128-L131 PolarHBondContact O-N 3.41Å; R128-E132 WeakPolarHBondContact O-CB 3.24Å; R128-E132 PolarHBondContact O-N 2.91Å |
| 129 | K | 98.4 | Very high | 98.3 | Very high | 113 Ų | 113 | 108.8 Ų | 108.8 | 49% | 0.491 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.8 | -45.5 | 176.6 | -70.8 | 178.7 | 174.8 | -169.9 | 0 | 112.2 | K125 N126 K127 L131 E132 T133 | K125-K129 WeakPolarHBondContact O-CG 3.46Å; K125-K129 PolarHBondContact O-N 3.24Å; K125-K129 VanDerWaalsContact O-N 3.14Å; N126-K129 WeakPolarHBondContact O-CB 3.46Å; N126-K129 PolarHBondContact O-N 3.22Å; N126-K129 VanDerWaalsContact O-N 3.13Å; K127-K129 VanDerWaalsContact C-N 3.34Å; K127-K129 PolarHBondContact O-N 2.94Å; K129-L131 VanDerWaalsContact C-N 3.29Å; K129-L131 PolarHBondContact O-N 3.35Å; K129-E132 PolarHBondContact O-N 3.39Å; K129-T133 WeakPolarHBondContact O-CG2 3.41Å; K129-T133 PolarHBondContact O-N 3.49Å; K129-T133 PolarHBondContact O-OG1 3.24Å |
| 130 | E | 98.4 | Very high | 98.3 | Very high | 78 Ų | 78 | 105.7 Ų | 105.7 | 36% | 0.364 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.1 | -41.2 | 176.5 | -73.8 | 170.7 | -154.5 | 0 | 0 | 111.9 | N126 K127 T133 F134 | N126-E130 PolarHBondContact ND2-OE1 2.93Å; N126-E130 WeakPolarHBondContact O-CG 3.47Å; N126-E130 PolarHBondContact O-N 3.24Å; K127-E130 IonicContact NZ-OE1 3.46Å; K127-E130 IonicContact NZ-OE2 3.63Å; K127-E130 PolarHBondContact NZ-OE2 3.13Å; K127-E130 PolarHBondContact O-N 3.29Å; E130-T133 WeakPolarHBondContact CA-OG1 3.32Å; E130-T133 PolarHBondContact O-OG1 2.91Å; E130-F134 WeakPolarHBondContact O-CB 3.37Å; E130-F134 PolarHBondContact O-N 3.32Å |
| 131 | L | 98.1 | Very high | 98.3 | Very high | 121 Ų | 121 | 107.3 Ų | 107.3 | 63% | 0.634 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -66.7 | -41.1 | 175.7 | -73.6 | 171.2 | 0 | 0 | 0 | 112.2 | K127 R128 K129 F134 K135 | K127-L131 WeakPolarHBondContact O-CG 3.41Å; K127-L131 PolarHBondContact O-N 3.44Å; R128-L131 PolarHBondContact O-N 3.41Å; K129-L131 VanDerWaalsContact C-N 3.29Å; K129-L131 PolarHBondContact O-N 3.35Å; L131-F134 PolarHBondContact O-N 3.42Å; L131-K135 WeakPolarHBondContact O-CB 3.43Å; L131-K135 PolarHBondContact O-N 3.48Å |
| 132 | E | 98.3 | Very high | 98.3 | Very high | 142 Ų | 142 | 107.5 Ų | 107.5 | 66% | 0.664 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -40.9 | 176.8 | -173.4 | 174.1 | -165 | 0 | 0 | 111.7 | R128 K129 A136 | R128-E132 WeakPolarHBondContact O-CB 3.24Å; R128-E132 PolarHBondContact O-N 2.91Å; K129-E132 PolarHBondContact O-N 3.39Å; E132-A136 WeakPolarHBondContact O-CB 3.43Å; E132-A136 PolarHBondContact O-N 3.32Å |
| 133 | T | 98.2 | Very high | 98.2 | Very high | 75 Ų | 75 | 105.5 Ų | 105.5 | 46% | 0.46 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.9 | -46.5 | 175.6 | 52.7 | 0 | 0 | 0 | 0 | 111.8 | K129 E130 K135 A136 E137 | K129-T133 WeakPolarHBondContact O-CG2 3.41Å; K129-T133 PolarHBondContact O-N 3.49Å; K129-T133 PolarHBondContact O-OG1 3.24Å; E130-T133 WeakPolarHBondContact CA-OG1 3.32Å; E130-T133 PolarHBondContact O-OG1 2.91Å; T133-K135 VanDerWaalsContact C-N 3.28Å; T133-K135 PolarHBondContact O-N 3.3Å; T133-A136 PolarHBondContact O-N 3.02Å; T133-A136 VanDerWaalsContact O-N 3.16Å; T133-E137 WeakPolarHBondContact O-CB 3.42Å; T133-E137 WeakPolarHBondContact O-CG 3.42Å; T133-E137 PolarHBondContact O-N 3Å |
| 134 | F | 98.1 | Very high | 98.2 | Very high | 128 Ų | 128 | 105.2 Ų | 105.2 | 56% | 0.561 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61 | -39.9 | 178.3 | -176.3 | -100.7 | 0 | 0 | 0 | 111.6 | E130 L131 E137 L138 | E130-F134 WeakPolarHBondContact O-CB 3.37Å; E130-F134 PolarHBondContact O-N 3.32Å; L131-F134 PolarHBondContact O-N 3.42Å; F134-E137 PolarHBondContact O-N 3.15Å; F134-L138 WeakPolarHBondContact O-CB 3.47Å; F134-L138 PolarHBondContact O-N 3.4Å |
| 135 | K | 98.3 | Very high | 98.1 | Very high | 136 Ų | 136 | 106.4 Ų | 106.4 | 59% | 0.591 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.4 | -48.3 | 174.2 | -176.3 | -178.6 | 176.7 | -176.9 | 0 | 111.7 | L131 T133 E137 L138 D139 | L131-K135 WeakPolarHBondContact O-CB 3.43Å; L131-K135 PolarHBondContact O-N 3.48Å; T133-K135 VanDerWaalsContact C-N 3.28Å; T133-K135 PolarHBondContact O-N 3.3Å; K135-E137 VanDerWaalsContact C-N 3.32Å; K135-E137 PolarHBondContact O-N 3.2Å; K135-L138 PolarHBondContact O-N 2.9Å; K135-D139 WeakPolarHBondContact O-CB 3.28Å; K135-D139 VanDerWaalsContact O-CG 3.3Å; K135-D139 PolarHBondContact O-N 2.93Å |
| 136 | A | 98.2 | Very high | 98.1 | Very high | 57 Ų | 57 | 104.4 Ų | 104.4 | 47% | 0.471 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.8 | -37.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | E132 T133 A140 | E132-A136 WeakPolarHBondContact O-CB 3.43Å; E132-A136 PolarHBondContact O-N 3.32Å; T133-A136 PolarHBondContact O-N 3.02Å; T133-A136 VanDerWaalsContact O-N 3.16Å; A136-A140 WeakPolarHBondContact O-CB 3.31Å; A136-A140 PolarHBondContact O-N 3.46Å |
| 137 | E | 98.1 | Very high | 98 | Very high | 127 Ų | 127 | 105.6 Ų | 105.6 | 59% | 0.593 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63 | -46 | 174.1 | -74.8 | 171.2 | -167.9 | 0 | 0 | 111.4 | T133 F134 K135 A140 E141 | T133-E137 WeakPolarHBondContact O-CB 3.42Å; T133-E137 WeakPolarHBondContact O-CG 3.42Å; T133-E137 PolarHBondContact O-N 3Å; F134-E137 PolarHBondContact O-N 3.15Å; K135-E137 VanDerWaalsContact C-N 3.32Å; K135-E137 PolarHBondContact O-N 3.2Å; E137-A140 PolarHBondContact O-N 3.23Å; E137-E141 WeakPolarHBondContact O-CB 3.48Å; E137-E141 PolarHBondContact O-N 3.45Å |
| 138 | L | 97.9 | Very high | 97.9 | Very high | 91 Ų | 91 | 107.7 Ų | 107.7 | 48% | 0.476 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -65.2 | -40.9 | 178.2 | -168.3 | 67.7 | 0 | 0 | 0 | 112 | F134 K135 A140 E141 H142 | F134-L138 WeakPolarHBondContact O-CB 3.47Å; F134-L138 PolarHBondContact O-N 3.4Å; K135-L138 PolarHBondContact O-N 2.9Å; L138-A140 VanDerWaalsContact C-N 3.32Å; L138-A140 PolarHBondContact O-N 2.98Å; L138-E141 PolarHBondContact O-N 2.97Å; L138-H142 WeakPolarHBondContact O-CB 3.35Å; L138-H142 PolarHBondContact O-N 3.09Å |
| 139 | D | 97.9 | Very high | 97.6 | Very high | 94 Ų | 94 | 104.7 Ų | 104.7 | 50% | 0.503 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.2 | -40.7 | 174.9 | -73.1 | -23.8 | 0 | 0 | 0 | 111 | K135 A143 | K135-D139 WeakPolarHBondContact O-CB 3.28Å; K135-D139 VanDerWaalsContact O-CG 3.3Å; K135-D139 PolarHBondContact O-N 2.93Å; D139-A143 WeakPolarHBondContact O-CB 3.41Å; D139-A143 PolarHBondContact O-N 3.04Å |
| 140 | A | 98.1 | Very high | 97.5 | Very high | 58 Ų | 58 | 103.7 Ų | 103.7 | 48% | 0.479 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -69 | -42.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A136 E137 L138 H142 A143 Q144 | A136-A140 WeakPolarHBondContact O-CB 3.31Å; A136-A140 PolarHBondContact O-N 3.46Å; E137-A140 PolarHBondContact O-N 3.23Å; L138-A140 VanDerWaalsContact C-N 3.32Å; L138-A140 PolarHBondContact O-N 2.98Å; A140-H142 VanDerWaalsContact C-N 3.35Å; A140-A143 PolarHBondContact O-N 3.44Å; A140-Q144 WeakPolarHBondContact O-CB 3.45Å; A140-Q144 PolarHBondContact O-N 3.44Å |
| 141 | E | 97.8 | Very high | 97.4 | Very high | 125 Ų | 125 | 105.3 Ų | 105.3 | 58% | 0.584 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -61.5 | -44.6 | 175.4 | -169.8 | -170.2 | 171.2 | 0 | 0 | 110.7 | E137 L138 Q144 K145 | E137-E141 WeakPolarHBondContact O-CB 3.48Å; E137-E141 PolarHBondContact O-N 3.45Å; L138-E141 PolarHBondContact O-N 2.97Å; E141-Q144 PolarHBondContact O-N 3.48Å; E141-K145 WeakPolarHBondContact O-CB 3.46Å; E141-K145 PolarHBondContact O-N 2.88Å |
| 142 | H | 97.7 | Very high | 97.2 | Very high | 128 Ų | 128 | 102.6 Ų | 102.6 | 59% | 0.593 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.4 | -47 | 175.7 | -177.8 | -97.2 | 0 | 0 | 0 | 111.6 | L138 A140 Q144 K145 V146 | L138-H142 WeakPolarHBondContact O-CB 3.35Å; L138-H142 PolarHBondContact O-N 3.09Å; A140-H142 VanDerWaalsContact C-N 3.35Å; H142-Q144 VanDerWaalsContact C-N 3.33Å; H142-Q144 PolarHBondContact O-N 3.43Å; H142-K145 PolarHBondContact O-N 3.31Å; H142-V146 WeakPolarHBondContact O-CG2 3.46Å; H142-V146 PolarHBondContact O-N 3.39Å |
| 143 | A | 97.8 | Very high | 97 | Very high | 49 Ų | 49 | 101.3 Ų | 101.3 | 41% | 0.405 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.2 | -41.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | D139 A140 V146 L147 | D139-A143 WeakPolarHBondContact O-CB 3.41Å; D139-A143 PolarHBondContact O-N 3.04Å; A140-A143 PolarHBondContact O-N 3.44Å; A143-V146 PolarHBondContact O-N 2.87Å; A143-L147 WeakPolarHBondContact O-CG 3.42Å; A143-L147 PolarHBondContact O-N 3Å; A143-L147 VanDerWaalsContact O-N 3.08Å |
| 144 | Q | 97.8 | Very high | 96.7 | Very high | 132 Ų | 132 | 102.6 Ų | 102.6 | 62% | 0.617 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.3 | -45.7 | 175.5 | 180 | 177.7 | -8 | 0 | 0 | 111.6 | A140 E141 H142 V146 L147 E148 | A140-Q144 WeakPolarHBondContact O-CB 3.45Å; A140-Q144 PolarHBondContact O-N 3.44Å; E141-Q144 PolarHBondContact O-N 3.48Å; H142-Q144 VanDerWaalsContact C-N 3.33Å; H142-Q144 PolarHBondContact O-N 3.43Å; Q144-V146 VanDerWaalsContact C-N 3.32Å; Q144-V146 PolarHBondContact O-N 3.14Å; Q144-L147 PolarHBondContact O-N 3.47Å; Q144-E148 PolarHBondContact O-N 2.87Å |
| 145 | K | 97.3 | Very high | 96.5 | Very high | 147 Ų | 147 | 101 Ų | 101 | 64% | 0.639 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.3 | -38.2 | 179.2 | -171 | 173.6 | -175.1 | 175.5 | 0 | 112.2 | E141 H142 E148 M149 | E141-K145 WeakPolarHBondContact O-CB 3.46Å; E141-K145 PolarHBondContact O-N 2.88Å; H142-K145 PolarHBondContact O-N 3.31Å; K145-E148 PolarHBondContact O-N 3.37Å; K145-M149 WeakPolarHBondContact O-CB 3.49Å; K145-M149 PolarHBondContact O-N 3.44Å |
| 146 | V | 97.2 | Very high | 96.2 | Very high | 62 Ų | 62 | 101.2 Ų | 101.2 | 38% | 0.376 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.9 | -46.8 | 173.6 | 169.8 | 0 | 0 | 0 | 0 | 110.8 | H142 A143 Q144 M149 E150 | H142-V146 WeakPolarHBondContact O-CG2 3.46Å; H142-V146 PolarHBondContact O-N 3.39Å; A143-V146 PolarHBondContact O-N 2.87Å; Q144-V146 VanDerWaalsContact C-N 3.32Å; Q144-V146 PolarHBondContact O-N 3.14Å; V146-M149 PolarHBondContact O-N 3Å; V146-E150 PolarHBondContact O-N 2.72Å |
| 147 | L | 96.8 | Very high | 95.9 | Very high | 111 Ų | 111 | 103.7 Ų | 103.7 | 58% | 0.581 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63.8 | -40.4 | 177.3 | -71.3 | 173.4 | 0 | 0 | 0 | 112.5 | A143 Q144 E150 H151 | A143-L147 WeakPolarHBondContact O-CG 3.42Å; A143-L147 PolarHBondContact O-N 3Å; A143-L147 VanDerWaalsContact O-N 3.08Å; Q144-L147 PolarHBondContact O-N 3.47Å; L147-E150 PolarHBondContact O-N 3.29Å; L147-H151 WeakPolarHBondContact O-CB 3.37Å; L147-H151 PolarHBondContact O-N 3.11Å |
| 148 | E | 96.5 | Very high | 95.7 | Very high | 123 Ų | 123 | 105 Ų | 105 | 58% | 0.575 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -65 | -42.1 | 176.8 | -174.7 | 176.1 | -165.7 | 0 | 0 | 111.7 | Q144 K145 H151 T152 | Q144-E148 PolarHBondContact O-N 2.87Å; K145-E148 PolarHBondContact O-N 3.37Å; E148-H151 PolarHBondContact O-N 3.5Å; E148-T152 WeakPolarHBondContact O-CB 3.17Å; E148-T152 PolarHBondContact O-N 2.93Å; E148-T152 PolarHBondContact O-OG1 3.25Å |
| 149 | M | 93.7 | Very high | 95.4 | Very high | 102 Ų | 102 | 106.4 Ų | 106.4 | 50% | 0.502 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -62.3 | -45 | 174.7 | -177.5 | -179.4 | 62.7 | 0 | 0 | 111.4 | K145 V146 T152 Q153 M202 | K145-M149 WeakPolarHBondContact O-CB 3.49Å; K145-M149 PolarHBondContact O-N 3.44Å; V146-M149 PolarHBondContact O-N 3Å; M149-T152 PolarHBondContact O-N 3.2Å; M149-Q153 WeakPolarHBondContact O-CB 3.46Å; M149-Q153 PolarHBondContact O-N 2.87Å; M149-M202 HydrophobicContact SD-CE 4.36Å |
| 150 | E | 95.1 | Very high | 95.1 | Very high | 91 Ų | 91 | 108.4 Ų | 108.4 | 43% | 0.425 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.9 | -46 | 175.9 | -173.8 | -176.8 | 178.4 | 0 | 0 | 111.3 | V146 L147 T152 Q153 Q154 | V146-E150 PolarHBondContact O-N 2.72Å; L147-E150 PolarHBondContact O-N 3.29Å; E150-T152 PolarHBondContact O-N 2.9Å; E150-Q153 WeakPolarHBondContact O-CB 3.49Å; E150-Q153 PolarHBondContact O-N 3Å; E150-Q154 WeakPolarHBondContact O-CG 3.36Å; E150-Q154 PolarHBondContact O-N 3.49Å; E150-Q154 PolarHBondContact OE1-NE2 3.48Å |
| 151 | H | 96.5 | Very high | 94.8 | Very high | 112 Ų | 112 | 112 Ų | 112 | 52% | 0.519 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.1 | -43.6 | 178 | -174 | 62.5 | 0 | 0 | 0 | 112 | L147 E148 Q153 Q154 M155 | L147-H151 WeakPolarHBondContact O-CB 3.37Å; L147-H151 PolarHBondContact O-N 3.11Å; E148-H151 PolarHBondContact O-N 3.5Å; H151-Q153 VanDerWaalsContact C-N 3.32Å; H151-Q153 PolarHBondContact O-N 3.31Å; H151-Q154 PolarHBondContact O-N 2.94Å; H151-M155 WeakPolarHBondContact O-CB 3.29Å; H151-M155 PolarHBondContact O-N 2.92Å |
| 152 | T | 95.1 | Very high | 94.6 | Very high | 64 Ų | 64 | 112.9 Ų | 112.9 | 39% | 0.393 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -59.8 | -43.5 | 175.2 | -59.2 | 0 | 0 | 0 | 0 | 110.9 | E148 M149 E150 M155 K156 | E148-T152 WeakPolarHBondContact O-CB 3.17Å; E148-T152 PolarHBondContact O-N 2.93Å; E148-T152 PolarHBondContact O-OG1 3.25Å; M149-T152 PolarHBondContact O-N 3.2Å; E150-T152 PolarHBondContact O-N 2.9Å; T152-M155 PolarHBondContact O-N 3.31Å; T152-K156 WeakPolarHBondContact O-CG 3.35Å; T152-K156 PolarHBondContact O-N 3.43Å; T152-K156 VanDerWaalsContact O-N 3.1Å |
| 153 | Q | 93.1 | Very high | 94.2 | Very high | 115 Ų | 115 | 113.6 Ų | 113.6 | 54% | 0.537 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.6 | -45 | 176.1 | -172 | -178.5 | 11.9 | 0 | 0 | 111.7 | M149 E150 H151 M155 K156 L157 | M149-Q153 WeakPolarHBondContact O-CB 3.46Å; M149-Q153 PolarHBondContact O-N 2.87Å; E150-Q153 WeakPolarHBondContact O-CB 3.49Å; E150-Q153 PolarHBondContact O-N 3Å; H151-Q153 VanDerWaalsContact C-N 3.32Å; H151-Q153 PolarHBondContact O-N 3.31Å; Q153-M155 PolarHBondContact O-N 3.06Å; Q153-K156 PolarHBondContact O-N 2.9Å; Q153-L157 WeakPolarHBondContact O-CG 3.42Å; Q153-L157 PolarHBondContact O-N 3.37Å; Q153-L157 VanDerWaalsContact O-N 3.08Å |
| 154 | Q | 92.8 | Very high | 93.7 | Very high | 103 Ų | 103 | 115.8 Ų | 115.8 | 48% | 0.481 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.2 | -40.9 | 176.7 | -73.4 | -177.4 | 9.9 | 0 | 0 | 112.2 | E150 H151 L157 K158 | E150-Q154 WeakPolarHBondContact O-CG 3.36Å; E150-Q154 PolarHBondContact O-N 3.49Å; E150-Q154 PolarHBondContact OE1-NE2 3.48Å; H151-Q154 PolarHBondContact O-N 2.94Å; Q154-L157 PolarHBondContact O-N 3.4Å; Q154-K158 WeakPolarHBondContact O-CB 3.41Å; Q154-K158 PolarHBondContact O-N 3.49Å |
| 155 | M | 92.4 | Very high | 93.5 | Very high | 93 Ų | 93 | 114.9 Ų | 114.9 | 46% | 0.458 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.8 | -46.7 | 176.5 | -172 | -178.3 | -64.5 | 0 | 0 | 111.1 | H151 T152 Q153 L157 K158 E159 | H151-M155 WeakPolarHBondContact O-CB 3.29Å; H151-M155 PolarHBondContact O-N 2.92Å; T152-M155 PolarHBondContact O-N 3.31Å; Q153-M155 PolarHBondContact O-N 3.06Å; M155-L157 VanDerWaalsContact C-N 3.34Å; M155-L157 PolarHBondContact O-N 3.44Å; M155-K158 PolarHBondContact O-N 3.34Å; M155-E159 WeakPolarHBondContact O-CG 3.3Å; M155-E159 PolarHBondContact O-N 3.03Å |
| 156 | K | 92.8 | Very high | 93.2 | Very high | 142 Ų | 142 | 112.8 Ų | 112.8 | 62% | 0.617 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -58.3 | -43.3 | 175.5 | -72.8 | 179 | 179.2 | -179.3 | 0 | 112.4 | T152 Q153 R160 | T152-K156 WeakPolarHBondContact O-CG 3.35Å; T152-K156 PolarHBondContact O-N 3.43Å; T152-K156 VanDerWaalsContact O-N 3.1Å; Q153-K156 PolarHBondContact O-N 2.9Å; K156-R160 WeakPolarHBondContact O-CB 3.46Å; K156-R160 PolarHBondContact O-N 3.02Å |
| 157 | L | 90.9 | Very high | 92.7 | Very high | 109 Ų | 109 | 111.6 Ų | 111.6 | 57% | 0.571 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64.1 | -41.6 | 176.8 | -70.8 | 173.4 | 0 | 0 | 0 | 111.9 | Q153 Q154 M155 R160 Q161 | Q153-L157 WeakPolarHBondContact O-CG 3.42Å; Q153-L157 PolarHBondContact O-N 3.37Å; Q153-L157 VanDerWaalsContact O-N 3.08Å; Q154-L157 PolarHBondContact O-N 3.4Å; M155-L157 VanDerWaalsContact C-N 3.34Å; M155-L157 PolarHBondContact O-N 3.44Å; L157-R160 PolarHBondContact O-N 3.24Å; L157-Q161 PolarHBondContact O-N 2.87Å |
| 158 | K | 94.6 | Very high | 92.4 | Very high | 154 Ų | 154 | 112 Ų | 112 | 67% | 0.67 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -69.4 | -41.2 | 179.4 | -170.6 | 178.7 | -179.7 | 179.7 | 0 | 112.7 | Q154 M155 R160 Q161 K162 | Q154-K158 WeakPolarHBondContact O-CB 3.41Å; Q154-K158 PolarHBondContact O-N 3.49Å; M155-K158 PolarHBondContact O-N 3.34Å; K158-R160 VanDerWaalsContact C-N 3.33Å; K158-Q161 PolarHBondContact O-N 2.91Å; K158-K162 PolarHBondContact O-N 2.95Å |
| 159 | E | 92.4 | Very high | 92.1 | Very high | 121 Ų | 121 | 109.7 Ų | 109.7 | 57% | 0.565 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.1 | -43.4 | 173.3 | -75.4 | -177.9 | 164 | 0 | 0 | 111.3 | M155 Q161 K162 F163 | M155-E159 WeakPolarHBondContact O-CG 3.3Å; M155-E159 PolarHBondContact O-N 3.03Å; E159-Q161 PolarHBondContact O-N 3.38Å; E159-K162 WeakPolarHBondContact O-CB 2.9Å; E159-K162 PolarHBondContact O-N 3.13Å; E159-F163 PolarHBondContact O-N 3.27Å |
| 160 | R | 89.9 | Confident | 91.9 | Very high | 136 Ų | 136 | 109.2 Ų | 109.2 | 51% | 0.513 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61 | -43.6 | 174.5 | -175.7 | 173.8 | -171.4 | 168.9 | 2.8 | 111.9 | K156 L157 K158 K162 F163 F164 | K156-R160 WeakPolarHBondContact O-CB 3.46Å; K156-R160 PolarHBondContact O-N 3.02Å; L157-R160 PolarHBondContact O-N 3.24Å; K158-R160 VanDerWaalsContact C-N 3.33Å; R160-K162 VanDerWaalsContact C-N 3.35Å; R160-F163 PolarHBondContact O-N 3.24Å; R160-F164 HydrophobicContact CG-CD2 4.04Å; R160-F164 HydrophobicContact CG-CE2 3.57Å; R160-F164 WeakPolarHBondContact O-CD2 3.32Å; R160-F164 PolarHBondContact O-N 3.42Å |
| 161 | Q | 91.7 | Very high | 91.4 | Very high | 133 Ų | 133 | 107.7 Ų | 107.7 | 62% | 0.621 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.7 | -45.9 | 174.6 | -175.5 | -179.5 | 12.7 | 0 | 0 | 111.3 | L157 K158 E159 F163 F164 E165 | L157-Q161 PolarHBondContact O-N 2.87Å; K158-Q161 PolarHBondContact O-N 2.91Å; E159-Q161 PolarHBondContact O-N 3.38Å; Q161-F163 VanDerWaalsContact C-N 3.32Å; Q161-F163 PolarHBondContact O-N 3.45Å; Q161-F164 PolarHBondContact O-N 3.1Å; Q161-E165 PolarHBondContact O-N 3.16Å |
| 162 | K | 93.9 | Very high | 90.9 | Very high | 144 Ų | 144 | 105.9 Ų | 105.9 | 63% | 0.626 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.1 | -41.5 | 178 | -174.2 | -174.5 | 175.1 | -170 | 0 | 112 | K158 E159 R160 F164 E165 E166 | K158-K162 PolarHBondContact O-N 2.95Å; E159-K162 WeakPolarHBondContact O-CB 2.9Å; E159-K162 PolarHBondContact O-N 3.13Å; R160-K162 VanDerWaalsContact C-N 3.35Å; K162-F164 VanDerWaalsContact C-N 3.33Å; K162-F164 PolarHBondContact O-N 3.41Å; K162-E165 PolarHBondContact O-N 2.83Å; K162-E166 WeakPolarHBondContact O-CB 3.42Å; K162-E166 PolarHBondContact O-N 2.92Å |
| 163 | F | 90.4 | Very high | 90.6 | Very high | 143 Ų | 143 | 107.7 Ų | 107.7 | 63% | 0.627 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.3 | -43.1 | 177 | -177.5 | -92 | 0 | 0 | 0 | 112.1 | E159 R160 Q161 A167 | E159-F163 PolarHBondContact O-N 3.27Å; R160-F163 PolarHBondContact O-N 3.24Å; Q161-F163 VanDerWaalsContact C-N 3.32Å; Q161-F163 PolarHBondContact O-N 3.45Å; F163-A167 WeakPolarHBondContact O-CB 3.31Å; F163-A167 PolarHBondContact O-N 3.15Å |
| 164 | F | 86.9 | Confident | 90.2 | Very high | 94 Ų | 94 | 105.4 Ų | 105.4 | 41% | 0.412 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -69.7 | -39.6 | 176.6 | -71.7 | -60.5 | 0 | 0 | 0 | 113 | R160 Q161 K162 E166 A167 F168 | R160-F164 HydrophobicContact CG-CD2 4.04Å; R160-F164 HydrophobicContact CG-CE2 3.57Å; R160-F164 WeakPolarHBondContact O-CD2 3.32Å; R160-F164 PolarHBondContact O-N 3.42Å; Q161-F164 PolarHBondContact O-N 3.1Å; K162-F164 VanDerWaalsContact C-N 3.33Å; K162-F164 PolarHBondContact O-N 3.41Å; F164-E166 VanDerWaalsContact C-N 3.34Å; F164-A167 PolarHBondContact O-N 3Å; F164-F168 WeakPolarHBondContact O-CB 3.25Å; F164-F168 PolarHBondContact O-N 3.49Å |
| 165 | E | 92.6 | Very high | 89.9 | Confident | 113 Ų | 113 | 106.3 Ų | 106.3 | 53% | 0.528 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.4 | -43.9 | 175.6 | -171.1 | 64.5 | -148.4 | 0 | 0 | 111.1 | Q161 K162 F168 Q169 | Q161-E165 PolarHBondContact O-N 3.16Å; K162-E165 PolarHBondContact O-N 2.83Å; E165-F168 PolarHBondContact O-N 3.44Å; E165-Q169 WeakPolarHBondContact O-CB 3.4Å; E165-Q169 PolarHBondContact O-N 3.47Å |
| 166 | E | 90.9 | Very high | 89.7 | Confident | 104 Ų | 104 | 108.3 Ų | 108.3 | 49% | 0.486 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.6 | -41.3 | 177.2 | -172.5 | 173.7 | 173.1 | 0 | 0 | 111.8 | K162 F164 F168 Q169 Q170 | K162-E166 WeakPolarHBondContact O-CB 3.42Å; K162-E166 PolarHBondContact O-N 2.92Å; F164-E166 VanDerWaalsContact C-N 3.34Å; E166-F168 VanDerWaalsContact C-N 3.34Å; E166-F168 PolarHBondContact O-N 2.92Å; E166-Q169 PolarHBondContact O-N 2.87Å; E166-Q170 VanDerWaalsContact O-CG 3.29Å; E166-Q170 WeakPolarHBondContact O-CG 3.44Å; E166-Q170 PolarHBondContact O-N 2.93Å |
| 167 | A | 88.2 | Confident | 89.5 | Confident | 36 Ų | 36 | 106.4 Ų | 106.4 | 30% | 0.298 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.1 | -42.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | F163 F164 Q170 D171 | F163-A167 WeakPolarHBondContact O-CB 3.31Å; F163-A167 PolarHBondContact O-N 3.15Å; F164-A167 PolarHBondContact O-N 3Å; A167-Q170 PolarHBondContact O-N 3.49Å; A167-D171 PolarHBondContact O-N 2.92Å |
| 168 | F | 88.8 | Confident | 89.1 | Confident | 121 Ų | 121 | 105.9 Ų | 105.9 | 53% | 0.531 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.8 | -41.5 | 176.6 | 179.4 | -97.4 | 0 | 0 | 0 | 112.5 | F164 E165 E166 Q170 D171 M172 | F164-F168 WeakPolarHBondContact O-CB 3.25Å; F164-F168 PolarHBondContact O-N 3.49Å; E165-F168 PolarHBondContact O-N 3.44Å; E166-F168 VanDerWaalsContact C-N 3.34Å; E166-F168 PolarHBondContact O-N 2.92Å; F168-Q170 VanDerWaalsContact C-N 3.33Å; F168-Q170 PolarHBondContact O-N 3.47Å; F168-D171 WeakPolarHBondContact O-CB 3.45Å; F168-D171 PolarHBondContact O-N 3.45Å; F168-M172 HydrophobicContact CE1-SD 4.42Å; F168-M172 WeakPolarHBondContact O-CB 3.42Å; F168-M172 PolarHBondContact O-N 3.41Å |
| 169 | Q | 91.5 | Very high | 88.3 | Confident | 74 Ų | 74 | 100.6 Ų | 100.6 | 35% | 0.346 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.7 | -43.4 | 176.8 | -175.9 | 63.8 | 29.3 | 0 | 0 | 111 | E165 E166 M172 E173 | E165-Q169 WeakPolarHBondContact O-CB 3.4Å; E165-Q169 PolarHBondContact O-N 3.47Å; E166-Q169 PolarHBondContact O-N 2.87Å; Q169-M172 PolarHBondContact O-N 3.43Å; Q169-E173 WeakPolarHBondContact CG-OE1 3.25Å; Q169-E173 PolarHBondContact NE2-OE1 3.4Å; Q169-E173 WeakPolarHBondContact O-CB 3.49Å; Q169-E173 WeakPolarHBondContact O-CG 3.32Å; Q169-E173 PolarHBondContact O-N 2.91Å |
| 170 | Q | 88.2 | Confident | 87.2 | Confident | 91 Ų | 91 | 104.3 Ų | 104.3 | 43% | 0.425 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.7 | -46 | 173.9 | -73.2 | 175.5 | 18.5 | 0 | 0 | 111.7 | E166 A167 F168 M172 E173 Q174 | E166-Q170 VanDerWaalsContact O-CG 3.29Å; E166-Q170 WeakPolarHBondContact O-CG 3.44Å; E166-Q170 PolarHBondContact O-N 2.93Å; A167-Q170 PolarHBondContact O-N 3.49Å; F168-Q170 VanDerWaalsContact C-N 3.33Å; F168-Q170 PolarHBondContact O-N 3.47Å; Q170-M172 VanDerWaalsContact C-N 3.33Å; Q170-M172 PolarHBondContact O-N 2.92Å; Q170-E173 PolarHBondContact O-N 3.19Å; Q170-Q174 WeakPolarHBondContact O-CB 3.44Å; Q170-Q174 PolarHBondContact O-N 2.81Å |
| 171 | D | 85.6 | Confident | 86.2 | Confident | 59 Ų | 59 | 101.5 Ų | 101.5 | 32% | 0.316 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.2 | -43.5 | 176.4 | -79.9 | -2.8 | 0 | 0 | 0 | 111.7 | A167 F168 Q174 Y175 L181 | A167-D171 PolarHBondContact O-N 2.92Å; F168-D171 WeakPolarHBondContact O-CB 3.45Å; F168-D171 PolarHBondContact O-N 3.45Å; D171-Q174 PolarHBondContact O-N 3.29Å; D171-Y175 PolarHBondContact O-N 3.38Å; D171-L181 HydrophobicContact CB-CD1 4.04Å; D171-L181 VanDerWaalsContact O-CD1 3.29Å; D171-L181 WeakPolarHBondContact O-CD1 3.25Å |
| 172 | M | 86.8 | Confident | 84.8 | Confident | 74 Ų | 74 | 100.9 Ų | 100.9 | 37% | 0.365 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.6 | -44.4 | 177.8 | -175.2 | 171.5 | 58.4 | 0 | 0 | 112.1 | F168 Q169 Q170 Q174 Y175 L176 | F168-M172 HydrophobicContact CE1-SD 4.42Å; F168-M172 WeakPolarHBondContact O-CB 3.42Å; F168-M172 PolarHBondContact O-N 3.41Å; Q169-M172 PolarHBondContact O-N 3.43Å; Q170-M172 VanDerWaalsContact C-N 3.33Å; Q170-M172 PolarHBondContact O-N 2.92Å; M172-Q174 VanDerWaalsContact C-N 3.32Å; M172-Q174 PolarHBondContact O-N 3.31Å; M172-Y175 PolarHBondContact O-N 3.15Å; M172-L176 HydrophobicContact CG-CD1 4.36Å; M172-L176 WeakPolarHBondContact O-CG 3.27Å; M172-L176 PolarHBondContact O-N 2.89Å |
| 173 | E | 88.8 | Confident | 83.2 | Confident | 102 Ų | 102 | 99.2 Ų | 99.2 | 48% | 0.477 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.5 | -39.7 | 175.6 | -76.3 | 173.9 | -165.9 | 0 | 0 | 111.8 | Q169 Q170 L176 S177 | Q169-E173 WeakPolarHBondContact CG-OE1 3.25Å; Q169-E173 PolarHBondContact NE2-OE1 3.4Å; Q169-E173 WeakPolarHBondContact O-CB 3.49Å; Q169-E173 WeakPolarHBondContact O-CG 3.32Å; Q169-E173 PolarHBondContact O-N 2.91Å; Q170-E173 PolarHBondContact O-N 3.19Å; E173-L176 PolarHBondContact O-N 3.31Å; E173-S177 VanDerWaalsContact O-CB 3.31Å; E173-S177 WeakPolarHBondContact O-CB 3.29Å; E173-S177 PolarHBondContact O-N 2.96Å; E173-S177 PolarHBondContact O-OG 3.46Å |
| 174 | Q | 84.5 | Confident | 81.3 | Confident | 68 Ų | 68 | 97.2 Ų | 97.2 | 32% | 0.318 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.4 | -46.9 | 174.5 | -173.5 | -179.8 | 14.3 | 0 | 0 | 111.1 | Q170 D171 M172 L176 S177 T178 | Q170-Q174 WeakPolarHBondContact O-CB 3.44Å; Q170-Q174 PolarHBondContact O-N 2.81Å; D171-Q174 PolarHBondContact O-N 3.29Å; M172-Q174 VanDerWaalsContact C-N 3.32Å; M172-Q174 PolarHBondContact O-N 3.31Å; Q174-L176 PolarHBondContact O-N 3.36Å; Q174-S177 PolarHBondContact O-N 2.85Å; Q174-S177 VanDerWaalsContact O-N 3.14Å; Q174-T178 PolarHBondContact O-N 3.5Å; Q174-T178 PolarHBondContact O-OG1 3.45Å |
| 175 | Y | 86.8 | Confident | 79.7 | Confident | 122 Ų | 122 | 100.9 Ų | 100.9 | 48% | 0.478 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.2 | -46.9 | 177.4 | 175.9 | -105.5 | 0 | 0 | 0 | 112.1 | D171 M172 S177 T178 G179 L181 | D171-Y175 PolarHBondContact O-N 3.38Å; M172-Y175 PolarHBondContact O-N 3.15Å; Y175-S177 PolarHBondContact O-N 3.07Å; Y175-T178 PolarHBondContact O-N 2.96Å; Y175-G179 VanDerWaalsContact O-CA 3.32Å; Y175-G179 WeakPolarHBondContact O-CA 3.38Å; Y175-G179 PolarHBondContact O-N 2.85Å; Y175-L181 HydrophobicContact CD2-CB 4.19Å |
| 176 | L | 88.3 | Confident | 77.8 | Confident | 135 Ų | 135 | 106.2 Ų | 106.2 | 71% | 0.707 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.8 | -31.6 | 176.7 | -68.7 | 173 | 0 | 0 | 0 | 112.4 | M172 E173 Q174 | M172-L176 HydrophobicContact CG-CD1 4.36Å; M172-L176 WeakPolarHBondContact O-CG 3.27Å; M172-L176 PolarHBondContact O-N 2.89Å; E173-L176 PolarHBondContact O-N 3.31Å; Q174-L176 PolarHBondContact O-N 3.36Å |
| 177 | S | 88.6 | Confident | 75.9 | Confident | 101 Ų | 101 | 109 Ų | 109 | 71% | 0.706 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -81.3 | -35.4 | -179.2 | -58.6 | 0 | 0 | 0 | 0 | 114.1 | E173 Q174 Y175 | E173-S177 VanDerWaalsContact O-CB 3.31Å; E173-S177 WeakPolarHBondContact O-CB 3.29Å; E173-S177 PolarHBondContact O-N 2.96Å; E173-S177 PolarHBondContact O-OG 3.46Å; Q174-S177 PolarHBondContact O-N 2.85Å; Q174-S177 VanDerWaalsContact O-N 3.14Å; Y175-S177 PolarHBondContact O-N 3.07Å |
| 178 | T | 82.4 | Confident | 73.7 | Confident | 99 Ų | 99 | 115.5 Ų | 115.5 | 61% | 0.607 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -115 | -16.3 | -172.7 | 44.8 | 0 | 0 | 0 | 0 | 115.2 | Q174 Y175 | Q174-T178 PolarHBondContact O-N 3.5Å; Q174-T178 PolarHBondContact O-OG1 3.45Å; Y175-T178 PolarHBondContact O-N 2.96Å |
| 179 | G | 78 | Confident | 71.6 | Confident | 43 Ų | 43 | 116 Ų | 116 | 44% | 0.443 | 58% | 0.583 | S | S | . | * | S | Bend | trans | 83.2 | -0.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | Y175 | Y175-G179 VanDerWaalsContact O-CA 3.32Å; Y175-G179 WeakPolarHBondContact O-CA 3.38Å; Y175-G179 PolarHBondContact O-N 2.85Å |
| 180 | Y | 67.6 | Low | 69.7 | Low | 198 Ų | 198 | 116.5 Ų | 116.5 | 78% | 0.776 | 59% | 0.587 | S | S | * | * | S | Bend | trans | -143.2 | 148.4 | 175 | -99.8 | -94.9 | 0 | 0 | 0 | 110.4 | ||
| 181 | L | 69.3 | Low | 67.8 | Low | 77 Ų | 77 | 115.5 Ų | 115.5 | 40% | 0.403 | 60% | 0.602 | S | S | . | * | trans | -102.9 | 121.7 | -173.9 | -168.4 | 67.8 | 0 | 0 | 0 | 111.1 | D171 Y175 I183 | D171-L181 HydrophobicContact CB-CD1 4.04Å; D171-L181 VanDerWaalsContact O-CD1 3.29Å; D171-L181 WeakPolarHBondContact O-CD1 3.25Å; Y175-L181 HydrophobicContact CD2-CB 4.19Å; L181-I183 HydrophobicContact CB-CG1 4.38Å; L181-I183 HydrophobicContact CD2-CD1 3.39Å; L181-I183 HydrophobicContact CD2-CG1 3.55Å; L181-I183 HydrophobicContact CG-CD1 3.98Å; L181-I183 HydrophobicContact CG-CG1 3.53Å; L181-I183 PolarHBondContact O-N 3.05Å | ||
| 182 | Q | 62.1 | Low | 65.9 | Low | 120 Ų | 120 | 117.4 Ų | 117.4 | 56% | 0.561 | 62% | 0.619 | S | S | * | * | trans | -97.8 | 69.2 | -177.6 | -69.6 | -179.5 | 3.9 | 0 | 0 | 112.1 | ||||
| 183 | I | 60.2 | Low | 64 | Low | 110 Ų | 110 | 120 Ų | 120 | 56% | 0.564 | 63% | 0.632 | S | S | * | * | trans | -77.2 | -29.1 | -175 | -44.9 | 175.5 | 0 | 0 | 0 | 112.6 | L181 | L181-I183 HydrophobicContact CB-CG1 4.38Å; L181-I183 HydrophobicContact CD2-CD1 3.39Å; L181-I183 HydrophobicContact CD2-CG1 3.55Å; L181-I183 HydrophobicContact CG-CD1 3.98Å; L181-I183 HydrophobicContact CG-CG1 3.53Å; L181-I183 PolarHBondContact O-N 3.05Å | ||
| 184 | A | 51 | Low | 62.1 | Low | 101 Ų | 101 | 119.1 Ų | 119.1 | 84% | 0.835 | 64% | 0.637 | S | S | * | * | S | Bend | trans | -87.9 | -19.8 | -165.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 185 | E | 52.8 | Low | 60.4 | Low | 170 Ų | 170 | 119.7 Ų | 119.7 | 79% | 0.794 | 65% | 0.649 | S | S | * | * | S | Bend | trans | -100.9 | -12.1 | -163.7 | -152.9 | 164.5 | -157.1 | 0 | 0 | 114.2 | ||
| 186 | R | 54.1 | Low | 58.6 | Low | 226 Ų | 226 | 122 Ų | 122 | 85% | 0.853 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -106.4 | 6.8 | -176.7 | -137.6 | -169.1 | -171.1 | -154.3 | 3.2 | 115.5 | ||
| 187 | R | 50.4 | Low | 57 | Low | 161 Ų | 161 | 123.4 Ų | 123.4 | 61% | 0.608 | 67% | 0.669 | S | S | * | * | trans | -100.4 | 91.1 | -173.6 | -143.4 | 178.8 | -153.8 | -166.5 | -1.1 | 110.6 | I190 | R187-I190 HydrophobicContact CG-CD1 3.91Å; R187-I190 HydrophobicContact CG-CG1 4.01Å; R187-I190 VanDerWaalsContact CZ-CD1 3.48Å | ||
| 188 | E | 42.7 | Very low | 55.3 | Low | 173 Ų | 173 | 122.9 Ų | 122.9 | 81% | 0.808 | 66% | 0.661 | S | S | * | * | trans | -59.7 | 145.3 | 156.5 | -76.6 | -175.2 | 166.1 | 0 | 0 | 108.5 | I190 | E188-I190 PolarHBondContact O-N 2.85Š| ||
| 189 | P | 43.7 | Very low | 54 | Low | 132 Ų | 132 | 123.3 Ų | 123.3 | 86% | 0.857 | 66% | 0.66 | S | S | * | * | trans | -51.8 | 110.6 | -171.4 | -26.1 | 33.5 | 0 | 0 | 0 | 111.4 | G191 | P189-G191 PolarHBondContact O-N 2.91Š| ||
| 190 | I | 51.3 | Low | 52.8 | Low | 85 Ų | 85 | 125.9 Ų | 125.9 | 44% | 0.436 | 67% | 0.667 | S | S | . | * | trans | -66 | 104.4 | 172.9 | -58.4 | 178.1 | 0 | 0 | 0 | 105.7 | R187 E188 S192 M193 | R187-I190 HydrophobicContact CG-CD1 3.91Å; R187-I190 HydrophobicContact CG-CG1 4.01Å; R187-I190 VanDerWaalsContact CZ-CD1 3.48Å; E188-I190 PolarHBondContact O-N 2.85Å; I190-S192 PolarHBondContact O-N 3.41Å; I190-M193 HydrophobicContact CG2-CG 4.04Å | ||
| 191 | G | 49 | Very low | 52.2 | Low | 70 Ų | 70 | 122.6 Ų | 122.6 | 72% | 0.722 | 66% | 0.663 | S | S | * | * | trans | -51.6 | 114 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109.2 | P189 | P189-G191 PolarHBondContact O-N 2.91Š| ||
| 192 | S | 45.5 | Very low | 51.6 | Low | 98 Ų | 98 | 124.2 Ų | 124.2 | 69% | 0.685 | 67% | 0.67 | S | S | * | * | trans | 43.4 | 95.8 | 164.1 | -64.4 | 0 | 0 | 0 | 0 | 117.3 | I190 S194 | I190-S192 PolarHBondContact O-N 3.41Å; S192-S194 WeakPolarHBondContact CB-O 3.34Å; S192-S194 PolarHBondContact O-N 3.35Å | ||
| 193 | M | 47.7 | Very low | 51.5 | Low | 129 Ų | 129 | 124.3 Ų | 124.3 | 64% | 0.635 | 67% | 0.673 | S | S | * | * | S | Bend | trans | -77.9 | 11 | 162.9 | -60.3 | -176 | 62.3 | 0 | 0 | 113.6 | I190 | I190-M193 HydrophobicContact CG2-CG 4.04Š|
| 194 | S | 48.4 | Very low | 51.3 | Low | 84 Ų | 84 | 126.2 Ų | 126.2 | 59% | 0.587 | 68% | 0.68 | S | S | * | * | trans | -121 | 119.2 | 167.4 | -177.8 | 0 | 0 | 0 | 0 | 104.5 | S192 | S192-S194 WeakPolarHBondContact CB-O 3.34Å; S192-S194 PolarHBondContact O-N 3.35Å | ||
| 195 | S | 48 | Very low | 51.4 | Low | 80 Ų | 80 | 129.4 Ų | 129.4 | 56% | 0.559 | 68% | 0.677 | S | S | * | * | -163.2 | 157 | 64.1 | -54.7 | 0 | 0 | 0 | 0 | 109.2 | E197 | S195-E197 PolarHBondContact O-N 3.44Š| |||
| 196 | M | 49.3 | Very low | 51.6 | Low | 169 Ų | 169 | 128.2 Ų | 128.2 | 83% | 0.833 | 67% | 0.674 | S | S | * | * | trans | -54.7 | 89.9 | 142.8 | -171.6 | 91.3 | 71.3 | 0 | 0 | 105.8 | V198 | M196-V198 HydrophobicContact CG-CG2 4.22Å; M196-V198 PolarHBondContact O-N 3.06Å | ||
| 197 | E | 55.7 | Low | 51.5 | Low | 165 Ų | 165 | 124.2 Ų | 124.2 | 77% | 0.771 | 67% | 0.669 | S | S | * | * | trans | -67.4 | 86.4 | 164 | -75.3 | 176.7 | -179.2 | 0 | 0 | 104.7 | S195 N199 | S195-E197 PolarHBondContact O-N 3.44Å; E197-N199 PolarHBondContact O-N 2.9Å; E197-N199 VanDerWaalsContact O-N 3.17Å | ||
| 198 | V | 52 | Low | 51.7 | Low | 91 Ų | 91 | 124 Ų | 124 | 55% | 0.552 | 68% | 0.679 | S | S | * | * | trans | -48.7 | 119.4 | 153.7 | -177.2 | 0 | 0 | 0 | 0 | 103.4 | M196 V200 | M196-V198 HydrophobicContact CG-CG2 4.22Å; M196-V198 PolarHBondContact O-N 3.06Å; V198-V200 HydrophobicContact CB-CG2 4.43Å; V198-V200 WeakPolarHBondContact O-CG2 3.41Å; V198-V200 PolarHBondContact O-N 3.36Å | ||
| 199 | N | 54.8 | Low | 52.3 | Low | 108 Ų | 108 | 124 Ų | 124 | 58% | 0.578 | 68% | 0.681 | S | S | * | * | trans | -64 | 81.6 | 173.8 | -72.1 | -59.8 | 0 | 0 | 0 | 107.4 | E197 D201 M202 L203 | E197-N199 PolarHBondContact O-N 2.9Å; E197-N199 VanDerWaalsContact O-N 3.17Å; N199-D201 PolarHBondContact O-N 3.47Å; N199-M202 HydrophobicContact CB-CB 3.91Å; N199-M202 HydrophobicContact CB-CG 3.82Å; N199-M202 PolarHBondContact O-N 2.83Å; N199-L203 PolarHBondContact O-N 3.33Å | ||
| 200 | V | 52.4 | Low | 53 | Low | 97 Ų | 97 | 124.2 Ų | 124.2 | 59% | 0.588 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -59.6 | -34.6 | 177.1 | 177.8 | 0 | 0 | 0 | 0 | 108.7 | V198 M202 L203 E204 | V198-V200 HydrophobicContact CB-CG2 4.43Å; V198-V200 WeakPolarHBondContact O-CG2 3.41Å; V198-V200 PolarHBondContact O-N 3.36Å; V200-M202 VanDerWaalsContact C-N 3.25Å; V200-M202 PolarHBondContact O-N 2.94Å; V200-L203 WeakPolarHBondContact O-CB 3.49Å; V200-L203 PolarHBondContact O-N 3.4Å; V200-E204 PolarHBondContact O-N 2.91Å; V200-E204 VanDerWaalsContact O-N 3.11Å |
| 201 | D | 54.9 | Low | 53.2 | Low | 129 Ų | 129 | 127.5 Ų | 127.5 | 69% | 0.69 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -64.3 | -23.2 | 176.3 | -55.1 | -8.9 | 0 | 0 | 0 | 113.6 | N199 | N199-D201 PolarHBondContact O-N 3.47Å |
| 202 | M | 58.1 | Low | 53.5 | Low | 111 Ų | 111 | 128.2 Ų | 128.2 | 55% | 0.547 | 69% | 0.686 | S | S | . | * | H | α-helix | trans | -86.9 | -22.2 | 172.9 | -70.9 | -101.8 | -76.7 | 0 | 0 | 112.5 | M149 N199 V200 | M149-M202 HydrophobicContact SD-CE 4.36Å; N199-M202 HydrophobicContact CB-CB 3.91Å; N199-M202 HydrophobicContact CB-CG 3.82Å; N199-M202 PolarHBondContact O-N 2.83Å; V200-M202 VanDerWaalsContact C-N 3.25Å; V200-M202 PolarHBondContact O-N 2.94Å |
| 203 | L | 58.6 | Low | 54.3 | Low | 121 Ų | 121 | 128.5 Ų | 128.5 | 63% | 0.634 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -74.7 | -32.7 | 171.5 | -104.7 | 74.4 | 0 | 0 | 0 | 111.5 | N199 V200 Q205 M206 | N199-L203 PolarHBondContact O-N 3.33Å; V200-L203 WeakPolarHBondContact O-CB 3.49Å; V200-L203 PolarHBondContact O-N 3.4Å; L203-Q205 PolarHBondContact O-N 3.23Å; L203-M206 WeakPolarHBondContact O-CB 3.43Å; L203-M206 PolarHBondContact O-N 2.93Å |
| 204 | E | 56.9 | Low | 54.9 | Low | 150 Ų | 150 | 127.1 Ų | 127.1 | 70% | 0.701 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -69.5 | -17.2 | 177.6 | -166.3 | 172.3 | -161.3 | 0 | 0 | 112.9 | V200 | V200-E204 PolarHBondContact O-N 2.91Å; V200-E204 VanDerWaalsContact O-N 3.11Å |
| 205 | Q | 53.6 | Low | 55.6 | Low | 168 Ų | 168 | 130.5 Ų | 130.5 | 79% | 0.785 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -93.4 | 3.1 | 176.7 | -134.3 | 166.5 | 47.5 | 0 | 0 | 113.9 | L203 D207 | L203-Q205 PolarHBondContact O-N 3.23Å; Q205-D207 PolarHBondContact O-N 3.45Å |
| 206 | M | 56.4 | Low | 56.3 | Low | 146 Ų | 146 | 129.2 Ų | 129.2 | 72% | 0.719 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -87.7 | 13.9 | 174.8 | -126.2 | -179.5 | 76.7 | 0 | 0 | 112.7 | L203 L208 | L203-M206 WeakPolarHBondContact O-CB 3.43Å; L203-M206 PolarHBondContact O-N 2.93Å; M206-L208 PolarHBondContact O-N 2.81Å |
| 207 | D | 52.7 | Low | 57 | Low | 142 Ų | 142 | 126 Ų | 126 | 76% | 0.759 | 66% | 0.658 | S | S | * | * | trans | -59.5 | 109.6 | 168.2 | -92.5 | -9.2 | 0 | 0 | 0 | 108.3 | Q205 M209 | Q205-D207 PolarHBondContact O-N 3.45Å; D207-M209 PolarHBondContact O-N 2.89Å | ||
| 208 | L | 55.1 | Low | 57.4 | Low | 156 Ų | 156 | 121.6 Ų | 121.6 | 82% | 0.817 | 64% | 0.64 | S | S | * | * | trans | -43.9 | 108.1 | 170.3 | -81.5 | 86.6 | 0 | 0 | 0 | 108.7 | M206 D210 | M206-L208 PolarHBondContact O-N 2.81Å; L208-D210 PolarHBondContact O-N 2.79Å | ||
| 209 | M | 55.2 | Low | 58.3 | Low | 173 Ų | 173 | 122 Ų | 122 | 85% | 0.852 | 64% | 0.642 | S | S | * | * | trans | -61.3 | 98.4 | 148.7 | -83.3 | 170.4 | -177.4 | 0 | 0 | 105.8 | D207 I211 | D207-M209 PolarHBondContact O-N 2.89Å; M209-I211 PolarHBondContact O-N 2.87Å | ||
| 210 | D | 58.2 | Low | 58.8 | Low | 137 Ų | 137 | 125.3 Ų | 125.3 | 73% | 0.733 | 65% | 0.652 | S | S | * | * | trans | -61.1 | 88.1 | 169.5 | -164.3 | 8.9 | 0 | 0 | 0 | 107.7 | L208 S212 | L208-D210 PolarHBondContact O-N 2.79Å; D210-S212 VanDerWaalsContact C-N 3.31Å | ||
| 211 | I | 55.1 | Low | 59.4 | Low | 154 Ų | 154 | 126.9 Ų | 126.9 | 79% | 0.79 | 66% | 0.656 | S | S | * | * | trans | -98.3 | 29.5 | 175.3 | 45.8 | 165.7 | 0 | 0 | 0 | 111.9 | M209 D213 | M209-I211 PolarHBondContact O-N 2.87Å; I211-D213 PolarHBondContact O-N 3.38Å | ||
| 212 | S | 56 | Low | 59.8 | Low | 84 Ų | 84 | 126.7 Ų | 126.7 | 59% | 0.587 | 66% | 0.655 | S | S | * | * | trans | -77 | 60.5 | 148.7 | -178.8 | 0 | 0 | 0 | 0 | 109.1 | D210 Q214 | D210-S212 VanDerWaalsContact C-N 3.31Å; S212-Q214 PolarHBondContact O-N 3.43Å | ||
| 213 | D | 61 | Low | 59.8 | Low | 104 Ų | 104 | 126.3 Ų | 126.3 | 56% | 0.556 | 66% | 0.663 | S | S | * | * | trans | -75.4 | 58.8 | 169 | -150.7 | 16.8 | 0 | 0 | 0 | 108.5 | I211 E215 A216 | I211-D213 PolarHBondContact O-N 3.38Å; D213-E215 PolarHBondContact O-N 2.98Å; D213-E215 VanDerWaalsContact O-N 3.15Å; D213-A216 PolarHBondContact O-N 3.21Å; D213-A216 VanDerWaalsContact O-N 3.1Å | ||
| 214 | Q | 61.1 | Low | 59.7 | Low | 100 Ų | 100 | 124 Ų | 124 | 47% | 0.467 | 67% | 0.67 | S | S | . | * | H | α-helix | trans | -60.3 | -23.3 | -174.6 | -176.6 | 62 | 44.6 | 0 | 0 | 111.2 | S212 D218 | S212-Q214 PolarHBondContact O-N 3.43Å; Q214-D218 PolarHBondContact O-N 3.44Å |
| 215 | E | 63.3 | Low | 59.6 | Low | 155 Ų | 155 | 119.8 Ų | 119.8 | 72% | 0.724 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -70.8 | -34.4 | 177.3 | -163 | 169.7 | -165.9 | 0 | 0 | 112.3 | D213 V219 | D213-E215 PolarHBondContact O-N 2.98Å; D213-E215 VanDerWaalsContact O-N 3.15Å; E215-V219 WeakPolarHBondContact O-CG2 3.17Å; E215-V219 PolarHBondContact O-N 2.86Å |
| 216 | A | 62.9 | Low | 59.4 | Low | 53 Ų | 53 | 120.9 Ų | 120.9 | 44% | 0.438 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -72 | -32.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | D213 F220 | D213-A216 PolarHBondContact O-N 3.21Å; D213-A216 VanDerWaalsContact O-N 3.1Å; A216-F220 PolarHBondContact O-N 2.82Å |
| 217 | L | 62.8 | Low | 59 | Low | 102 Ų | 102 | 122.5 Ų | 122.5 | 53% | 0.534 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -73.3 | -37 | 176.4 | -68.8 | 173.5 | 0 | 0 | 0 | 112 | F220 L221 | L217-F220 PolarHBondContact O-N 3.34Å; L217-L221 WeakPolarHBondContact O-CG 3.44Å; L217-L221 PolarHBondContact O-N 2.95Å |
| 218 | D | 64.4 | Low | 58.7 | Low | 73 Ų | 73 | 122.5 Ų | 122.5 | 39% | 0.39 | 68% | 0.677 | S | S | . | * | H | α-helix | trans | -68.3 | -35.2 | 176.8 | -77.8 | -12.3 | 0 | 0 | 0 | 112.1 | Q214 N222 | Q214-D218 PolarHBondContact O-N 3.44Å; D218-N222 WeakPolarHBondContact O-CB 3.3Å; D218-N222 PolarHBondContact O-N 2.92Å; D218-N222 PolarHBondContact O-ND2 2.87Å |
| 219 | V | 70.6 | Confident | 57.5 | Low | 99 Ų | 99 | 122 Ų | 122 | 60% | 0.6 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -65.8 | -38.8 | 172.7 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | E215 S223 | E215-V219 WeakPolarHBondContact O-CG2 3.17Å; E215-V219 PolarHBondContact O-N 2.86Å; V219-S223 WeakPolarHBondContact O-CB 3.4Å; V219-S223 PolarHBondContact O-N 3.33Å; V219-S223 VanDerWaalsContact O-N 3.08Å |
| 220 | F | 65.4 | Low | 56.6 | Low | 178 Ų | 178 | 118.6 Ų | 118.6 | 78% | 0.781 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -71.1 | -35.5 | 179.2 | -159.4 | -95 | 0 | 0 | 0 | 113 | A216 L217 | A216-F220 PolarHBondContact O-N 2.82Å; L217-F220 PolarHBondContact O-N 3.34Å |
| 221 | L | 66.1 | Low | 55.5 | Low | 129 Ų | 129 | 120 Ų | 120 | 68% | 0.675 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -79.6 | -31.7 | 178.1 | -68.3 | 173.5 | 0 | 0 | 0 | 113 | L217 | L217-L221 WeakPolarHBondContact O-CG 3.44Å; L217-L221 PolarHBondContact O-N 2.95Å |
| 222 | N | 62.7 | Low | 54.4 | Low | 125 Ų | 125 | 117.6 Ų | 117.6 | 67% | 0.668 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -86.7 | -16.3 | 179.3 | -66 | -41.6 | 0 | 0 | 0 | 113.7 | D218 G224 | D218-N222 WeakPolarHBondContact O-CB 3.3Å; D218-N222 PolarHBondContact O-N 2.92Å; D218-N222 PolarHBondContact O-ND2 2.87Å; N222-G224 PolarHBondContact O-N 3.42Å |
| 223 | S | 58.4 | Low | 53.4 | Low | 103 Ų | 103 | 119.3 Ų | 119.3 | 72% | 0.72 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | 6.9 | 178.6 | -160.5 | 0 | 0 | 0 | 0 | 114.4 | V219 | V219-S223 WeakPolarHBondContact O-CB 3.4Å; V219-S223 PolarHBondContact O-N 3.33Å; V219-S223 VanDerWaalsContact O-N 3.08Å |
| 224 | G | 56.3 | Low | 52 | Low | 74 Ų | 74 | 118.5 Ų | 118.5 | 76% | 0.763 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.3 | 19.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | N222 | N222-G224 PolarHBondContact O-N 3.42Š|
| 225 | G | 54.4 | Low | 50.8 | Low | 61 Ų | 61 | 122 Ų | 122 | 63% | 0.629 | 71% | 0.711 | S | S | * | * | trans | -156.8 | 60.1 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | E227 | G225-E227 VanDerWaalsContact C-N 3.33Å; G225-E227 PolarHBondContact O-N 3.16Å | ||
| 226 | E | 50.1 | Low | 49.3 | Very low | 190 Ų | 190 | 118 Ų | 118 | 89% | 0.888 | 71% | 0.711 | S | S | * | * | trans | -86.2 | 81 | 153.6 | 49.1 | 176.8 | 157.8 | 0 | 0 | 109.5 | ||||
| 227 | E | 47.6 | Very low | 48.7 | Very low | 180 Ų | 180 | 120.3 Ų | 120.3 | 84% | 0.841 | 72% | 0.722 | S | S | * | * | S | Bend | 171.5 | 135.7 | 128.4 | 58.9 | -157.4 | 166 | 0 | 0 | 110.9 | G225 | G225-E227 VanDerWaalsContact C-N 3.33Å; G225-E227 PolarHBondContact O-N 3.16Å | |
| 228 | N | 46.7 | Very low | 47 | Very low | 142 Ų | 142 | 123 Ų | 123 | 76% | 0.759 | 73% | 0.732 | S | S | * | * | trans | 74.3 | 86.6 | 178.4 | -92.7 | -29.4 | 0 | 0 | 0 | 117.8 | ||||
| 229 | T | 30.3 | Very low | 45.4 | Very low | 145 Ų | 145 | 124.4 Ų | 124.4 | 89% | 0.89 | 75% | 0.747 | S | S | * | * | trans | -138.3 | 95.5 | 130.6 | -19.5 | 0 | 0 | 0 | 0 | 110.3 | L231 | T229-L231 PolarHBondContact O-N 3.31Å; T229-L231 VanDerWaalsContact O-N 3.14Å | ||
| 230 | V | 35.8 | Very low | 43.7 | Very low | 102 Ų | 102 | 124.8 Ų | 124.8 | 62% | 0.618 | 75% | 0.754 | S | S | * | * | trans | -49.6 | 108.3 | 165 | 176.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 231 | L | 35.3 | Very low | 41.9 | Very low | 166 Ų | 166 | 122.2 Ų | 122.2 | 87% | 0.869 | 75% | 0.753 | S | S | * | * | trans | -92.9 | 109.8 | 144.1 | -75.8 | 174.4 | 0 | 0 | 0 | 106.1 | T229 P233 | T229-L231 PolarHBondContact O-N 3.31Å; T229-L231 VanDerWaalsContact O-N 3.14Å; L231-P233 VanDerWaalsContact O-CD 3.28Å; L231-P233 WeakPolarHBondContact O-CD 3.43Å | ||
| 232 | S | 31.1 | Very low | 40.2 | Very low | 105 Ų | 105 | 120.6 Ų | 120.6 | 73% | 0.734 | 75% | 0.751 | S | S | * | * | trans | -56.7 | 135.8 | 176.7 | -57.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 233 | P | 35.1 | Very low | 38.8 | Very low | 120 Ų | 120 | 122.7 Ų | 122.7 | 78% | 0.779 | 76% | 0.757 | S | S | * | * | -130.5 | 124.5 | 122.8 | 31.2 | -18.3 | 0 | 0 | 0 | 110.7 | L231 | L231-P233 VanDerWaalsContact O-CD 3.28Å; L231-P233 WeakPolarHBondContact O-CD 3.43Å | |||
| 234 | A | 32.5 | Very low | 37.6 | Very low | 87 Ų | 87 | 125.9 Ų | 125.9 | 72% | 0.719 | 77% | 0.766 | S | S | * | * | trans | 32.6 | 125 | 148.1 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 235 | L | 35.5 | Very low | 36.6 | Very low | 174 Ų | 174 | 130.5 Ų | 130.5 | 91% | 0.911 | 77% | 0.768 | S | S | * | * | trans | 72.7 | 112.4 | 142.2 | -68.8 | 162.8 | 0 | 0 | 0 | 118.6 | ||||
| 236 | G | 31.1 | Very low | 36 | Very low | 70 Ų | 70 | 135 Ų | 135 | 72% | 0.722 | 78% | 0.776 | S | S | * | * | trans | 91.1 | 161.1 | 131 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 237 | P | 50.7 | Low | 35.6 | Very low | 102 Ų | 102 | 131.2 Ų | 131.2 | 66% | 0.662 | 77% | 0.766 | S | S | * | * | -128 | -175.3 | -121.6 | 31.4 | -11.4 | 0 | 0 | 0 | 113.3 | |||||
| 238 | E | 27.2 | Very low | 35.2 | Very low | 159 Ų | 159 | 130.3 Ų | 130.3 | 74% | 0.743 | 77% | 0.766 | S | S | * | * | trans | 89.5 | 138.4 | 155.7 | -35.1 | -51.5 | 165.9 | 0 | 0 | 120.1 | ||||
| 239 | S | 31.2 | Very low | 34.9 | Very low | 102 Ų | 102 | 132.4 Ų | 132.4 | 71% | 0.713 | 77% | 0.771 | S | S | * | * | trans | 86.3 | 97.8 | 146 | 62.6 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 240 | S | 33.9 | Very low | 35.5 | Very low | 106 Ų | 106 | 131.5 Ų | 131.5 | 74% | 0.741 | 77% | 0.765 | S | S | * | * | -8.8 | 135.2 | 122 | 54.9 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 241 | T | 28.8 | Very low | 35.6 | Very low | 124 Ų | 124 | 132.6 Ų | 132.6 | 76% | 0.761 | 77% | 0.774 | S | S | * | * | 170.8 | 121.5 | 122.8 | -74.4 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 242 | C | 28.7 | Very low | 36.2 | Very low | 95 Ų | 95 | 131.7 Ų | 131.7 | 64% | 0.642 | 77% | 0.77 | S | S | * | * | trans | 77.2 | 117.9 | 144.8 | -70.2 | 0 | 0 | 0 | 0 | 123.1 | ||||
| 243 | Q | 33.3 | Very low | 36.9 | Very low | 169 Ų | 169 | 132.1 Ų | 132.1 | 79% | 0.79 | 77% | 0.77 | S | S | * | * | 77.1 | 107 | 123.6 | -65.5 | 176.6 | -3.5 | 0 | 0 | 117.9 | |||||
| 244 | N | 33.7 | Very low | 37.4 | Very low | 171 Ų | 171 | 131.3 Ų | 131.3 | 91% | 0.914 | 77% | 0.768 | S | S | * | * | -158.4 | 118.1 | 118.2 | -82.3 | -39.7 | 0 | 0 | 0 | 109.4 | |||||
| 245 | E | 35.8 | Very low | 37.7 | Very low | 171 Ų | 171 | 136.3 Ų | 136.3 | 80% | 0.799 | 78% | 0.776 | S | S | * | * | trans | -97.8 | 127.6 | 177 | -174 | -177.5 | 176 | 0 | 0 | 108.3 | ||||
| 246 | I | 41.4 | Very low | 37.9 | Very low | 155 Ų | 155 | 136.4 Ų | 136.4 | 80% | 0.795 | 78% | 0.777 | S | S | * | * | trans | -125.3 | 102.1 | 166.3 | -66.7 | 167.8 | 0 | 0 | 0 | 106.8 | ||||
| 247 | T | 41.3 | Very low | 38.4 | Very low | 110 Ų | 110 | 145.4 Ų | 145.4 | 68% | 0.675 | 79% | 0.789 | S | S | * | * | trans | -71.9 | 126.2 | 174.3 | -46.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 248 | L | 39.6 | Very low | 37.7 | Very low | 162 Ų | 162 | 145 Ų | 145 | 85% | 0.848 | 79% | 0.794 | S | S | * | * | trans | -111.2 | 116.2 | 166.1 | -74.3 | 172.2 | 0 | 0 | 0 | 109.5 | ||||
| 249 | Q | 39.8 | Very low | 38.5 | Very low | 185 Ų | 185 | 146.9 Ų | 146.9 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 132.9 | -174.7 | -168.4 | 174.4 | 51.8 | 0 | 0 | 110.8 | ||
| 250 | V | 43.9 | Very low | 39 | Very low | 127 Ų | 127 | 147.5 Ų | 147.5 | 77% | 0.77 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -96.1 | 136.3 | 178.6 | 179.4 | 0 | 0 | 0 | 0 | 110.3 | ||
| 251 | P | 38.2 | Very low | 39.4 | Very low | 124 Ų | 124 | 148.4 Ų | 148.4 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 137.7 | 175.5 | -20 | 33.2 | 0 | 0 | 0 | 114.2 | ||
| 252 | N | 46.8 | Very low | 39.7 | Very low | 147 Ų | 147 | 148 Ų | 148 | 79% | 0.786 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -87.2 | 142.1 | -176.6 | -155.2 | 7.8 | 0 | 0 | 0 | 111.7 | S254 | N252-S254 PolarHBondContact O-N 3.41Š|
| 253 | P | 46.9 | Very low | 39.9 | Very low | 114 Ų | 114 | 149.3 Ų | 149.3 | 74% | 0.74 | 82% | 0.817 | S | S | * | * | trans | -93.7 | 93.5 | 179.7 | 34.1 | -25.7 | 0 | 0 | 0 | 110.6 | ||||
| 254 | S | 44.4 | Very low | 39.9 | Very low | 104 Ų | 104 | 146.9 Ų | 146.9 | 73% | 0.727 | 82% | 0.819 | S | S | * | * | trans | -162.4 | 95.7 | 163.7 | -77.2 | 0 | 0 | 0 | 0 | 109.1 | N252 | N252-S254 PolarHBondContact O-N 3.41Š| ||
| 255 | E | 40.3 | Very low | 40.4 | Very low | 191 Ų | 191 | 144.6 Ų | 144.6 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | trans | 166.2 | 78.1 | 151.7 | -94.9 | 174.3 | -166.6 | 0 | 0 | 110.4 | ||||
| 256 | L | 38.2 | Very low | 40.2 | Very low | 177 Ų | 177 | 142.3 Ų | 142.3 | 93% | 0.927 | 81% | 0.814 | S | S | * | * | trans | -137.7 | 87 | 154.7 | -81.3 | 178.8 | 0 | 0 | 0 | 109.4 | A258 | L256-A258 PolarHBondContact O-N 3.14Š| ||
| 257 | R | 42.3 | Very low | 39.7 | Very low | 259 Ų | 259 | 140.4 Ų | 140.4 | 98% | 0.977 | 81% | 0.813 | S | S | * | * | trans | -76.7 | 96.1 | 165.3 | -172.7 | -174 | -156.5 | -165.2 | 7.8 | 108.1 | ||||
| 258 | A | 37.1 | Very low | 39.4 | Very low | 92 Ų | 92 | 141 Ų | 141 | 76% | 0.76 | 82% | 0.817 | S | S | * | * | trans | -123 | 129.2 | 164.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | L256 | L256-A258 PolarHBondContact O-N 3.14Š| ||
| 259 | K | 42.9 | Very low | 39.1 | Very low | 200 Ų | 200 | 140.2 Ų | 140.2 | 87% | 0.87 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -82.6 | 133.7 | -170.3 | -175.4 | 168.3 | -178.8 | 172.7 | 0 | 110.2 | ||
| 260 | P | 42.3 | Very low | 38.9 | Very low | 115 Ų | 115 | 137.3 Ų | 137.3 | 75% | 0.747 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -85.8 | 143.4 | 169.8 | 32.6 | -30.2 | 0 | 0 | 0 | 110.6 | ||
| 261 | P | 42.5 | Very low | 38.7 | Very low | 125 Ų | 125 | 135.3 Ų | 135.3 | 81% | 0.812 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -86 | 134.6 | 159.7 | 31.9 | -27.5 | 0 | 0 | 0 | 110.6 | ||
| 262 | S | 34.2 | Very low | 38.7 | Very low | 114 Ų | 114 | 135.6 Ų | 135.6 | 80% | 0.797 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 144.1 | 161.1 | -53.4 | 0 | 0 | 0 | 0 | 110.7 | ||
| 263 | S | 33.6 | Very low | 38.2 | Very low | 124 Ų | 124 | 139.8 Ų | 139.8 | 87% | 0.867 | 82% | 0.815 | S | S | * | * | -177.5 | 145.4 | 127.1 | -78.7 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 264 | S | 33.8 | Very low | 37.6 | Very low | 118 Ų | 118 | 141.6 Ų | 141.6 | 83% | 0.825 | 82% | 0.819 | S | S | * | * | trans | -58.4 | 161.1 | -174.9 | -50.7 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 265 | S | 43.5 | Very low | 37.2 | Very low | 122 Ų | 122 | 144.6 Ų | 144.6 | 85% | 0.853 | 83% | 0.825 | S | S | * | * | trans | -150.4 | 130.3 | 135.3 | 61.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 266 | T | 31.1 | Very low | 37 | Very low | 124 Ų | 124 | 140 Ų | 140 | 76% | 0.761 | 81% | 0.813 | S | S | * | * | trans | -84.2 | 165.2 | -174.5 | -19.8 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 267 | C | 31.6 | Very low | 37 | Very low | 115 Ų | 115 | 140.4 Ų | 140.4 | 78% | 0.777 | 81% | 0.811 | S | S | * | * | trans | 65.3 | 140.6 | 155.4 | 68.4 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 268 | T | 35.4 | Very low | 36.7 | Very low | 123 Ų | 123 | 132.1 Ų | 132.1 | 76% | 0.755 | 81% | 0.806 | S | S | * | * | cis | -152.7 | 128.4 | 37.4 | 35.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 269 | D | 32.8 | Very low | 36.6 | Very low | 145 Ų | 145 | 131.5 Ų | 131.5 | 78% | 0.775 | 81% | 0.808 | S | S | * | * | 44.3 | 112 | 91.1 | -161.4 | 22.5 | 0 | 0 | 0 | 115.7 | |||||
| 270 | S | 36.2 | Very low | 36.4 | Very low | 123 Ų | 123 | 131.4 Ų | 131.4 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | -157.4 | 92.2 | 160.4 | -77.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 271 | A | 38.5 | Very low | 36.5 | Very low | 86 Ų | 86 | 131 Ų | 131 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | trans | -82.6 | 132 | 163.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 272 | T | 38.9 | Very low | 36.9 | Very low | 130 Ų | 130 | 130.8 Ų | 130.8 | 80% | 0.798 | 81% | 0.81 | S | S | * | * | trans | -155.2 | 102.4 | 148.8 | -24.8 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 273 | R | 35.3 | Very low | 37.3 | Very low | 235 Ų | 235 | 131.7 Ų | 131.7 | 89% | 0.887 | 81% | 0.81 | S | S | * | * | trans | 56.2 | 128.1 | 135.4 | -68.6 | -177.4 | 147.2 | 165.9 | -5.9 | 123.3 | ||||
| 274 | D | 35.1 | Very low | 38.1 | Very low | 152 Ų | 152 | 131.8 Ų | 131.8 | 81% | 0.813 | 81% | 0.805 | S | S | * | * | trans | -30.8 | 149 | 155.4 | -70.1 | -56.5 | 0 | 0 | 0 | 118.1 | ||||
| 275 | I | 35.7 | Very low | 38.2 | Very low | 166 Ų | 166 | 135 Ų | 135 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | -167.7 | 117 | 123.2 | -86.8 | 146.7 | 0 | 0 | 0 | 109.8 | |||||
| 276 | S | 36.1 | Very low | 38.4 | Very low | 94 Ų | 94 | 134.4 Ų | 134.4 | 66% | 0.657 | 80% | 0.803 | S | S | * | * | trans | 52.1 | 133.4 | 131.7 | -148.6 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 277 | E | 37.5 | Very low | 39.5 | Very low | 186 Ų | 186 | 135.6 Ų | 135.6 | 87% | 0.869 | 81% | 0.805 | S | S | * | * | trans | 81.8 | 113.3 | 144.4 | -89 | -179.4 | 151.2 | 0 | 0 | 122 | ||||
| 278 | G | 36 | Very low | 40.2 | Very low | 85 Ų | 85 | 138.6 Ų | 138.6 | 88% | 0.876 | 81% | 0.808 | S | S | * | * | 89.6 | 96.3 | 123.5 | 0 | 0 | 0 | 0 | 0 | 117.6 | |||||
| 279 | G | 36.1 | Very low | 40.7 | Very low | 79 Ų | 79 | 141.1 Ų | 141.1 | 81% | 0.814 | 81% | 0.811 | S | S | * | * | trans | 177.4 | 97.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 280 | E | 38.4 | Very low | 41.4 | Very low | 198 Ų | 198 | 142.3 Ų | 142.3 | 93% | 0.925 | 81% | 0.812 | S | S | * | * | trans | -59.1 | 136.8 | 177.2 | 60.7 | -154.2 | 142.5 | 0 | 0 | 114.8 | ||||
| 281 | S | 43.5 | Very low | 41.9 | Very low | 108 Ų | 108 | 142.5 Ų | 142.5 | 76% | 0.755 | 81% | 0.807 | S | S | * | * | trans | -153 | 136.7 | 159.9 | -168.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 282 | P | 51.8 | Low | 42 | Very low | 119 Ų | 119 | 145.8 Ų | 145.8 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 130 | -165.5 | 30.9 | -32.7 | 0 | 0 | 0 | 112.3 | ||
| 283 | V | 43.1 | Very low | 42.1 | Very low | 134 Ų | 134 | 145.6 Ų | 145.6 | 81% | 0.812 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -84.3 | 116.2 | 167.3 | 166.8 | 0 | 0 | 0 | 0 | 108.1 | Q285 | V283-Q285 PolarHBondContact O-N 2.88Š|
| 284 | V | 48.9 | Very low | 42.3 | Very low | 126 Ų | 126 | 141.7 Ų | 141.7 | 76% | 0.764 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 117.4 | 170.5 | 176.8 | 0 | 0 | 0 | 0 | 107.9 | ||
| 285 | Q | 37.1 | Very low | 42.9 | Very low | 184 Ų | 184 | 140.5 Ų | 140.5 | 86% | 0.86 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 128.4 | 168.2 | -63.3 | -180 | -61.2 | 0 | 0 | 108.4 | V283 | V283-Q285 PolarHBondContact O-N 2.88Š|
| 286 | S | 47.6 | Very low | 43.1 | Very low | 111 Ų | 111 | 136.6 Ų | 136.6 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | -118.6 | 124.3 | 159.6 | -73.5 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 287 | D | 53.6 | Low | 43.1 | Very low | 149 Ų | 149 | 140.7 Ų | 140.7 | 80% | 0.797 | 81% | 0.808 | S | S | * | * | trans | -61.5 | 138.2 | -174.3 | -159.4 | 7.4 | 0 | 0 | 0 | 111.4 | ||||
| 288 | E | 46.2 | Very low | 43.1 | Very low | 178 Ų | 178 | 136.7 Ų | 136.7 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | trans | -105.4 | 109.1 | 175.5 | 55 | -168.8 | 120.5 | 0 | 0 | 107.5 | ||||
| 289 | E | 46.3 | Very low | 43.3 | Very low | 175 Ų | 175 | 138.9 Ų | 138.9 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | trans | -117.9 | 98.1 | 162 | -84.3 | -160.3 | 130.2 | 0 | 0 | 109.8 | V291 | E289-V291 PolarHBondContact O-N 2.89Š| ||
| 290 | E | 48.1 | Very low | 43.1 | Very low | 171 Ų | 171 | 139.7 Ų | 139.7 | 80% | 0.799 | 80% | 0.796 | S | S | * | * | trans | -75.4 | 105.2 | 165 | -169.2 | -178.9 | -157.3 | 0 | 0 | 108.1 | Q292 | E290-Q292 PolarHBondContact O-N 3Š| ||
| 291 | V | 45.5 | Very low | 43.1 | Very low | 127 Ų | 127 | 138.2 Ų | 138.2 | 77% | 0.77 | 79% | 0.789 | S | S | * | * | trans | -72.4 | 101.8 | 176.6 | 179.2 | 0 | 0 | 0 | 0 | 109.2 | E289 V293 | E289-V291 PolarHBondContact O-N 2.89Å; V291-V293 PolarHBondContact O-N 3.21Å | ||
| 292 | Q | 42 | Very low | 42.6 | Very low | 155 Ų | 155 | 139.9 Ų | 139.9 | 72% | 0.724 | 79% | 0.794 | S | S | * | * | trans | -65.2 | 121.2 | 168.5 | -70.8 | 166.3 | 6.7 | 0 | 0 | 109.6 | E290 D294 | E290-Q292 PolarHBondContact O-N 3Å; Q292-D294 PolarHBondContact O-N 3.4Å | ||
| 293 | V | 41.1 | Very low | 42.2 | Very low | 125 Ų | 125 | 142.3 Ų | 142.3 | 76% | 0.758 | 80% | 0.801 | S | S | * | * | trans | -91.9 | 94.5 | 172.2 | -156.4 | 0 | 0 | 0 | 0 | 108 | V291 T295 | V291-V293 PolarHBondContact O-N 3.21Å; V293-T295 PolarHBondContact O-N 3.46Å | ||
| 294 | D | 37.9 | Very low | 42 | Very low | 154 Ų | 154 | 147.3 Ų | 147.3 | 82% | 0.824 | 81% | 0.805 | S | S | * | * | trans | -64.3 | 98.3 | 168.7 | -88.1 | -32.4 | 0 | 0 | 0 | 109.6 | Q292 | Q292-D294 PolarHBondContact O-N 3.4Š| ||
| 295 | T | 49.3 | Very low | 41.8 | Very low | 127 Ų | 127 | 150.2 Ų | 150.2 | 78% | 0.779 | 81% | 0.81 | S | S | * | * | trans | -115.6 | 80.5 | 166.2 | -49.1 | 0 | 0 | 0 | 0 | 109.1 | V293 | V293-T295 PolarHBondContact O-N 3.46Š| ||
| 296 | A | 39.8 | Very low | 41.9 | Very low | 84 Ų | 84 | 145.8 Ų | 145.8 | 69% | 0.694 | 81% | 0.805 | S | S | * | * | trans | -148.4 | 98.3 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 297 | L | 34.6 | Very low | 41.9 | Very low | 180 Ų | 180 | 146.9 Ų | 146.9 | 94% | 0.942 | 81% | 0.807 | S | S | * | * | trans | -178.6 | 96.1 | 138.7 | -117.6 | 122.3 | 0 | 0 | 0 | 110.7 | ||||
| 298 | A | 38.3 | Very low | 41.9 | Very low | 101 Ų | 101 | 145.9 Ų | 145.9 | 84% | 0.835 | 81% | 0.809 | S | S | * | * | trans | -160.3 | 63.3 | 157.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 299 | T | 39.4 | Very low | 41.7 | Very low | 131 Ų | 131 | 145.4 Ų | 145.4 | 80% | 0.804 | 81% | 0.812 | S | S | * | * | trans | -140.1 | 118 | 148.6 | 48.9 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 300 | S | 33.5 | Very low | 41.6 | Very low | 97 Ų | 97 | 140.7 Ų | 140.7 | 68% | 0.678 | 81% | 0.811 | S | S | * | * | 173.3 | 157 | 68.4 | 47.9 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 301 | H | 36.5 | Very low | 41.3 | Very low | 167 Ų | 167 | 135.7 Ų | 135.7 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | trans | 81.7 | 114.5 | 154.5 | -57.1 | -60.5 | 0 | 0 | 0 | 121.2 | ||||
| 302 | T | 34.9 | Very low | 41.5 | Very low | 142 Ų | 142 | 138.4 Ų | 138.4 | 87% | 0.871 | 81% | 0.809 | S | S | * | * | -169.4 | 130 | 97.8 | 26.5 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 303 | D | 42.3 | Very low | 42 | Very low | 170 Ų | 170 | 138.4 Ų | 138.4 | 91% | 0.909 | 81% | 0.814 | S | S | * | * | trans | -55.6 | 136.2 | 161.3 | -89.9 | -50.2 | 0 | 0 | 0 | 111.4 | ||||
| 304 | R | 39.8 | Very low | 42.8 | Very low | 240 Ų | 240 | 137.5 Ų | 137.5 | 91% | 0.906 | 81% | 0.813 | S | S | * | * | trans | -160 | 113 | 140.5 | -154.3 | 169.4 | 158.8 | 90.5 | 2.2 | 113 | ||||
| 305 | E | 43.4 | Very low | 43.7 | Very low | 186 Ų | 186 | 137.4 Ų | 137.4 | 87% | 0.869 | 81% | 0.813 | S | S | * | * | trans | -39.7 | 127.3 | 156.2 | -175.1 | 173.6 | 138 | 0 | 0 | 114.7 | ||||
| 306 | A | 39.5 | Very low | 43.7 | Very low | 91 Ų | 91 | 140.8 Ų | 140.8 | 75% | 0.752 | 84% | 0.842 | S | S | * | * | trans | -172.5 | 137.7 | 142.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 307 | T | 47.1 | Very low | 43.9 | Very low | 134 Ų | 134 | 143.7 Ų | 143.7 | 82% | 0.822 | 85% | 0.849 | S | S | * | * | trans | -54.4 | 160.5 | -179.1 | 44.6 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 308 | P | 53.9 | Low | 44.4 | Very low | 129 Ų | 129 | 141.7 Ų | 141.7 | 84% | 0.838 | 85% | 0.845 | S | S | * | * | -132.9 | 131.6 | 113.7 | 34 | -22.2 | 0 | 0 | 0 | 113.4 | |||||
| 309 | D | 42.2 | Very low | 44.8 | Very low | 167 Ų | 167 | 144 Ų | 144 | 89% | 0.893 | 85% | 0.845 | S | S | * | * | trans | -64.5 | 142.5 | 160.1 | -179.5 | 28.8 | 0 | 0 | 0 | 110.4 | ||||
| 310 | G | 44.2 | Very low | 45.1 | Very low | 76 Ų | 76 | 144.8 Ų | 144.8 | 78% | 0.784 | 85% | 0.848 | S | S | * | * | trans | 133.4 | 101.6 | 163.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 311 | G | 41.6 | Very low | 45.8 | Very low | 66 Ų | 66 | 147.8 Ų | 147.8 | 68% | 0.68 | 86% | 0.858 | S | S | * | * | trans | 138.6 | 83.6 | 163.6 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 312 | E | 51.1 | Low | 46.4 | Very low | 184 Ų | 184 | 146.5 Ų | 146.5 | 86% | 0.86 | 86% | 0.864 | S | S | * | * | 57.3 | 100.2 | 91.9 | -66.7 | -177.3 | 131.3 | 0 | 0 | 113.5 | |||||
| 313 | D | 51.7 | Low | 47.2 | Very low | 155 Ų | 155 | 146.8 Ų | 146.8 | 83% | 0.829 | 86% | 0.863 | S | S | * | * | 161.9 | 147.3 | 110.5 | -94.2 | -27.3 | 0 | 0 | 0 | 115.1 | |||||
| 314 | S | 58.5 | Low | 47.6 | Very low | 106 Ų | 106 | 145 Ų | 145 | 74% | 0.741 | 86% | 0.86 | S | S | * | * | trans | 87.1 | 111.1 | 146.7 | -72.3 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 315 | D | 55.8 | Low | 48.3 | Very low | 153 Ų | 153 | 137.1 Ų | 137.1 | 82% | 0.818 | 86% | 0.856 | S | S | * | * | 46.3 | 104.2 | 127.9 | -80.7 | -20.7 | 0 | 0 | 0 | 120.8 | |||||
| 316 | S | 50.5 | Low | 48.7 | Very low | 198 Ų | 198 | 132.6 Ų | 132.6 | 100% | 1.385 | 86% | 0.855 | S | S | * | * | 163 | 0 | 116.6 | -71.4 | 0 | 0 | 0 | 0 | 111.7 |
Retrieved 316 of 316 residues in 141.7 ms
(Link to these results)