| 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 | 65.9 | Low | 65.3 | Low | 251 Ų | 251 | 127.5 Ų | 127.5 | 100% | 1.236 | 75% | 0.754 | S | S | * | * | 0 | 117.5 | 0 | -80.6 | -177.2 | 148.6 | 0 | 0 | 108.5 | |||||
| 2 | A | 56.9 | Low | 65.9 | Low | 100 Ų | 100 | 133.9 Ų | 133.9 | 83% | 0.826 | 76% | 0.755 | S | S | * | * | trans | -97 | 143.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 3 | P | 62.7 | Low | 67 | Low | 112 Ų | 112 | 129.1 Ų | 129.1 | 73% | 0.727 | 73% | 0.73 | S | S | * | * | trans | -79.4 | 161.4 | -164.3 | 32.8 | -35.6 | 0 | 0 | 0 | 113.3 | G5 | P3-G5 PolarHBondContact O-N 2.78Š| ||
| 4 | P | 63.9 | Low | 67.6 | Low | 139 Ų | 139 | 127.8 Ų | 127.8 | 90% | 0.903 | 72% | 0.715 | S | S | * | * | trans | -78.5 | 79.4 | -172.1 | 33.5 | -34.5 | 0 | 0 | 0 | 111.4 | ||||
| 5 | G | 59.2 | Low | 68 | Low | 76 Ų | 76 | 123.9 Ų | 123.9 | 78% | 0.784 | 69% | 0.692 | S | S | * | * | trans | -105.7 | 34.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | P3 | P3-G5 PolarHBondContact O-N 2.78Š| ||
| 6 | G | 66.1 | Low | 68.6 | Low | 57 Ų | 57 | 123 Ų | 123 | 59% | 0.588 | 68% | 0.678 | S | S | * | * | trans | -78.9 | 122.7 | -170.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | I8 | G6-I8 PolarHBondContact O-N 2.87Š| ||
| 7 | K | 64.2 | Low | 69.5 | Low | 140 Ų | 140 | 122.7 Ų | 122.7 | 61% | 0.609 | 67% | 0.669 | S | S | * | * | trans | 56.9 | 42.6 | 139 | -51.3 | -176.9 | -175 | 171.1 | 0 | 117.2 | N9 R10 | K7-N9 VanDerWaalsContact C-N 3.26Å; K7-N9 PolarHBondContact O-N 2.73Å; K7-R10 HydrophobicContact CB-CB 4.46Å; K7-R10 HydrophobicContact CB-CG 4.26Å | ||
| 8 | I | 65.2 | Low | 70.4 | Confident | 137 Ų | 137 | 122.7 Ų | 122.7 | 70% | 0.703 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | -37.4 | 175.6 | -59.8 | 174.9 | 0 | 0 | 0 | 111.3 | G6 | G6-I8 PolarHBondContact O-N 2.87Š|
| 9 | N | 70.9 | Confident | 71.2 | Confident | 158 Ų | 158 | 120.6 Ų | 120.6 | 85% | 0.845 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.5 | 11.8 | -170.4 | -66.4 | -30.1 | 0 | 0 | 0 | 116.6 | K7 | K7-N9 VanDerWaalsContact C-N 3.26Å; K7-N9 PolarHBondContact O-N 2.73Å |
| 10 | R | 71.7 | Confident | 72 | Confident | 163 Ų | 163 | 122.8 Ų | 122.8 | 62% | 0.615 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -87.6 | 142.9 | -177.3 | -64.8 | -174.3 | -172.2 | 162.4 | 10 | 112.2 | K7 R12 | K7-R10 HydrophobicContact CB-CB 4.46Å; K7-R10 HydrophobicContact CB-CG 4.26Å; R10-R12 PolarHBondContact O-N 3.37Å |
| 11 | P | 71.6 | Confident | 72.8 | Confident | 70 Ų | 70 | 123 Ų | 123 | 46% | 0.455 | 65% | 0.648 | S | S | . | * | trans | -63.7 | 112.4 | 179.4 | 23.4 | -31.4 | 0 | 0 | 0 | 110.9 | T13 K16 K17 | P11-T13 PolarHBondContact O-N 2.9Å; P11-K16 HydrophobicContact CB-CB 3.79Å; P11-K17 HydrophobicContact CB-CG 4.22Å; P11-K17 HydrophobicContact CG-CG 4.13Å | ||
| 12 | R | 72.8 | Confident | 73.8 | Confident | 204 Ų | 204 | 116.2 Ų | 116.2 | 77% | 0.77 | 61% | 0.609 | S | S | * | * | trans | -73.5 | -19.5 | -171.3 | -61.6 | -175 | 177 | -176 | -2.6 | 115.4 | R10 | R10-R12 PolarHBondContact O-N 3.37Š| ||
| 13 | T | 79.8 | Confident | 75.4 | Confident | 71 Ų | 71 | 118.9 Ų | 118.9 | 44% | 0.436 | 60% | 0.597 | S | S | . | * | S | Bend | trans | -128.9 | 153.9 | -173.8 | 65 | 0 | 0 | 0 | 0 | 113.2 | P11 L15 K16 K17 | P11-T13 PolarHBondContact O-N 2.9Å; T13-L15 PolarHBondContact O-N 3.26Å; T13-L15 VanDerWaalsContact O-N 3.16Å; T13-K16 WeakPolarHBondContact O-CA 3.36Å; T13-K16 PolarHBondContact O-N 3.03Å; T13-K16 WeakPolarHBondContact OG1-CG 3.5Å; T13-K16 PolarHBondContact OG1-N 3.02Å; T13-K17 WeakPolarHBondContact O-CG 3.36Å; T13-K17 PolarHBondContact O-N 3.46Å |
| 14 | E | 76.1 | Confident | 76.6 | Confident | 111 Ų | 111 | 122.2 Ų | 122.2 | 52% | 0.519 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -54.1 | -34.1 | 178.8 | -68.6 | -55.1 | 123.5 | 0 | 0 | 113.7 | K17 K18 | E14-K17 IonicContact OE1-NZ 2.74Å; E14-K17 PolarHBondContact OE1-NZ 2.86Å; E14-K18 PolarHBondContact O-N 3.46Å; E14-K18 VanDerWaalsContact O-N 3.11Å |
| 15 | L | 74 | Confident | 77.8 | Confident | 70 Ų | 70 | 117.4 Ų | 117.4 | 37% | 0.366 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -72.2 | -38.9 | 173.7 | -75.5 | 173.3 | 0 | 0 | 0 | 112.6 | T13 K17 K18 K21 R22 V25 | T13-L15 PolarHBondContact O-N 3.26Å; T13-L15 VanDerWaalsContact O-N 3.16Å; L15-K17 VanDerWaalsContact C-N 3.31Å; L15-K18 CarbonylContact O-C 3.14Å; L15-K18 PolarHBondContact O-N 3.5Å; L15-K21 HydrophobicContact CD2-CB 4.16Å; L15-K21 HydrophobicContact CD2-CD 4Å; L15-K21 HydrophobicContact CD2-CG 3.83Å; L15-R22 HydrophobicContact CB-CB 4.28Å; L15-R22 VanDerWaalsContact O-CB 3.25Å; L15-R22 WeakPolarHBondContact O-CB 3.47Å; L15-V25 HydrophobicContact CD2-CG2 4.4Å |
| 16 | K | 77.6 | Confident | 79.1 | Confident | 109 Ų | 109 | 116.9 Ų | 116.9 | 47% | 0.474 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -70.2 | -31 | 177.3 | -76 | -177.6 | 176.8 | -176.7 | 0 | 111.9 | P11 T13 | P11-K16 HydrophobicContact CB-CB 3.79Å; T13-K16 WeakPolarHBondContact O-CA 3.36Å; T13-K16 PolarHBondContact O-N 3.03Å; T13-K16 WeakPolarHBondContact OG1-CG 3.5Å; T13-K16 PolarHBondContact OG1-N 3.02Å |
| 17 | K | 83.8 | Confident | 80 | Confident | 118 Ų | 118 | 116.3 Ų | 116.3 | 51% | 0.513 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.9 | -41.3 | 169.5 | -64.7 | 175.8 | -172.4 | 173.1 | 0 | 111.1 | P11 T13 E14 L15 L19 | P11-K17 HydrophobicContact CB-CG 4.22Å; P11-K17 HydrophobicContact CG-CG 4.13Å; T13-K17 WeakPolarHBondContact O-CG 3.36Å; T13-K17 PolarHBondContact O-N 3.46Å; E14-K17 IonicContact OE1-NZ 2.74Å; E14-K17 PolarHBondContact OE1-NZ 2.86Å; L15-K17 VanDerWaalsContact C-N 3.31Å; K17-L19 PolarHBondContact O-N 3.05Å |
| 18 | K | 85.6 | Confident | 80.9 | Confident | 122 Ų | 122 | 116.3 Ų | 116.3 | 53% | 0.53 | 53% | 0.526 | S | S | . | . | S | Bend | trans | -99 | 75.7 | 178.9 | -61.8 | 179.1 | -176.7 | 178.6 | 0 | 111.3 | E14 L15 F20 K21 R22 | E14-K18 PolarHBondContact O-N 3.46Å; E14-K18 VanDerWaalsContact O-N 3.11Å; L15-K18 CarbonylContact O-C 3.14Å; L15-K18 PolarHBondContact O-N 3.5Å; K18-F20 VanDerWaalsContact C-N 3.27Å; K18-F20 PolarHBondContact O-N 2.98Å; K18-F20 VanDerWaalsContact O-N 3.12Å; K18-K21 HydrophobicContact CB-CB 4.08Å; K18-K21 WeakPolarHBondContact O-CB 3.48Å; K18-K21 PolarHBondContact O-N 3.49Å; K18-R22 PolarHBondContact O-N 3Å; K18-R22 VanDerWaalsContact O-N 3.14Å |
| 19 | L | 84.5 | Confident | 81.4 | Confident | 84 Ų | 84 | 113.4 Ų | 113.4 | 44% | 0.44 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -49 | -43.6 | -171.9 | -170.5 | 149.1 | 0 | 0 | 0 | 113.9 | K17 R22 R23 | K17-L19 PolarHBondContact O-N 3.05Å; L19-R22 PolarHBondContact O-N 3.5Å; L19-R23 HydrophobicContact CD2-CG 4.42Å; L19-R23 PolarHBondContact O-N 3.27Å |
| 20 | F | 87.8 | Confident | 82 | Confident | 164 Ų | 164 | 112.8 Ų | 112.8 | 72% | 0.719 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -66.6 | -37.9 | 179.2 | -64.4 | -66.4 | 0 | 0 | 0 | 112.9 | K18 R22 R23 R24 | K18-F20 VanDerWaalsContact C-N 3.27Å; K18-F20 PolarHBondContact O-N 2.98Å; K18-F20 VanDerWaalsContact O-N 3.12Å; F20-R22 VanDerWaalsContact C-N 3.33Å; F20-R22 PolarHBondContact O-N 3.39Å; F20-R23 PolarHBondContact O-N 3.14Å; F20-R24 WeakPolarHBondContact O-CB 3.43Å; F20-R24 PolarHBondContact O-N 2.95Å |
| 21 | K | 89.9 | Confident | 82 | Confident | 126 Ų | 126 | 113.5 Ų | 113.5 | 55% | 0.548 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.4 | -36.3 | 176 | -162.4 | 177.2 | -177.1 | 179.7 | 0 | 111.2 | L15 K18 R24 V25 | L15-K21 HydrophobicContact CD2-CB 4.16Å; L15-K21 HydrophobicContact CD2-CD 4Å; L15-K21 HydrophobicContact CD2-CG 3.83Å; K18-K21 HydrophobicContact CB-CB 4.08Å; K18-K21 WeakPolarHBondContact O-CB 3.48Å; K18-K21 PolarHBondContact O-N 3.49Å; K21-R24 PolarHBondContact O-N 3.47Å; K21-V25 WeakPolarHBondContact O-CG2 3.36Å; K21-V25 PolarHBondContact O-N 3.16Å |
| 22 | R | 86.1 | Confident | 82 | Confident | 109 Ų | 109 | 119.3 Ų | 119.3 | 41% | 0.411 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64 | -49.4 | 174.6 | 175.2 | 172.9 | 179.5 | -99.2 | -3.2 | 112.6 | L15 K18 L19 F20 R24 V25 L26 | L15-R22 HydrophobicContact CB-CB 4.28Å; L15-R22 VanDerWaalsContact O-CB 3.25Å; L15-R22 WeakPolarHBondContact O-CB 3.47Å; K18-R22 PolarHBondContact O-N 3Å; K18-R22 VanDerWaalsContact O-N 3.14Å; L19-R22 PolarHBondContact O-N 3.5Å; F20-R22 VanDerWaalsContact C-N 3.33Å; F20-R22 PolarHBondContact O-N 3.39Å; R22-R24 VanDerWaalsContact C-N 3.25Å; R22-R24 PolarHBondContact O-N 2.93Å; R22-V25 PolarHBondContact O-N 3.37Å; R22-L26 HydrophobicContact CG-CD1 3.78Å; R22-L26 HydrophobicContact CG-CG 4.47Å; R22-L26 WeakPolarHBondContact O-CB 3.48Å; R22-L26 VanDerWaalsContact O-CG 3.24Å; R22-L26 WeakPolarHBondContact O-CG 3.49Å; R22-L26 PolarHBondContact O-N 3.48Å |
| 23 | R | 90.6 | Very high | 81.4 | Confident | 157 Ų | 157 | 117.1 Ų | 117.1 | 59% | 0.592 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -59.1 | -40.6 | 175.3 | -72.6 | -176.6 | 177.1 | -178.3 | 1 | 111.3 | L19 F20 L26 S27 | L19-R23 HydrophobicContact CD2-CG 4.42Å; L19-R23 PolarHBondContact O-N 3.27Å; F20-R23 PolarHBondContact O-N 3.14Å; R23-L26 PolarHBondContact O-N 3.36Å; R23-S27 WeakPolarHBondContact O-CB 3.44Å; R23-S27 PolarHBondContact O-N 2.99Å; R23-S27 PolarHBondContact O-OG 3.32Å |
| 24 | R | 86.9 | Confident | 81 | Confident | 181 Ų | 181 | 122.5 Ų | 122.5 | 68% | 0.683 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.4 | -44.9 | 178.3 | -170.2 | -177.5 | -67.8 | -175.8 | -1.4 | 112.9 | F20 K21 R22 R28 | F20-R24 WeakPolarHBondContact O-CB 3.43Å; F20-R24 PolarHBondContact O-N 2.95Å; K21-R24 PolarHBondContact O-N 3.47Å; R22-R24 VanDerWaalsContact C-N 3.25Å; R22-R24 PolarHBondContact O-N 2.93Å; R24-R28 WeakPolarHBondContact O-CB 3.48Å; R24-R28 PolarHBondContact O-N 3.04Å; R24-R28 VanDerWaalsContact O-N 3.13Å |
| 25 | V | 89.4 | Confident | 80.7 | Confident | 39 Ų | 39 | 121.9 Ų | 121.9 | 24% | 0.236 | 52% | 0.518 | C | S | . | . | H | α-helix | trans | -65.5 | -45.7 | 175.3 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | L15 K21 R22 S27 R28 D29 | L15-V25 HydrophobicContact CD2-CG2 4.4Å; K21-V25 WeakPolarHBondContact O-CG2 3.36Å; K21-V25 PolarHBondContact O-N 3.16Å; R22-V25 PolarHBondContact O-N 3.37Å; V25-S27 VanDerWaalsContact C-N 3.34Å; V25-S27 PolarHBondContact O-N 3.08Å; V25-R28 PolarHBondContact O-N 3.41Å; V25-D29 PolarHBondContact O-N 3.1Å |
| 26 | L | 86.7 | Confident | 80.3 | Confident | 65 Ų | 65 | 121.1 Ų | 121.1 | 34% | 0.34 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -62 | -39.7 | -179 | -72 | 169.7 | 0 | 0 | 0 | 112.8 | R22 R23 R30 | R22-L26 HydrophobicContact CG-CD1 3.78Å; R22-L26 HydrophobicContact CG-CG 4.47Å; R22-L26 WeakPolarHBondContact O-CB 3.48Å; R22-L26 VanDerWaalsContact O-CG 3.24Å; R22-L26 WeakPolarHBondContact O-CG 3.49Å; R22-L26 PolarHBondContact O-N 3.48Å; R23-L26 PolarHBondContact O-N 3.36Å; L26-R30 WeakPolarHBondContact O-CG 3.42Å; L26-R30 PolarHBondContact O-N 2.95Å |
| 27 | S | 85.9 | Confident | 79.5 | Confident | 45 Ų | 45 | 119.6 Ų | 119.6 | 32% | 0.315 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -74.6 | -33.3 | 177.6 | -68.1 | 0 | 0 | 0 | 0 | 112.8 | R23 V25 R30 R31 | R23-S27 WeakPolarHBondContact O-CB 3.44Å; R23-S27 PolarHBondContact O-N 2.99Å; R23-S27 PolarHBondContact O-OG 3.32Å; V25-S27 VanDerWaalsContact C-N 3.34Å; V25-S27 PolarHBondContact O-N 3.08Å; S27-R30 WeakPolarHBondContact O-CB 3.46Å; S27-R30 PolarHBondContact O-N 3.44Å; S27-R31 WeakPolarHBondContact O-CG 3.47Å; S27-R31 PolarHBondContact O-N 2.95Å |
| 28 | R | 82.4 | Confident | 78.6 | Confident | 140 Ų | 140 | 116.1 Ų | 116.1 | 53% | 0.528 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -67 | -40.8 | 175.2 | -157.7 | -168.4 | -29.6 | 158.2 | 12.9 | 111 | R24 V25 R30 R31 R32 | R24-R28 WeakPolarHBondContact O-CB 3.48Å; R24-R28 PolarHBondContact O-N 3.04Å; R24-R28 VanDerWaalsContact O-N 3.13Å; V25-R28 PolarHBondContact O-N 3.41Å; R28-R30 VanDerWaalsContact C-N 3.35Å; R28-R31 PolarHBondContact O-N 3.31Å; R28-R32 PolarHBondContact O-N 2.95Å |
| 29 | D | 76.1 | Confident | 77.6 | Confident | 76 Ų | 76 | 114.2 Ų | 114.2 | 41% | 0.406 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.3 | -42 | 170.1 | -73.4 | -16.6 | 0 | 0 | 0 | 111.1 | V25 R31 K33 | V25-D29 PolarHBondContact O-N 3.1Å; D29-R31 VanDerWaalsContact C-N 3.28Å; D29-R31 PolarHBondContact O-N 3.29Å; D29-K33 VanDerWaalsContact O-CB 3.22Å; D29-K33 WeakPolarHBondContact O-CB 3.29Å; D29-K33 VanDerWaalsContact O-CD 3.25Å; D29-K33 WeakPolarHBondContact O-CD 3.26Å; D29-K33 WeakPolarHBondContact O-CG 3.31Å; D29-K33 PolarHBondContact O-N 3.48Å |
| 30 | R | 82.6 | Confident | 76.8 | Confident | 145 Ų | 145 | 111.4 Ų | 111.4 | 55% | 0.547 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.5 | -30.3 | 175.8 | -73.2 | 171.4 | -154.7 | -170.2 | 2.5 | 113.7 | L26 S27 R28 R34 | L26-R30 WeakPolarHBondContact O-CG 3.42Å; L26-R30 PolarHBondContact O-N 2.95Å; S27-R30 WeakPolarHBondContact O-CB 3.46Å; S27-R30 PolarHBondContact O-N 3.44Å; R28-R30 VanDerWaalsContact C-N 3.35Å; R30-R34 WeakPolarHBondContact O-CG 3.35Å |
| 31 | R | 71.5 | Confident | 75.9 | Confident | 178 Ų | 178 | 109.1 Ų | 109.1 | 67% | 0.672 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -88.2 | -39.1 | -179.2 | -72.5 | -177.8 | -158.6 | 174.6 | 4.1 | 113.3 | S27 R28 D29 K33 R34 | S27-R31 WeakPolarHBondContact O-CG 3.47Å; S27-R31 PolarHBondContact O-N 2.95Å; R28-R31 PolarHBondContact O-N 3.31Å; D29-R31 VanDerWaalsContact C-N 3.28Å; D29-R31 PolarHBondContact O-N 3.29Å; R31-K33 PolarHBondContact O-N 3.24Å; R31-R34 PolarHBondContact O-N 3.49Å |
| 32 | R | 71.6 | Confident | 75.2 | Confident | 192 Ų | 192 | 103.5 Ų | 103.5 | 73% | 0.725 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -59 | -27.7 | 166.2 | -104.4 | -179.6 | 177.7 | 177.8 | -2.1 | 111.6 | R28 R34 | R28-R32 PolarHBondContact O-N 2.95Å; R32-R34 VanDerWaalsContact C-N 3.26Å; R32-R34 PolarHBondContact O-N 2.94Å |
| 33 | K | 61.2 | Low | 74.4 | Confident | 157 Ų | 157 | 105.3 Ų | 105.3 | 68% | 0.683 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.2 | -4.4 | 170.2 | -74.7 | 171.1 | -174.9 | -170.4 | 0 | 115.4 | D29 R31 | D29-K33 VanDerWaalsContact O-CB 3.22Å; D29-K33 WeakPolarHBondContact O-CB 3.29Å; D29-K33 VanDerWaalsContact O-CD 3.25Å; D29-K33 WeakPolarHBondContact O-CD 3.26Å; D29-K33 WeakPolarHBondContact O-CG 3.31Å; D29-K33 PolarHBondContact O-N 3.48Å; R31-K33 PolarHBondContact O-N 3.24Å |
| 34 | R | 70.9 | Confident | 73.8 | Confident | 185 Ų | 185 | 101.6 Ų | 101.6 | 70% | 0.698 | 50% | 0.501 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -125.4 | 13 | -177.2 | -68 | 179.9 | -170.2 | -179.7 | 0.4 | 114.3 | R30 R31 R32 A55 | R30-R34 WeakPolarHBondContact O-CG 3.35Å; R31-R34 PolarHBondContact O-N 3.49Å; R32-R34 VanDerWaalsContact C-N 3.26Å; R32-R34 PolarHBondContact O-N 2.94Å; R34-A55 CarbonylContact C-O 3.54Å; R34-A55 WeakPolarHBondContact CA-O 3.09Å |
| 35 | Q | 69.4 | Low | 73.5 | Confident | 97 Ų | 97 | 94.2 Ų | 94.2 | 45% | 0.453 | 48% | 0.475 | S | S | . | . | trans | -95.3 | 127.1 | -170 | -88.6 | -179.5 | -19.6 | 0 | 0 | 115.4 | V37 R54 A55 S57 A58 | Q35-V37 HydrophobicContact CB-CG2 3.97Å; Q35-R54 CarbonylContact C-O 3.17Å; Q35-A55 PolarHBondContact N-O 3.07Å; Q35-A55 VanDerWaalsContact N-O 3.12Å; Q35-S57 CarbonylContact O-C 3.09Å; Q35-A58 PolarHBondContact O-N 2.64Å | ||
| 36 | V | 66.1 | Low | 73 | Confident | 55 Ų | 55 | 93 Ų | 93 | 33% | 0.333 | 47% | 0.468 | S | S | . | . | trans | -74.2 | 113.3 | 155 | 171 | 0 | 0 | 0 | 0 | 108.7 | L51 R54 A55 | V36-L51 WeakPolarHBondContact CG2-O 3.49Å; V36-R54 WeakPolarHBondContact CA-O 3.37Å; V36-R54 HydrophobicContact CB-CB 3.77Å; V36-R54 HydrophobicContact CB-CG 3.89Å; V36-R54 HydrophobicContact CG1-CB 3.58Å; V36-R54 HydrophobicContact CG1-CG 3.61Å; V36-R54 HydrophobicContact CG2-CB 3.76Å; V36-R54 HydrophobicContact CG2-CG 4.43Å; V36-R54 PolarHBondContact N-O 3.06Å; V36-R54 VanDerWaalsContact N-O 3.09Å; V36-A55 VanDerWaalsContact CG2-CA 3.41Å; V36-A55 HydrophobicContact CG2-CB 3.79Å | ||
| 37 | V | 60.1 | Low | 72.7 | Confident | 76 Ų | 76 | 93.3 Ų | 93.3 | 46% | 0.461 | 47% | 0.472 | S | S | . | . | trans | -115.3 | 109.9 | 178.2 | -171.5 | 0 | 0 | 0 | 0 | 113 | Q35 R54 A58 | Q35-V37 HydrophobicContact CB-CG2 3.97Å; V37-R54 PolarHBondContact O-NE 3.3Å; V37-R54 PolarHBondContact O-NH1 2.81Å; V37-A58 HydrophobicContact CB-CB 3.7Å; V37-A58 HydrophobicContact CG2-CB 3.46Å; V37-A58 VanDerWaalsContact CG2-CB 3.46Å | ||
| 38 | G | 64.6 | Low | 72.4 | Confident | 45 Ų | 45 | 100 Ų | 100 | 46% | 0.464 | 50% | 0.495 | S | S | . | . | S | Bend | trans | 127.2 | 157.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | V40 R54 I62 | G38-V40 PolarHBondContact O-N 3.27Å; G38-R54 PolarHBondContact O-NH1 3Å; G38-R54 VanDerWaalsContact O-NH1 3.08Å; G38-I62 VanDerWaalsContact O-CD1 3.25Å; G38-I62 WeakPolarHBondContact O-CD1 3.36Å |
| 39 | A | 64.6 | Low | 72.2 | Confident | 83 Ų | 83 | 98.2 Ų | 98.2 | 69% | 0.686 | 49% | 0.493 | S | S | * | . | trans | -62.1 | 126.2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | I41 I62 | A39-I41 PolarHBondContact O-N 3.24Å; A39-I41 VanDerWaalsContact O-N 3.13Å; A39-I62 WeakPolarHBondContact O-CD1 3.45Å | ||
| 40 | V | 67.6 | Low | 72.3 | Confident | 24 Ų | 24 | 96 Ų | 96 | 15% | 0.145 | 48% | 0.48 | C | S | . | . | trans | -76.6 | 95.2 | 172.6 | -172 | 0 | 0 | 0 | 0 | 107.2 | G38 D42 E43 T46 L51 I62 | G38-V40 PolarHBondContact O-N 3.27Å; V40-D42 PolarHBondContact O-N 3.41Å; V40-E43 HydrophobicContact CB-CG 4.02Å; V40-E43 HydrophobicContact CG1-CG 4.15Å; V40-E43 WeakPolarHBondContact O-CG 3.35Å; V40-T46 HydrophobicContact CG1-CG2 3.65Å; V40-T46 VanDerWaalsContact CG1-OG1 3.27Å; V40-T46 WeakPolarHBondContact CG1-OG1 3.47Å; V40-L51 HydrophobicContact CG1-CD2 4.31Å; V40-L51 HydrophobicContact CG2-CD2 3.69Å; V40-I62 HydrophobicContact CB-CD1 3.81Å; V40-I62 HydrophobicContact CG1-CD1 4.32Å; V40-I62 HydrophobicContact CG2-CD1 3.44Å; V40-I62 VanDerWaalsContact CG2-CD1 3.44Å | ||
| 41 | I | 70 | Confident | 72 | Confident | 117 Ų | 117 | 92.6 Ų | 92.6 | 60% | 0.6 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -30.9 | -174.4 | -58.4 | -178.8 | 0 | 0 | 0 | 112.2 | A39 T63 | A39-I41 PolarHBondContact O-N 3.24Å; A39-I41 VanDerWaalsContact O-N 3.13Å; I41-T63 HydrophobicContact CB-CG2 4.03Å; I41-T63 HydrophobicContact CD1-CG2 3.6Å; I41-T63 HydrophobicContact CG1-CG2 3.77Å |
| 42 | D | 74.6 | Confident | 72.3 | Confident | 8 Ų | 8 | 91.3 Ų | 91.3 | 4% | 0.043 | 47% | 0.472 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -113.7 | 48.2 | -171.7 | -60.9 | -53.4 | 0 | 0 | 0 | 112.3 | V40 G44 L45 T46 L64 R69 | V40-D42 PolarHBondContact O-N 3.41Å; D42-G44 VanDerWaalsContact C-N 3.31Å; D42-G44 PolarHBondContact O-N 3.5Å; D42-G44 VanDerWaalsContact O-N 3.13Å; D42-L45 HydrophobicContact CB-CB 4.28Å; D42-L45 CarbonylContact O-C 3.53Å; D42-L45 WeakPolarHBondContact O-CA 3.25Å; D42-L45 PolarHBondContact O-N 3Å; D42-T46 HydrophobicContact CB-CG2 4.02Å; D42-T46 WeakPolarHBondContact O-CG2 3.21Å; D42-T46 PolarHBondContact O-N 3.03Å; D42-T46 PolarHBondContact O-OG1 3.08Å; D42-L64 HydrophobicContact CB-CD1 4.24Å; D42-L64 HydrophobicContact CB-CG 4.33Å; D42-L64 PolarHBondContact OD2-N 3.47Å; D42-R69 WeakPolarHBondContact OD1-CD 3.33Å; D42-R69 IonicContact OD1-CZ 3.11Å; D42-R69 IonicContact OD1-NE 3.07Å; D42-R69 PolarHBondContact OD1-NE 3.38Å; D42-R69 VanDerWaalsContact OD1-NE 3.07Å; D42-R69 IonicContact OD1-NH1 3.14Å; D42-R69 PolarHBondContact OD1-NH1 3.06Å; D42-R69 VanDerWaalsContact OD1-NH1 3.14Å; D42-R69 IonicContact OD1-NH2 3.87Å |
| 43 | E | 70.7 | Confident | 72.6 | Confident | 146 Ų | 146 | 87.7 Ų | 87.7 | 68% | 0.682 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.8 | -44.7 | -169 | -58 | -166.1 | 155.2 | 0 | 0 | 114.5 | V40 L45 T46 | V40-E43 HydrophobicContact CB-CG 4.02Å; V40-E43 HydrophobicContact CG1-CG 4.15Å; V40-E43 WeakPolarHBondContact O-CG 3.35Å; E43-L45 PolarHBondContact O-N 3.13Å; E43-T46 WeakPolarHBondContact CA-OG1 3.27Å; E43-T46 PolarHBondContact O-OG1 3.14Å; E43-T46 VanDerWaalsContact O-OG1 3.06Å |
| 44 | G | 77.4 | Confident | 73.1 | Confident | 79 Ų | 79 | 81.7 Ų | 81.7 | 81% | 0.814 | 43% | 0.434 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.9 | -9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | D42 | D42-G44 VanDerWaalsContact C-N 3.31Å; D42-G44 PolarHBondContact O-N 3.5Å; D42-G44 VanDerWaalsContact O-N 3.13Å |
| 45 | L | 80.6 | Confident | 73.2 | Confident | 26 Ų | 26 | 74.5 Ų | 74.5 | 14% | 0.136 | 41% | 0.414 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -115.7 | -20.6 | 178.7 | -58.4 | 171.4 | 0 | 0 | 0 | 111.9 | D42 E43 T47 L64 R69 L72 L73 I76 | D42-L45 HydrophobicContact CB-CB 4.28Å; D42-L45 CarbonylContact O-C 3.53Å; D42-L45 WeakPolarHBondContact O-CA 3.25Å; D42-L45 PolarHBondContact O-N 3Å; E43-L45 PolarHBondContact O-N 3.13Å; L45-T47 PolarHBondContact O-N 3.27Å; L45-L64 HydrophobicContact CB-CD1 3.45Å; L45-L64 VanDerWaalsContact CB-CD1 3.45Å; L45-L64 HydrophobicContact CD1-CD1 4.46Å; L45-R69 HydrophobicContact CD1-CG 3.69Å; L45-L72 HydrophobicContact CB-CD1 4.34Å; L45-L72 HydrophobicContact CD2-CB 3.91Å; L45-L73 HydrophobicContact CD1-CD1 4.29Å; L45-L73 HydrophobicContact CD1-CD2 4.01Å; L45-L73 HydrophobicContact CD1-CG 3.87Å; L45-L73 HydrophobicContact CD2-CD2 4.13Å; L45-L73 HydrophobicContact CD2-CG 4.38Å; L45-I76 HydrophobicContact CD2-CD1 3.63Å |
| 46 | T | 78.4 | Confident | 73.3 | Confident | 15 Ų | 15 | 74.5 Ų | 74.5 | 9% | 0.092 | 43% | 0.425 | C | S | . | . | trans | -73.8 | 122.1 | 177.1 | 49.4 | 0 | 0 | 0 | 0 | 110.6 | V40 D42 E43 I62 L64 | V40-T46 HydrophobicContact CG1-CG2 3.65Å; V40-T46 VanDerWaalsContact CG1-OG1 3.27Å; V40-T46 WeakPolarHBondContact CG1-OG1 3.47Å; D42-T46 HydrophobicContact CB-CG2 4.02Å; D42-T46 WeakPolarHBondContact O-CG2 3.21Å; D42-T46 PolarHBondContact O-N 3.03Å; D42-T46 PolarHBondContact O-OG1 3.08Å; E43-T46 WeakPolarHBondContact CA-OG1 3.27Å; E43-T46 PolarHBondContact O-OG1 3.14Å; E43-T46 VanDerWaalsContact O-OG1 3.06Å; T46-I62 WeakPolarHBondContact CG2-O 3.2Å; T46-L64 HydrophobicContact CG2-CG 4.31Å | ||
| 47 | T | 79.9 | Confident | 73.6 | Confident | 70 Ų | 70 | 74.5 Ų | 74.5 | 43% | 0.429 | 43% | 0.428 | S | S | . | . | trans | -77.8 | 160.1 | -179.9 | 60.5 | 0 | 0 | 0 | 0 | 111.5 | L45 H49 H50 L51 | L45-T47 PolarHBondContact O-N 3.27Å; T47-H49 PolarHBondContact O-N 3.02Å; T47-H50 WeakPolarHBondContact O-CB 3.5Å; T47-H50 PolarHBondContact O-N 2.78Å; T47-H50 PolarHBondContact OG1-CD2 2.93Å; T47-L51 PolarHBondContact O-N 2.87Å | ||
| 48 | K | 80.4 | Confident | 74.1 | Confident | 185 Ų | 185 | 73.1 Ų | 73.1 | 80% | 0.804 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -46.6 | -31.5 | 170.2 | -175.2 | 177 | -178 | 176.5 | 0 | 112.6 | L51 K52 | K48-L51 PolarHBondContact O-N 2.99Å; K48-K52 WeakPolarHBondContact O-CB 3.39Å; K48-K52 PolarHBondContact O-N 3.48Å |
| 49 | H | 78.5 | Confident | 74.4 | Confident | 103 Ų | 103 | 82.1 Ų | 82.1 | 48% | 0.477 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -67 | -37.7 | 176.6 | -179 | -112 | 0 | 0 | 0 | 113.3 | T47 K53 | T47-H49 PolarHBondContact O-N 3.02Å; H49-K53 WeakPolarHBondContact CE1-CE 3.45Å; H49-K53 PolarHBondContact CE1-NZ 3.42Å; H49-K53 WeakPolarHBondContact NE2-CE 3.5Å; H49-K53 WeakPolarHBondContact O-CB 3.44Å; H49-K53 VanDerWaalsContact O-CG 3.32Å; H49-K53 WeakPolarHBondContact O-CG 3.43Å; H49-K53 PolarHBondContact O-N 3.46Å |
| 50 | H | 78.1 | Confident | 75 | Confident | 30 Ų | 30 | 79.3 Ų | 79.3 | 14% | 0.139 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -68.5 | -37.9 | 175.1 | -64.5 | -38.3 | 0 | 0 | 0 | 111.9 | T47 K53 R54 L64 K68 | T47-H50 WeakPolarHBondContact O-CB 3.5Å; T47-H50 PolarHBondContact O-N 2.78Å; T47-H50 PolarHBondContact OG1-CD2 2.93Å; H50-K53 PolarHBondContact O-N 3.13Å; H50-R54 PolarHBondContact O-N 3.14Å; H50-L64 WeakPolarHBondContact NE2-CD2 3.45Å; H50-K68 PolarHBondContact NE2-NZ 3.49Å |
| 51 | L | 75 | Confident | 75.2 | Confident | 74 Ų | 74 | 83.9 Ų | 83.9 | 39% | 0.387 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -68.9 | -43.1 | 175.7 | -60.5 | 176.1 | 0 | 0 | 0 | 112 | V36 V40 T47 K48 K53 R54 A55 | V36-L51 WeakPolarHBondContact CG2-O 3.49Å; V40-L51 HydrophobicContact CG1-CD2 4.31Å; V40-L51 HydrophobicContact CG2-CD2 3.69Å; T47-L51 PolarHBondContact O-N 2.87Å; K48-L51 PolarHBondContact O-N 2.99Å; L51-K53 VanDerWaalsContact C-N 3.28Å; L51-K53 PolarHBondContact O-N 3.43Å; L51-R54 PolarHBondContact O-N 2.95Å; L51-A55 PolarHBondContact O-N 3.41Å |
| 52 | K | 79.3 | Confident | 75.5 | Confident | 151 Ų | 151 | 78.4 Ų | 78.4 | 66% | 0.657 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -62 | -37.1 | 174.3 | -168.1 | 176.1 | -178.7 | -177.9 | 0 | 111.7 | K48 R54 A55 S56 | K48-K52 WeakPolarHBondContact O-CB 3.39Å; K48-K52 PolarHBondContact O-N 3.48Å; K52-R54 VanDerWaalsContact C-N 3.34Å; K52-R54 PolarHBondContact O-N 3.48Å; K52-A55 PolarHBondContact O-N 3.06Å; K52-S56 PolarHBondContact O-N 3.34Å; K52-S56 PolarHBondContact O-OG 3.05Å |
| 53 | K | 76.6 | Confident | 75.6 | Confident | 116 Ų | 116 | 80.3 Ų | 80.3 | 50% | 0.504 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -63.4 | -37.6 | 177.6 | -85.5 | -176.2 | 169 | -173.9 | 0 | 113 | H49 H50 L51 S57 | H49-K53 WeakPolarHBondContact CE1-CE 3.45Å; H49-K53 PolarHBondContact CE1-NZ 3.42Å; H49-K53 WeakPolarHBondContact NE2-CE 3.5Å; H49-K53 WeakPolarHBondContact O-CB 3.44Å; H49-K53 VanDerWaalsContact O-CG 3.32Å; H49-K53 WeakPolarHBondContact O-CG 3.43Å; H49-K53 PolarHBondContact O-N 3.46Å; H50-K53 PolarHBondContact O-N 3.13Å; L51-K53 VanDerWaalsContact C-N 3.28Å; L51-K53 PolarHBondContact O-N 3.43Å; K53-S57 PolarHBondContact O-N 3.29Å |
| 54 | R | 73.3 | Confident | 76 | Confident | 30 Ų | 30 | 74 Ų | 74 | 11% | 0.113 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -82.8 | -27.2 | 177.3 | -151.9 | -170.8 | -126.2 | -177.4 | -4.5 | 111.6 | Q35 V36 V37 G38 H50 L51 K52 S56 S57 A60 I62 | Q35-R54 CarbonylContact C-O 3.17Å; V36-R54 WeakPolarHBondContact CA-O 3.37Å; V36-R54 HydrophobicContact CB-CB 3.77Å; V36-R54 HydrophobicContact CB-CG 3.89Å; V36-R54 HydrophobicContact CG1-CB 3.58Å; V36-R54 HydrophobicContact CG1-CG 3.61Å; V36-R54 HydrophobicContact CG2-CB 3.76Å; V36-R54 HydrophobicContact CG2-CG 4.43Å; V36-R54 PolarHBondContact N-O 3.06Å; V36-R54 VanDerWaalsContact N-O 3.09Å; V37-R54 PolarHBondContact O-NE 3.3Å; V37-R54 PolarHBondContact O-NH1 2.81Å; G38-R54 PolarHBondContact O-NH1 3Å; G38-R54 VanDerWaalsContact O-NH1 3.08Å; H50-R54 PolarHBondContact O-N 3.14Å; L51-R54 PolarHBondContact O-N 2.95Å; K52-R54 VanDerWaalsContact C-N 3.34Å; K52-R54 PolarHBondContact O-N 3.48Å; R54-S56 PolarHBondContact O-N 3.09Å; R54-S56 VanDerWaalsContact O-N 3.11Å; R54-S57 WeakPolarHBondContact CA-O 3.07Å; R54-S57 WeakPolarHBondContact CG-O 3.43Å; R54-S57 CarbonylContact O-C 2.69Å; R54-S57 PolarHBondContact O-N 2.77Å; R54-A60 HydrophobicContact CB-CB 4.39Å; R54-A60 HydrophobicContact CG-CB 4.22Å; R54-A60 PolarHBondContact NE-O 3.33Å; R54-A60 PolarHBondContact NH2-O 2.94Å; R54-I62 HydrophobicContact CB-CG2 3.38Å; R54-I62 HydrophobicContact CG-CG2 3.67Å; R54-I62 VanDerWaalsContact CZ-CG1 3.49Å |
| 55 | A | 73.1 | Confident | 76.3 | Confident | 34 Ų | 34 | 74.4 Ų | 74.4 | 28% | 0.281 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -60.3 | -27.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | R34 Q35 V36 L51 K52 | R34-A55 CarbonylContact C-O 3.54Å; R34-A55 WeakPolarHBondContact CA-O 3.09Å; Q35-A55 PolarHBondContact N-O 3.07Å; Q35-A55 VanDerWaalsContact N-O 3.12Å; V36-A55 VanDerWaalsContact CG2-CA 3.41Å; V36-A55 HydrophobicContact CG2-CB 3.79Å; L51-A55 PolarHBondContact O-N 3.41Å; K52-A55 PolarHBondContact O-N 3.06Å |
| 56 | S | 70.6 | Confident | 76.6 | Confident | 98 Ų | 98 | 75.4 Ų | 75.4 | 69% | 0.685 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.2 | -17.4 | 172.7 | -55.7 | 0 | 0 | 0 | 0 | 114.1 | K52 R54 | K52-S56 PolarHBondContact O-N 3.34Å; K52-S56 PolarHBondContact O-OG 3.05Å; R54-S56 PolarHBondContact O-N 3.09Å; R54-S56 VanDerWaalsContact O-N 3.11Å |
| 57 | S | 72.6 | Confident | 77.2 | Confident | 55 Ų | 55 | 82.2 Ų | 82.2 | 39% | 0.385 | 44% | 0.435 | S | S | . | . | trans | -155.8 | 121.3 | -174.9 | 177.4 | 0 | 0 | 0 | 0 | 113.7 | Q35 K53 R54 R59 A60 | Q35-S57 CarbonylContact O-C 3.09Å; K53-S57 PolarHBondContact O-N 3.29Å; R54-S57 WeakPolarHBondContact CA-O 3.07Å; R54-S57 WeakPolarHBondContact CG-O 3.43Å; R54-S57 CarbonylContact O-C 2.69Å; R54-S57 PolarHBondContact O-N 2.77Å; S57-R59 VanDerWaalsContact C-N 3.26Å; S57-R59 PolarHBondContact O-N 3.42Å; S57-A60 PolarHBondContact O-N 2.82Å | ||
| 58 | A | 71.1 | Confident | 77.5 | Confident | 47 Ų | 47 | 83.4 Ų | 83.4 | 39% | 0.388 | 43% | 0.434 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.9 | -33.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q35 V37 | Q35-A58 PolarHBondContact O-N 2.64Å; V37-A58 HydrophobicContact CB-CB 3.7Å; V37-A58 HydrophobicContact CG2-CB 3.46Å; V37-A58 VanDerWaalsContact CG2-CB 3.46Å |
| 59 | R | 71.3 | Confident | 77.8 | Confident | 233 Ų | 233 | 79.9 Ų | 79.9 | 88% | 0.879 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.9 | -11.6 | -174.9 | -67 | 176.7 | 69.3 | -172.3 | 2.9 | 114 | S57 N61 | S57-R59 VanDerWaalsContact C-N 3.26Å; S57-R59 PolarHBondContact O-N 3.42Å; R59-N61 PolarHBondContact O-N 3Å |
| 60 | A | 75.1 | Confident | 78.4 | Confident | 25 Ų | 25 | 84.2 Ų | 84.2 | 21% | 0.207 | 43% | 0.428 | C | S | . | . | S | Bend | trans | -59 | 135.3 | -173.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | R54 S57 I62 | R54-A60 HydrophobicContact CB-CB 4.39Å; R54-A60 HydrophobicContact CG-CB 4.22Å; R54-A60 PolarHBondContact NE-O 3.33Å; R54-A60 PolarHBondContact NH2-O 2.94Å; S57-A60 PolarHBondContact O-N 2.82Å; A60-I62 PolarHBondContact O-N 2.69Å |
| 61 | N | 73.5 | Confident | 79.1 | Confident | 119 Ų | 119 | 88.8 Ų | 88.8 | 64% | 0.636 | 45% | 0.447 | S | S | * | . | trans | -71.8 | 122.6 | 175.9 | -169.1 | -44.2 | 0 | 0 | 0 | 109.3 | R59 T63 | R59-N61 PolarHBondContact O-N 3Å; N61-T63 PolarHBondContact ND2-OG1 3.34Å; N61-T63 WeakPolarHBondContact OD1-CA 3.17Å; N61-T63 WeakPolarHBondContact OD1-CB 3.44Å; N61-T63 PolarHBondContact OD1-N 3.45Å; N61-T63 PolarHBondContact OD1-O 3.09Å; N61-T63 PolarHBondContact OD1-OG1 2.88Å | ||
| 62 | I | 75 | Confident | 79.8 | Confident | 2 Ų | 2 | 87.5 Ų | 87.5 | 1% | 0.01 | 44% | 0.441 | C | S | . | . | trans | -103 | -11.7 | 176.9 | 53.8 | 176.5 | 0 | 0 | 0 | 113.6 | G38 A39 V40 T46 R54 A60 | G38-I62 VanDerWaalsContact O-CD1 3.25Å; G38-I62 WeakPolarHBondContact O-CD1 3.36Å; A39-I62 WeakPolarHBondContact O-CD1 3.45Å; V40-I62 HydrophobicContact CB-CD1 3.81Å; V40-I62 HydrophobicContact CG1-CD1 4.32Å; V40-I62 HydrophobicContact CG2-CD1 3.44Å; V40-I62 VanDerWaalsContact CG2-CD1 3.44Å; T46-I62 WeakPolarHBondContact CG2-O 3.2Å; R54-I62 HydrophobicContact CB-CG2 3.38Å; R54-I62 HydrophobicContact CG-CG2 3.67Å; R54-I62 VanDerWaalsContact CZ-CG1 3.49Å; A60-I62 PolarHBondContact O-N 2.69Å | ||
| 63 | T | 77.9 | Confident | 80.3 | Confident | 49 Ų | 49 | 83.4 Ų | 83.4 | 30% | 0.301 | 43% | 0.426 | S | S | . | . | S | Bend | trans | -77.1 | 143.5 | 178.4 | 64.2 | 0 | 0 | 0 | 0 | 108.8 | I41 N61 | I41-T63 HydrophobicContact CB-CG2 4.03Å; I41-T63 HydrophobicContact CD1-CG2 3.6Å; I41-T63 HydrophobicContact CG1-CG2 3.77Å; N61-T63 PolarHBondContact ND2-OG1 3.34Å; N61-T63 WeakPolarHBondContact OD1-CA 3.17Å; N61-T63 WeakPolarHBondContact OD1-CB 3.44Å; N61-T63 PolarHBondContact OD1-N 3.45Å; N61-T63 PolarHBondContact OD1-O 3.09Å; N61-T63 PolarHBondContact OD1-OG1 2.88Å |
| 64 | L | 77.8 | Confident | 81.1 | Confident | 14 Ų | 14 | 83.5 Ų | 83.5 | 7% | 0.073 | 43% | 0.428 | C | S | . | . | P | Polyproline II helix | trans | -80 | 141.6 | 174.2 | -61.5 | 176.2 | 0 | 0 | 0 | 108.8 | D42 L45 T46 H50 G66 K68 R69 L72 | D42-L64 HydrophobicContact CB-CD1 4.24Å; D42-L64 HydrophobicContact CB-CG 4.33Å; D42-L64 PolarHBondContact OD2-N 3.47Å; L45-L64 HydrophobicContact CB-CD1 3.45Å; L45-L64 VanDerWaalsContact CB-CD1 3.45Å; L45-L64 HydrophobicContact CD1-CD1 4.46Å; T46-L64 HydrophobicContact CG2-CG 4.31Å; H50-L64 WeakPolarHBondContact NE2-CD2 3.45Å; L64-G66 PolarHBondContact O-N 2.97Å; L64-K68 HydrophobicContact CD2-CD 3.92Å; L64-K68 HydrophobicContact CD2-CG 4.48Å; L64-R69 HydrophobicContact CB-CB 4.25Å; L64-L72 HydrophobicContact CD1-CD1 3.8Å |
| 65 | S | 84.9 | Confident | 82 | Confident | 86 Ų | 86 | 87.9 Ų | 87.9 | 60% | 0.601 | 45% | 0.45 | S | S | * | . | P | Polyproline II helix | trans | -55.2 | 141.2 | 166 | 170.4 | 0 | 0 | 0 | 0 | 109.6 | K67 K68 R69 | S65-K67 PolarHBondContact O-N 3.09Å; S65-K67 VanDerWaalsContact O-N 3.09Å; S65-K68 WeakPolarHBondContact O-CA 3.46Å; S65-K68 WeakPolarHBondContact O-CB 3.34Å; S65-K68 PolarHBondContact O-N 3.08Å; S65-R69 PolarHBondContact O-N 2.91Å |
| 66 | G | 86.9 | Confident | 82.9 | Confident | 47 Ų | 47 | 89.8 Ų | 89.8 | 49% | 0.485 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -52.7 | -36.8 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | L64 R69 R70 | L64-G66 PolarHBondContact O-N 2.97Å; G66-R69 PolarHBondContact O-N 3.28Å; G66-R70 WeakPolarHBondContact O-CB 3.46Å; G66-R70 PolarHBondContact O-N 3.41Å |
| 67 | K | 90.6 | Very high | 84 | Confident | 158 Ų | 158 | 93 Ų | 93 | 69% | 0.687 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -63.7 | -43.2 | 175.3 | -174.3 | 175.4 | -178.1 | 175.9 | 0 | 112.1 | S65 R70 K71 | S65-K67 PolarHBondContact O-N 3.09Å; S65-K67 VanDerWaalsContact O-N 3.09Å; K67-R70 PolarHBondContact O-N 3.23Å; K67-K71 PolarHBondContact O-N 3.31Å; K67-K71 VanDerWaalsContact O-N 3.08Å |
| 68 | K | 86.1 | Confident | 85.1 | Confident | 96 Ų | 96 | 94.7 Ų | 94.7 | 42% | 0.417 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -68.4 | -43.6 | 179 | -175.4 | 173.6 | 175.3 | -169.2 | 0 | 111 | H50 L64 S65 R70 K71 L72 | H50-K68 PolarHBondContact NE2-NZ 3.49Å; L64-K68 HydrophobicContact CD2-CD 3.92Å; L64-K68 HydrophobicContact CD2-CG 4.48Å; S65-K68 WeakPolarHBondContact O-CA 3.46Å; S65-K68 WeakPolarHBondContact O-CB 3.34Å; S65-K68 PolarHBondContact O-N 3.08Å; K68-R70 VanDerWaalsContact C-N 3.34Å; K68-R70 PolarHBondContact O-N 3.38Å; K68-K71 PolarHBondContact O-N 3.44Å; K68-L72 HydrophobicContact CG-CD1 4.18Å; K68-L72 WeakPolarHBondContact O-CG 3.41Å; K68-L72 PolarHBondContact O-N 3.38Å |
| 69 | R | 86.5 | Confident | 86.2 | Confident | 111 Ų | 111 | 95 Ų | 95 | 42% | 0.419 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -55.6 | -49.3 | 173.8 | -175.1 | -179.7 | 176.2 | 172.6 | -3.2 | 111.2 | D42 L45 L64 S65 G66 K71 L72 L73 | D42-R69 WeakPolarHBondContact OD1-CD 3.33Å; D42-R69 IonicContact OD1-CZ 3.11Å; D42-R69 IonicContact OD1-NE 3.07Å; D42-R69 PolarHBondContact OD1-NE 3.38Å; D42-R69 VanDerWaalsContact OD1-NE 3.07Å; D42-R69 IonicContact OD1-NH1 3.14Å; D42-R69 PolarHBondContact OD1-NH1 3.06Å; D42-R69 VanDerWaalsContact OD1-NH1 3.14Å; D42-R69 IonicContact OD1-NH2 3.87Å; L45-R69 HydrophobicContact CD1-CG 3.69Å; L64-R69 HydrophobicContact CB-CB 4.25Å; S65-R69 PolarHBondContact O-N 2.91Å; G66-R69 PolarHBondContact O-N 3.28Å; R69-K71 PolarHBondContact O-N 3.39Å; R69-L72 PolarHBondContact O-N 3.46Å; R69-L73 HydrophobicContact CG-CD1 4.09Å; R69-L73 WeakPolarHBondContact O-CG 3.36Å; R69-L73 PolarHBondContact O-N 3.24Å; R69-L73 VanDerWaalsContact O-N 3.09Å |
| 70 | R | 91.4 | Very high | 87.2 | Confident | 194 Ų | 194 | 89.8 Ų | 89.8 | 73% | 0.732 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -59.5 | -46.7 | 178.6 | -171.3 | -175 | -61 | 171.3 | 0.5 | 112.5 | G66 K67 K68 L73 Q74 | G66-R70 WeakPolarHBondContact O-CB 3.46Å; G66-R70 PolarHBondContact O-N 3.41Å; K67-R70 PolarHBondContact O-N 3.23Å; K68-R70 VanDerWaalsContact C-N 3.34Å; K68-R70 PolarHBondContact O-N 3.38Å; R70-L73 PolarHBondContact O-N 2.93Å; R70-Q74 WeakPolarHBondContact O-CB 3.36Å; R70-Q74 PolarHBondContact O-N 3.12Å |
| 71 | K | 92.7 | Very high | 88.1 | Confident | 126 Ų | 126 | 95.9 Ų | 95.9 | 55% | 0.548 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.7 | -42.9 | 179.9 | -77.1 | -148.1 | 173.9 | -165.5 | 0 | 112.8 | K67 K68 R69 Q74 Q75 | K67-K71 PolarHBondContact O-N 3.31Å; K67-K71 VanDerWaalsContact O-N 3.08Å; K68-K71 PolarHBondContact O-N 3.44Å; R69-K71 PolarHBondContact O-N 3.39Å; K71-Q74 WeakPolarHBondContact O-CB 3.25Å; K71-Q74 PolarHBondContact O-N 3.49Å; K71-Q75 WeakPolarHBondContact O-CG 3.46Å; K71-Q75 PolarHBondContact O-N 3Å |
| 72 | L | 89.3 | Confident | 89 | Confident | 47 Ų | 47 | 96.5 Ų | 96.5 | 25% | 0.246 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -64.8 | -42.3 | 178.5 | -70.1 | 170.5 | 0 | 0 | 0 | 111.6 | L45 L64 K68 R69 Q74 Q75 I76 | L45-L72 HydrophobicContact CB-CD1 4.34Å; L45-L72 HydrophobicContact CD2-CB 3.91Å; L64-L72 HydrophobicContact CD1-CD1 3.8Å; K68-L72 HydrophobicContact CG-CD1 4.18Å; K68-L72 WeakPolarHBondContact O-CG 3.41Å; K68-L72 PolarHBondContact O-N 3.38Å; R69-L72 PolarHBondContact O-N 3.46Å; L72-Q74 VanDerWaalsContact C-N 3.29Å; L72-Q74 PolarHBondContact O-N 3.14Å; L72-Q75 PolarHBondContact O-N 3.47Å; L72-I76 WeakPolarHBondContact O-CG1 3.39Å; L72-I76 PolarHBondContact O-N 3.05Å |
| 73 | L | 90.4 | Very high | 89.8 | Confident | 65 Ų | 65 | 103.5 Ų | 103.5 | 34% | 0.34 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.1 | -38.1 | 174.6 | -72.2 | 170.1 | 0 | 0 | 0 | 112.1 | L45 R69 R70 I76 R77 | L45-L73 HydrophobicContact CD1-CD1 4.29Å; L45-L73 HydrophobicContact CD1-CD2 4.01Å; L45-L73 HydrophobicContact CD1-CG 3.87Å; L45-L73 HydrophobicContact CD2-CD2 4.13Å; L45-L73 HydrophobicContact CD2-CG 4.38Å; R69-L73 HydrophobicContact CG-CD1 4.09Å; R69-L73 WeakPolarHBondContact O-CG 3.36Å; R69-L73 PolarHBondContact O-N 3.24Å; R69-L73 VanDerWaalsContact O-N 3.09Å; R70-L73 PolarHBondContact O-N 2.93Å; L73-I76 PolarHBondContact O-N 3.37Å; L73-R77 VanDerWaalsContact O-CG 3.31Å; L73-R77 WeakPolarHBondContact O-CG 3.22Å; L73-R77 PolarHBondContact O-N 3.13Å |
| 74 | Q | 93.8 | Very high | 90.4 | Very high | 117 Ų | 117 | 103.5 Ų | 103.5 | 55% | 0.547 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.2 | -43.7 | 176 | -172 | 178.4 | 22.6 | 0 | 0 | 111.7 | R70 K71 L72 R77 L78 | R70-Q74 WeakPolarHBondContact O-CB 3.36Å; R70-Q74 PolarHBondContact O-N 3.12Å; K71-Q74 WeakPolarHBondContact O-CB 3.25Å; K71-Q74 PolarHBondContact O-N 3.49Å; L72-Q74 VanDerWaalsContact C-N 3.29Å; L72-Q74 PolarHBondContact O-N 3.14Å; Q74-R77 PolarHBondContact O-N 3.34Å; Q74-L78 HydrophobicContact CG-CD1 4.49Å; Q74-L78 WeakPolarHBondContact O-CG 3.01Å; Q74-L78 PolarHBondContact O-N 3.34Å |
| 75 | Q | 92.6 | Very high | 91 | Very high | 123 Ų | 123 | 105.5 Ų | 105.5 | 58% | 0.575 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62.5 | -44.8 | 177.1 | -73.5 | 176.2 | -20.4 | 0 | 0 | 111.9 | K71 L72 R77 L78 A79 | K71-Q75 WeakPolarHBondContact O-CG 3.46Å; K71-Q75 PolarHBondContact O-N 3Å; L72-Q75 PolarHBondContact O-N 3.47Å; Q75-R77 VanDerWaalsContact C-N 3.31Å; Q75-R77 PolarHBondContact O-N 2.99Å; Q75-L78 PolarHBondContact O-N 3.34Å; Q75-A79 WeakPolarHBondContact O-CB 3.46Å; Q75-A79 PolarHBondContact O-N 3.34Å |
| 76 | I | 91.9 | Very high | 90.8 | Very high | 74 Ų | 74 | 108.3 Ų | 108.3 | 38% | 0.379 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60 | -43.4 | 176.8 | -68.5 | 166.2 | 0 | 0 | 0 | 110.6 | L45 L72 L73 L78 A79 Q80 | L45-I76 HydrophobicContact CD2-CD1 3.63Å; L72-I76 WeakPolarHBondContact O-CG1 3.39Å; L72-I76 PolarHBondContact O-N 3.05Å; L73-I76 PolarHBondContact O-N 3.37Å; I76-L78 PolarHBondContact O-N 3.19Å; I76-A79 PolarHBondContact O-N 3.33Å; I76-Q80 HydrophobicContact CG2-CG 4.42Å; I76-Q80 WeakPolarHBondContact O-CB 3.21Å; I76-Q80 VanDerWaalsContact O-CG 3.26Å; I76-Q80 WeakPolarHBondContact O-CG 3.5Å; I76-Q80 PolarHBondContact O-N 3.05Å |
| 77 | R | 93.7 | Very high | 90.5 | Very high | 164 Ų | 164 | 112.1 Ų | 112.1 | 62% | 0.619 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.6 | -42.8 | 176.8 | -74.5 | 175.3 | -171.4 | 175.2 | 1.2 | 112.7 | L73 Q74 Q75 Q80 K81 | L73-R77 VanDerWaalsContact O-CG 3.31Å; L73-R77 WeakPolarHBondContact O-CG 3.22Å; L73-R77 PolarHBondContact O-N 3.13Å; Q74-R77 PolarHBondContact O-N 3.34Å; Q75-R77 VanDerWaalsContact C-N 3.31Å; Q75-R77 PolarHBondContact O-N 2.99Å; R77-Q80 PolarHBondContact O-N 3.26Å; R77-K81 WeakPolarHBondContact O-CG 3.43Å; R77-K81 PolarHBondContact O-N 2.89Å; R77-K81 VanDerWaalsContact O-N 3.1Å |
| 78 | L | 95.6 | Very high | 89.9 | Confident | 91 Ų | 91 | 109.1 Ų | 109.1 | 48% | 0.476 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.7 | -48.6 | 178 | -71.1 | 172.5 | 0 | 0 | 0 | 111 | Q74 Q75 I76 Q80 K81 E82 | Q74-L78 HydrophobicContact CG-CD1 4.49Å; Q74-L78 WeakPolarHBondContact O-CG 3.01Å; Q74-L78 PolarHBondContact O-N 3.34Å; Q75-L78 PolarHBondContact O-N 3.34Å; I76-L78 PolarHBondContact O-N 3.19Å; L78-Q80 VanDerWaalsContact C-N 3.27Å; L78-Q80 PolarHBondContact O-N 2.88Å; L78-K81 WeakPolarHBondContact O-CB 3.44Å; L78-K81 PolarHBondContact O-N 3.35Å; L78-K81 VanDerWaalsContact O-N 3.08Å; L78-E82 WeakPolarHBondContact O-CG 3.41Å; L78-E82 PolarHBondContact O-N 2.92Å |
| 79 | A | 93.3 | Very high | 89.2 | Confident | 54 Ų | 54 | 111.1 Ų | 111.1 | 45% | 0.446 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -59.6 | -36.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q75 I76 K83 | Q75-A79 WeakPolarHBondContact O-CB 3.46Å; Q75-A79 PolarHBondContact O-N 3.34Å; I76-A79 PolarHBondContact O-N 3.33Å; A79-K83 VanDerWaalsContact O-CB 3.29Å; A79-K83 WeakPolarHBondContact O-CB 3.17Å; A79-K83 PolarHBondContact O-N 2.84Å |
| 80 | Q | 93 | Very high | 88.3 | Confident | 123 Ų | 123 | 116.9 Ų | 116.9 | 58% | 0.575 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -66.2 | -41.7 | 174.7 | -76.8 | 174.2 | -15.3 | 0 | 0 | 112.4 | I76 R77 L78 K83 A84 | I76-Q80 HydrophobicContact CG2-CG 4.42Å; I76-Q80 WeakPolarHBondContact O-CB 3.21Å; I76-Q80 VanDerWaalsContact O-CG 3.26Å; I76-Q80 WeakPolarHBondContact O-CG 3.5Å; I76-Q80 PolarHBondContact O-N 3.05Å; R77-Q80 PolarHBondContact O-N 3.26Å; L78-Q80 VanDerWaalsContact C-N 3.27Å; L78-Q80 PolarHBondContact O-N 2.88Å; Q80-K83 PolarHBondContact O-N 3.23Å; Q80-A84 WeakPolarHBondContact O-CB 3.32Å; Q80-A84 PolarHBondContact O-N 3.38Å |
| 81 | K | 93.6 | Very high | 87.1 | Confident | 154 Ų | 154 | 111.9 Ų | 111.9 | 67% | 0.67 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.8 | -44.9 | 175.9 | -74.7 | -177.8 | 176.3 | -168.1 | 0 | 111.8 | R77 L78 A84 A85 | R77-K81 WeakPolarHBondContact O-CG 3.43Å; R77-K81 PolarHBondContact O-N 2.89Å; R77-K81 VanDerWaalsContact O-N 3.1Å; L78-K81 WeakPolarHBondContact O-CB 3.44Å; L78-K81 PolarHBondContact O-N 3.35Å; L78-K81 VanDerWaalsContact O-N 3.08Å; K81-A84 PolarHBondContact O-N 3.12Å; K81-A85 WeakPolarHBondContact O-CB 3.06Å; K81-A85 PolarHBondContact O-N 3.28Å |
| 82 | E | 92.2 | Very high | 85.3 | Confident | 131 Ų | 131 | 109.7 Ų | 109.7 | 61% | 0.612 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -61.7 | -45.3 | 176.9 | -71.5 | 171.2 | -174 | 0 | 0 | 111.5 | L78 A84 A85 M86 | L78-E82 WeakPolarHBondContact O-CG 3.41Å; L78-E82 PolarHBondContact O-N 2.92Å; E82-A84 PolarHBondContact O-N 3.11Å; E82-A85 PolarHBondContact O-N 3.27Å; E82-M86 PolarHBondContact O-N 3.01Å |
| 83 | K | 92.7 | Very high | 84 | Confident | 149 Ų | 149 | 112.9 Ų | 112.9 | 65% | 0.648 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -60.4 | -45.7 | 176.5 | -172.5 | -179.2 | 177.3 | -172.8 | 0 | 111.7 | A79 Q80 M86 E87 | A79-K83 VanDerWaalsContact O-CB 3.29Å; A79-K83 WeakPolarHBondContact O-CB 3.17Å; A79-K83 PolarHBondContact O-N 2.84Å; Q80-K83 PolarHBondContact O-N 3.23Å; K83-M86 PolarHBondContact O-N 3.45Å; K83-E87 WeakPolarHBondContact O-CB 3.42Å; K83-E87 PolarHBondContact O-N 2.95Å |
| 84 | A | 89.9 | Confident | 82.7 | Confident | 50 Ų | 50 | 119.3 Ų | 119.3 | 41% | 0.413 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -63.7 | -41.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q80 K81 E82 M86 E87 V88 | Q80-A84 WeakPolarHBondContact O-CB 3.32Å; Q80-A84 PolarHBondContact O-N 3.38Å; K81-A84 PolarHBondContact O-N 3.12Å; E82-A84 PolarHBondContact O-N 3.11Å; A84-M86 PolarHBondContact O-N 3.06Å; A84-E87 PolarHBondContact O-N 3.23Å; A84-V88 WeakPolarHBondContact O-CG2 3.24Å; A84-V88 PolarHBondContact O-N 3.29Å |
| 85 | A | 89.4 | Confident | 81.2 | Confident | 56 Ų | 56 | 123.1 Ų | 123.1 | 46% | 0.463 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -63.1 | -41.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | K81 E82 V88 L89 | K81-A85 WeakPolarHBondContact O-CB 3.06Å; K81-A85 PolarHBondContact O-N 3.28Å; E82-A85 PolarHBondContact O-N 3.27Å; A85-V88 PolarHBondContact O-N 3.4Å; A85-L89 PolarHBondContact O-N 2.9Å; A85-L89 VanDerWaalsContact O-N 3.14Å |
| 86 | M | 80.9 | Confident | 79.6 | Confident | 144 Ų | 144 | 121.6 Ų | 121.6 | 71% | 0.709 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -65 | -38.1 | 174.1 | -90.6 | -157.1 | 159.7 | 0 | 0 | 113 | E82 K83 A84 L89 R90 | E82-M86 PolarHBondContact O-N 3.01Å; K83-M86 PolarHBondContact O-N 3.45Å; A84-M86 PolarHBondContact O-N 3.06Å; M86-L89 PolarHBondContact O-N 3.01Å; M86-R90 WeakPolarHBondContact O-CB 3.42Å; M86-R90 PolarHBondContact O-N 3.24Å |
| 87 | E | 81.9 | Confident | 78.1 | Confident | 127 Ų | 127 | 130 Ų | 130 | 59% | 0.593 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -65.4 | -41.5 | 178.5 | -168.3 | 169 | 176 | 0 | 0 | 111.5 | K83 A84 L89 R90 S91 | K83-E87 WeakPolarHBondContact O-CB 3.42Å; K83-E87 PolarHBondContact O-N 2.95Å; A84-E87 PolarHBondContact O-N 3.23Å; E87-L89 PolarHBondContact O-N 3.36Å; E87-R90 WeakPolarHBondContact O-CB 3.43Å; E87-R90 PolarHBondContact O-N 3.11Å; E87-R90 VanDerWaalsContact O-N 3.16Å; E87-S91 WeakPolarHBondContact O-CB 3.45Å; E87-S91 PolarHBondContact O-N 2.94Å; E87-S91 PolarHBondContact O-OG 3.44Å |
| 88 | V | 77.8 | Confident | 76.3 | Confident | 95 Ų | 95 | 129.1 Ų | 129.1 | 58% | 0.576 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -63.5 | -40.3 | 174.4 | 172.9 | 0 | 0 | 0 | 0 | 112.1 | A84 A85 R90 S91 C92 | A84-V88 WeakPolarHBondContact O-CG2 3.24Å; A84-V88 PolarHBondContact O-N 3.29Å; A85-V88 PolarHBondContact O-N 3.4Å; V88-R90 VanDerWaalsContact C-N 3.3Å; V88-R90 PolarHBondContact O-N 3.46Å; V88-S91 PolarHBondContact O-N 2.74Å; V88-S91 PolarHBondContact O-OG 3.42Å; V88-C92 WeakPolarHBondContact O-CB 3.25Å; V88-C92 PolarHBondContact O-N 2.91Å |
| 89 | L | 69.8 | Low | 74 | Confident | 138 Ų | 138 | 138 Ų | 138 | 72% | 0.723 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -65.1 | -33.4 | 173.7 | -83.5 | 159.7 | 0 | 0 | 0 | 112.7 | A85 M86 E87 | A85-L89 PolarHBondContact O-N 2.9Å; A85-L89 VanDerWaalsContact O-N 3.14Å; M86-L89 PolarHBondContact O-N 3.01Å; E87-L89 PolarHBondContact O-N 3.36Å |
| 90 | R | 69.5 | Low | 73.1 | Confident | 232 Ų | 232 | 142.2 Ų | 142.2 | 88% | 0.875 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -75.4 | -36.4 | 176.4 | -99.7 | 178.5 | 155.7 | 173.5 | -5.6 | 113.1 | M86 E87 V88 | M86-R90 WeakPolarHBondContact O-CB 3.42Å; M86-R90 PolarHBondContact O-N 3.24Å; E87-R90 WeakPolarHBondContact O-CB 3.43Å; E87-R90 PolarHBondContact O-N 3.11Å; E87-R90 VanDerWaalsContact O-N 3.16Å; V88-R90 VanDerWaalsContact C-N 3.3Å; V88-R90 PolarHBondContact O-N 3.46Å |
| 91 | S | 65.8 | Low | 72 | Confident | 90 Ų | 90 | 143.2 Ų | 143.2 | 63% | 0.629 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -82.1 | -16.7 | 179.8 | 71.8 | 0 | 0 | 0 | 0 | 112.9 | E87 V88 P93 | E87-S91 WeakPolarHBondContact O-CB 3.45Å; E87-S91 PolarHBondContact O-N 2.94Å; E87-S91 PolarHBondContact O-OG 3.44Å; V88-S91 PolarHBondContact O-N 2.74Å; V88-S91 PolarHBondContact O-OG 3.42Å; S91-P93 WeakPolarHBondContact O-CD 3.48Å |
| 92 | C | 55 | Low | 70.8 | Confident | 80 Ų | 80 | 142.6 Ų | 142.6 | 54% | 0.541 | 71% | 0.711 | S | S | . | * | S | Bend | trans | -61.7 | 118 | 171.9 | -121.4 | 0 | 0 | 0 | 0 | 108.5 | V88 K94 | V88-C92 WeakPolarHBondContact O-CB 3.25Å; V88-C92 PolarHBondContact O-N 2.91Å; C92-K94 PolarHBondContact O-N 3.16Å |
| 93 | P | 61.5 | Low | 69.6 | Low | 113 Ų | 113 | 143.3 Ų | 143.3 | 73% | 0.734 | 72% | 0.717 | S | S | * | * | trans | -59.6 | 119.3 | 177.3 | 23.7 | -30.9 | 0 | 0 | 0 | 107.1 | S91 K95 | S91-P93 WeakPolarHBondContact O-CD 3.48Å; P93-K95 PolarHBondContact O-N 3.32Å | ||
| 94 | K | 62.6 | Low | 68.1 | Low | 200 Ų | 200 | 142.9 Ų | 142.9 | 87% | 0.87 | 72% | 0.721 | S | S | * | * | trans | -56 | 109.9 | 167.8 | -70.5 | -171.6 | 179.8 | -179.2 | 0 | 104.9 | C92 S96 | C92-K94 PolarHBondContact O-N 3.16Å; K94-S96 PolarHBondContact O-N 3.05Å | ||
| 95 | K | 61.8 | Low | 66.7 | Low | 198 Ų | 198 | 149.1 Ų | 149.1 | 86% | 0.861 | 74% | 0.742 | S | S | * | * | trans | -55.3 | 99.9 | 169.4 | -76 | -176.3 | 178.2 | -177.1 | 0 | 105.1 | P93 R97 | P93-K95 PolarHBondContact O-N 3.32Å; K95-R97 VanDerWaalsContact C-N 3.3Å; K95-R97 PolarHBondContact O-N 2.89Å | ||
| 96 | S | 59.6 | Low | 65.1 | Low | 91 Ų | 91 | 155.8 Ų | 155.8 | 64% | 0.636 | 76% | 0.762 | S | S | * | * | trans | -58.5 | 106 | 166.5 | 47.6 | 0 | 0 | 0 | 0 | 103.7 | K94 L98 | K94-S96 PolarHBondContact O-N 3.05Å; S96-L98 PolarHBondContact O-N 3.18Å | ||
| 97 | R | 60.8 | Low | 63.8 | Low | 251 Ų | 251 | 156.7 Ų | 156.7 | 95% | 0.947 | 77% | 0.766 | S | S | * | * | trans | -62 | 90.8 | 162.6 | -77.1 | -175.9 | -176.5 | 176.8 | 0.1 | 104.7 | K95 | K95-R97 VanDerWaalsContact C-N 3.3Å; K95-R97 PolarHBondContact O-N 2.89Å | ||
| 98 | L | 56.3 | Low | 62.3 | Low | 144 Ų | 144 | 159.2 Ų | 159.2 | 75% | 0.754 | 78% | 0.78 | S | S | * | * | trans | -70.6 | 120.8 | 159.8 | -79.9 | 159.2 | 0 | 0 | 0 | 104.8 | S96 | S96-L98 PolarHBondContact O-N 3.18Š| ||
| 99 | F | 47.7 | Very low | 60.9 | Low | 278 Ų | 278 | 165 Ų | 165 | 100% | 1.219 | 80% | 0.799 | S | S | * | * | trans | 7.6 | 0 | 170.4 | -68.1 | -86.4 | 0 | 0 | 0 | 117.6 |
Retrieved 99 of 99 residues in 229.2 ms
(Link to these results)