| 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 | 40.8 | Very low | 70.2 | Confident | 234 Ų | 234 | 141.1 Ų | 141.1 | 100% | 1.153 | 75% | 0.749 | S | S | * | * | 0 | 104.2 | 0 | -68.3 | -61.1 | -166.6 | 0 | 0 | 106.1 | E3 | M1-E3 PolarHBondContact O-N 3.12Å; M1-E3 VanDerWaalsContact O-N 3.12Å | |||
| 2 | S | 46.9 | Very low | 72.3 | Confident | 116 Ų | 116 | 141.4 Ų | 141.4 | 81% | 0.811 | 74% | 0.743 | S | S | * | * | trans | -76.5 | 97.4 | -174.5 | 51.4 | 0 | 0 | 0 | 0 | 109.8 | T4 | S2-T4 PolarHBondContact O-N 3.21Š| ||
| 3 | E | 53.8 | Low | 74.1 | Confident | 184 Ų | 184 | 135.2 Ų | 135.2 | 86% | 0.86 | 71% | 0.708 | S | S | * | * | trans | -59.9 | 110.7 | 156.9 | -74.4 | 168 | 175.8 | 0 | 0 | 107.2 | M1 P5 | M1-E3 PolarHBondContact O-N 3.12Å; M1-E3 VanDerWaalsContact O-N 3.12Å; E3-P5 WeakPolarHBondContact O-CD 3.41Å | ||
| 4 | T | 63.2 | Low | 75.6 | Confident | 124 Ų | 124 | 130.4 Ų | 130.4 | 76% | 0.761 | 68% | 0.682 | S | S | * | * | trans | -69.4 | 117.7 | 168.6 | 45.2 | 0 | 0 | 0 | 0 | 107.8 | S2 | S2-T4 PolarHBondContact O-N 3.21Š| ||
| 5 | P | 57.5 | Low | 77 | Confident | 111 Ų | 111 | 129.8 Ų | 129.8 | 72% | 0.721 | 68% | 0.675 | S | S | * | * | trans | -74.4 | 133.2 | -173.7 | 31.4 | -33.8 | 0 | 0 | 0 | 110.2 | E3 R7 | E3-P5 WeakPolarHBondContact O-CD 3.41Å; P5-R7 PolarHBondContact O-N 2.7Å | ||
| 6 | D | 69.5 | Low | 78.2 | Confident | 172 Ų | 172 | 127.3 Ų | 127.3 | 92% | 0.92 | 67% | 0.667 | S | S | * | * | trans | 27.1 | 38.9 | 158.4 | -69.6 | -13.3 | 0 | 0 | 0 | 118.8 | L8 | D6-L8 PolarHBondContact O-N 3.12Š| ||
| 7 | R | 80.7 | Confident | 79.2 | Confident | 179 Ų | 179 | 127.4 Ų | 127.4 | 68% | 0.675 | 67% | 0.665 | S | S | * | * | trans | -79.6 | 114.2 | 170.4 | -175.7 | 179.2 | 173.9 | -173.1 | -2.9 | 107.6 | P5 I9 E13 | P5-R7 PolarHBondContact O-N 2.7Å; R7-I9 PolarHBondContact O-N 2.6Å; R7-I9 VanDerWaalsContact O-N 3.12Å; R7-E13 IonicContact CZ-OE1 3.43Å; R7-E13 IonicContact NH1-OE1 3.93Å; R7-E13 IonicContact NH2-OE1 2.6Å; R7-E13 PolarHBondContact NH2-OE1 3.32Å; R7-E13 IonicContact NH2-OE2 3.68Å | ||
| 8 | L | 85.3 | Confident | 80.1 | Confident | 164 Ų | 164 | 125.6 Ų | 125.6 | 86% | 0.859 | 65% | 0.652 | S | S | * | * | trans | -61.1 | 115 | 164.8 | -63.4 | 179.2 | 0 | 0 | 0 | 108.1 | D6 | D6-L8 PolarHBondContact O-N 3.12Š| ||
| 9 | I | 87.7 | Confident | 81 | Confident | 91 Ų | 91 | 126.6 Ų | 126.6 | 47% | 0.467 | 65% | 0.65 | S | S | . | * | trans | -73.4 | 130.9 | 173.7 | -56 | 172 | 0 | 0 | 0 | 107.2 | R7 E13 L14 | R7-I9 PolarHBondContact O-N 2.6Å; R7-I9 VanDerWaalsContact O-N 3.12Å; I9-E13 HydrophobicContact CG2-CB 3.69Å; I9-L14 HydrophobicContact CB-CD2 4.41Å; I9-L14 HydrophobicContact CB-CG 4.45Å; I9-L14 HydrophobicContact CG2-CD2 3.73Å; I9-L14 HydrophobicContact CG2-CG 3.71Å | ||
| 10 | S | 91.9 | Very high | 81.9 | Confident | 50 Ų | 50 | 123 Ų | 123 | 35% | 0.35 | 63% | 0.632 | S | S | . | * | trans | -72.9 | 159.9 | 178.4 | 83 | 0 | 0 | 0 | 0 | 111.3 | E12 E13 L14 | S10-E12 VanDerWaalsContact C-N 3.29Å; S10-E12 PolarHBondContact O-N 3.45Å; S10-E12 PolarHBondContact OG-N 3.08Å; S10-E13 PolarHBondContact N-OE2 2.86Å; S10-E13 VanDerWaalsContact N-OE2 3.08Å; S10-E13 PolarHBondContact O-N 2.84Å; S10-E13 WeakPolarHBondContact OG-CG 3.37Å; S10-E13 PolarHBondContact OG-N 3.06Å; S10-L14 WeakPolarHBondContact O-CG 3.47Å; S10-L14 PolarHBondContact O-N 2.99Å; S10-L14 VanDerWaalsContact O-N 3.08Å | ||
| 11 | L | 95 | Very high | 82.6 | Confident | 127 Ų | 127 | 122.6 Ų | 122.6 | 67% | 0.665 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -58.5 | -43.7 | 173.2 | -170.8 | 100.1 | 0 | 0 | 0 | 111.1 | E13 L14 E15 | L11-E13 VanDerWaalsContact C-N 3.31Å; L11-E13 PolarHBondContact O-N 3.28Å; L11-L14 WeakPolarHBondContact O-CB 3.43Å; L11-L14 PolarHBondContact O-N 3.37Å; L11-L14 VanDerWaalsContact O-N 3.11Å; L11-E15 VanDerWaalsContact CD2-OE1 3.26Å; L11-E15 WeakPolarHBondContact CD2-OE1 3.22Å; L11-E15 HydrophobicContact CG-CG 4.47Å; L11-E15 WeakPolarHBondContact O-CG 3.34Å; L11-E15 PolarHBondContact O-N 3.5Å |
| 12 | E | 95.4 | Very high | 85.2 | Confident | 145 Ų | 145 | 119.2 Ų | 119.2 | 68% | 0.678 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -61.8 | -37.8 | 179.5 | -175.5 | 178.3 | -167.2 | 0 | 0 | 112.2 | S10 E15 T16 | S10-E12 VanDerWaalsContact C-N 3.29Å; S10-E12 PolarHBondContact O-N 3.45Å; S10-E12 PolarHBondContact OG-N 3.08Å; E12-E15 PolarHBondContact O-N 2.82Å; E12-T16 WeakPolarHBondContact O-CB 3.47Å; E12-T16 PolarHBondContact O-N 3.11Å; E12-T16 PolarHBondContact O-OG1 3.39Å |
| 13 | E | 95.1 | Very high | 87.6 | Confident | 61 Ų | 61 | 116.3 Ų | 116.3 | 29% | 0.285 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.7 | -44.4 | 173.2 | -74.6 | 178.1 | 152.3 | 0 | 0 | 111.2 | R7 I9 S10 L11 T16 M17 | R7-E13 IonicContact CZ-OE1 3.43Å; R7-E13 IonicContact NH1-OE1 3.93Å; R7-E13 IonicContact NH2-OE1 2.6Å; R7-E13 PolarHBondContact NH2-OE1 3.32Å; R7-E13 IonicContact NH2-OE2 3.68Å; I9-E13 HydrophobicContact CG2-CB 3.69Å; S10-E13 PolarHBondContact N-OE2 2.86Å; S10-E13 VanDerWaalsContact N-OE2 3.08Å; S10-E13 PolarHBondContact O-N 2.84Å; S10-E13 WeakPolarHBondContact OG-CG 3.37Å; S10-E13 PolarHBondContact OG-N 3.06Å; L11-E13 VanDerWaalsContact C-N 3.31Å; L11-E13 PolarHBondContact O-N 3.28Å; E13-T16 PolarHBondContact O-N 3.31Å; E13-M17 WeakPolarHBondContact O-CB 3.26Å; E13-M17 WeakPolarHBondContact O-CG 3.4Å; E13-M17 PolarHBondContact O-N 3.31Å |
| 14 | L | 95.5 | Very high | 89.6 | Confident | 67 Ų | 67 | 114.3 Ų | 114.3 | 35% | 0.351 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -64 | -43.6 | 176.2 | -67.6 | 172.5 | 0 | 0 | 0 | 111.8 | I9 S10 L11 T16 M17 F18 | I9-L14 HydrophobicContact CB-CD2 4.41Å; I9-L14 HydrophobicContact CB-CG 4.45Å; I9-L14 HydrophobicContact CG2-CD2 3.73Å; I9-L14 HydrophobicContact CG2-CG 3.71Å; S10-L14 WeakPolarHBondContact O-CG 3.47Å; S10-L14 PolarHBondContact O-N 2.99Å; S10-L14 VanDerWaalsContact O-N 3.08Å; L11-L14 WeakPolarHBondContact O-CB 3.43Å; L11-L14 PolarHBondContact O-N 3.37Å; L11-L14 VanDerWaalsContact O-N 3.11Å; L14-T16 VanDerWaalsContact C-N 3.25Å; L14-T16 PolarHBondContact O-N 3.08Å; L14-M17 PolarHBondContact O-N 3.43Å; L14-F18 HydrophobicContact CB-CD2 4.48Å; L14-F18 HydrophobicContact CD2-CD2 4.36Å; L14-F18 HydrophobicContact CD2-CE2 3.94Å; L14-F18 WeakPolarHBondContact O-CB 3.42Å; L14-F18 VanDerWaalsContact O-CD2 3.26Å; L14-F18 WeakPolarHBondContact O-CD2 3.47Å; L14-F18 PolarHBondContact O-N 3.43Å |
| 15 | E | 96.4 | Very high | 91.2 | Very high | 122 Ų | 122 | 115.9 Ų | 115.9 | 57% | 0.57 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -58.7 | -40.7 | 176 | -74.9 | 176.5 | 170.1 | 0 | 0 | 111.2 | L11 E12 F18 K19 | L11-E15 VanDerWaalsContact CD2-OE1 3.26Å; L11-E15 WeakPolarHBondContact CD2-OE1 3.22Å; L11-E15 HydrophobicContact CG-CG 4.47Å; L11-E15 WeakPolarHBondContact O-CG 3.34Å; L11-E15 PolarHBondContact O-N 3.5Å; E12-E15 PolarHBondContact O-N 2.82Å; E15-F18 CarbonylContact O-C 3.57Å; E15-K19 VanDerWaalsContact O-CA 3.28Å; E15-K19 WeakPolarHBondContact O-CA 3.28Å; E15-K19 WeakPolarHBondContact O-CB 3.26Å; E15-K19 PolarHBondContact O-N 3.37Å |
| 16 | T | 96.3 | Very high | 93.2 | Very high | 90 Ų | 90 | 112 Ų | 112 | 55% | 0.552 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -69.9 | -45.2 | 176.6 | -57.2 | 0 | 0 | 0 | 0 | 112 | E12 E13 L14 F18 K19 | E12-T16 WeakPolarHBondContact O-CB 3.47Å; E12-T16 PolarHBondContact O-N 3.11Å; E12-T16 PolarHBondContact O-OG1 3.39Å; E13-T16 PolarHBondContact O-N 3.31Å; L14-T16 VanDerWaalsContact C-N 3.25Å; L14-T16 PolarHBondContact O-N 3.08Å; T16-F18 VanDerWaalsContact C-N 3.26Å; T16-F18 PolarHBondContact O-N 2.96Å; T16-K19 WeakPolarHBondContact O-CG 3.38Å; T16-K19 PolarHBondContact O-N 2.91Å |
| 17 | M | 94.8 | Very high | 94.4 | Very high | 129 Ų | 129 | 109.2 Ų | 109.2 | 64% | 0.635 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.8 | -33.5 | 179.4 | -76.2 | 177.4 | 67.1 | 0 | 0 | 112.5 | E13 L14 | E13-M17 WeakPolarHBondContact O-CB 3.26Å; E13-M17 WeakPolarHBondContact O-CG 3.4Å; E13-M17 PolarHBondContact O-N 3.31Å; L14-M17 PolarHBondContact O-N 3.43Å |
| 18 | F | 96.7 | Very high | 95.1 | Very high | 95 Ų | 95 | 106.7 Ų | 106.7 | 42% | 0.417 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -111.5 | 20.3 | -177 | -65.3 | -75.3 | 0 | 0 | 0 | 113.3 | L14 E15 T16 D20 R21 | L14-F18 HydrophobicContact CB-CD2 4.48Å; L14-F18 HydrophobicContact CD2-CD2 4.36Å; L14-F18 HydrophobicContact CD2-CE2 3.94Å; L14-F18 WeakPolarHBondContact O-CB 3.42Å; L14-F18 VanDerWaalsContact O-CD2 3.26Å; L14-F18 WeakPolarHBondContact O-CD2 3.47Å; L14-F18 PolarHBondContact O-N 3.43Å; E15-F18 CarbonylContact O-C 3.57Å; T16-F18 VanDerWaalsContact C-N 3.26Å; T16-F18 PolarHBondContact O-N 2.96Å; F18-D20 PolarHBondContact O-N 2.93Å; F18-R21 HydrophobicContact CB-CB 4.17Å; F18-R21 WeakPolarHBondContact O-CB 3.42Å; F18-R21 PolarHBondContact O-N 3.06Å |
| 19 | K | 97.1 | Very high | 95.7 | Very high | 145 Ų | 145 | 102.4 Ų | 102.4 | 63% | 0.63 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.7 | -31.3 | -178.4 | 70 | -176.8 | -177.4 | 179.7 | 0 | 114 | E15 T16 | E15-K19 VanDerWaalsContact O-CA 3.28Å; E15-K19 WeakPolarHBondContact O-CA 3.28Å; E15-K19 WeakPolarHBondContact O-CB 3.26Å; E15-K19 PolarHBondContact O-N 3.37Å; T16-K19 WeakPolarHBondContact O-CG 3.38Å; T16-K19 PolarHBondContact O-N 2.91Å |
| 20 | D | 97.5 | Very high | 96.1 | Very high | 53 Ų | 53 | 101.3 Ų | 101.3 | 28% | 0.283 | 50% | 0.495 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.9 | 2.1 | -176.8 | -66.3 | -50.8 | 0 | 0 | 0 | 112.1 | F18 Y22 T23 K25 D26 | F18-D20 PolarHBondContact O-N 2.93Å; D20-Y22 PolarHBondContact O-N 3.04Å; D20-T23 WeakPolarHBondContact O-CB 3.28Å; D20-T23 WeakPolarHBondContact O-CG2 3.1Å; D20-T23 PolarHBondContact O-N 3.38Å; D20-T23 PolarHBondContact O-OG1 2.64Å; D20-K25 HydrophobicContact CB-CB 3.96Å; D20-K25 VanDerWaalsContact OD1-CD 3.28Å; D20-K25 WeakPolarHBondContact OD1-CD 3.47Å; D20-D26 WeakPolarHBondContact O-CB 3.48Å |
| 21 | R | 97 | Very high | 96.2 | Very high | 115 Ų | 115 | 105.5 Ų | 105.5 | 43% | 0.434 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.6 | 130.2 | -174.8 | -171.4 | -168 | -70.7 | 169.2 | -6.1 | 111.4 | F18 T23 D26 | F18-R21 HydrophobicContact CB-CB 4.17Å; F18-R21 WeakPolarHBondContact O-CB 3.42Å; F18-R21 PolarHBondContact O-N 3.06Å; R21-T23 PolarHBondContact O-N 3.03Å; R21-D26 WeakPolarHBondContact CA-OD2 3.35Å |
| 22 | Y | 96.6 | Very high | 96.2 | Very high | 163 Ų | 163 | 107.4 Ų | 107.4 | 64% | 0.639 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.4 | 18.4 | -177.5 | -45.7 | -56.3 | 0 | 0 | 0 | 115.5 | D20 D26 Y29 | D20-Y22 PolarHBondContact O-N 3.04Å; Y22-D26 PolarHBondContact N-OD2 3.23Å; Y22-Y29 AromaticContact CD1-CD2 3.88Å; Y22-Y29 HydrophobicContact CD1-CD2 3.88Å; Y22-Y29 HydrophobicContact CD1-CE2 4.26Å; Y22-Y29 HydrophobicContact CD1-CG 4.23Å; Y22-Y29 VanDerWaalsContact O-CE1 3.32Å; Y22-Y29 WeakPolarHBondContact O-CE1 3.34Å |
| 23 | T | 96.9 | Very high | 96.2 | Very high | 55 Ų | 55 | 104.9 Ų | 104.9 | 34% | 0.337 | 50% | 0.497 | S | S | . | . | S | Bend | trans | -99.2 | 178.1 | 171.3 | 74.2 | 0 | 0 | 0 | 0 | 111.3 | D20 R21 K25 D26 Q30 | D20-T23 WeakPolarHBondContact O-CB 3.28Å; D20-T23 WeakPolarHBondContact O-CG2 3.1Å; D20-T23 PolarHBondContact O-N 3.38Å; D20-T23 PolarHBondContact O-OG1 2.64Å; R21-T23 PolarHBondContact O-N 3.03Å; T23-K25 PolarHBondContact O-N 3.13Å; T23-K25 VanDerWaalsContact O-N 3.14Å; T23-K25 PolarHBondContact OG1-N 3.4Å; T23-D26 WeakPolarHBondContact O-CB 3.33Å; T23-D26 PolarHBondContact O-N 2.89Å; T23-D26 VanDerWaalsContact O-N 3.08Å; T23-Q30 PolarHBondContact O-NE2 3.44Å |
| 24 | D | 96.2 | Very high | 96.1 | Very high | 143 Ų | 143 | 106.3 Ų | 106.3 | 77% | 0.765 | 51% | 0.514 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | -16.8 | 173.6 | -63 | -25.3 | 0 | 0 | 0 | 113.9 | Q30 | D24-Q30 PolarHBondContact OD1-NE2 3.3Š|
| 25 | K | 97 | Very high | 95.9 | Very high | 157 Ų | 157 | 107.6 Ų | 107.6 | 68% | 0.683 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.9 | -12.8 | 177 | -64.3 | 173.1 | -178.4 | 174.4 | 0 | 113.2 | D20 T23 V27 | D20-K25 HydrophobicContact CB-CB 3.96Å; D20-K25 VanDerWaalsContact OD1-CD 3.28Å; D20-K25 WeakPolarHBondContact OD1-CD 3.47Å; T23-K25 PolarHBondContact O-N 3.13Å; T23-K25 VanDerWaalsContact O-N 3.14Å; T23-K25 PolarHBondContact OG1-N 3.4Å; K25-V27 PolarHBondContact O-N 2.96Å |
| 26 | D | 97.5 | Very high | 95.5 | Very high | 29 Ų | 29 | 105.9 Ų | 105.9 | 16% | 0.155 | 53% | 0.528 | C | S | . | . | trans | -79.2 | 98.5 | 177.5 | -176.6 | -16.2 | 0 | 0 | 0 | 110.4 | D20 R21 Y22 T23 N28 Y29 Q30 | D20-D26 WeakPolarHBondContact O-CB 3.48Å; R21-D26 WeakPolarHBondContact CA-OD2 3.35Å; Y22-D26 PolarHBondContact N-OD2 3.23Å; T23-D26 WeakPolarHBondContact O-CB 3.33Å; T23-D26 PolarHBondContact O-N 2.89Å; T23-D26 VanDerWaalsContact O-N 3.08Å; D26-N28 PolarHBondContact O-N 2.87Å; D26-N28 PolarHBondContact OD1-N 3.08Å; D26-Y29 VanDerWaalsContact CG-CB 3.41Å; D26-Y29 PolarHBondContact O-N 2.94Å; D26-Y29 VanDerWaalsContact O-N 3.13Å; D26-Y29 PolarHBondContact OD1-N 3.27Å; D26-Q30 WeakPolarHBondContact O-CG 3.37Å; D26-Q30 PolarHBondContact O-N 3.04Å | ||
| 27 | V | 95.6 | Very high | 95.1 | Very high | 114 Ų | 114 | 109.4 Ų | 109.4 | 69% | 0.691 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -55.8 | -37.5 | -178.8 | 179.1 | 0 | 0 | 0 | 0 | 112.3 | K25 K31 | K25-V27 PolarHBondContact O-N 2.96Å; V27-K31 WeakPolarHBondContact O-CB 3.5Å; V27-K31 PolarHBondContact O-N 3.17Å |
| 28 | N | 95.6 | Very high | 94.8 | Very high | 126 Ų | 126 | 109.5 Ų | 109.5 | 67% | 0.674 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -72.5 | -40.2 | -179.3 | -70.5 | -35.6 | 0 | 0 | 0 | 110.9 | D26 K31 Y32 | D26-N28 PolarHBondContact O-N 2.87Å; D26-N28 PolarHBondContact OD1-N 3.08Å; N28-K31 PolarHBondContact O-N 3.14Å; N28-Y32 WeakPolarHBondContact O-CB 3.32Å; N28-Y32 PolarHBondContact O-N 3.23Å |
| 29 | Y | 96.8 | Very high | 94.6 | Very high | 74 Ų | 74 | 109.7 Ų | 109.7 | 29% | 0.29 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.4 | -43.5 | 175 | -178.3 | -122.5 | 0 | 0 | 0 | 112 | Y22 D26 K31 Y32 L33 | Y22-Y29 AromaticContact CD1-CD2 3.88Å; Y22-Y29 HydrophobicContact CD1-CD2 3.88Å; Y22-Y29 HydrophobicContact CD1-CE2 4.26Å; Y22-Y29 HydrophobicContact CD1-CG 4.23Å; Y22-Y29 VanDerWaalsContact O-CE1 3.32Å; Y22-Y29 WeakPolarHBondContact O-CE1 3.34Å; D26-Y29 VanDerWaalsContact CG-CB 3.41Å; D26-Y29 PolarHBondContact O-N 2.94Å; D26-Y29 VanDerWaalsContact O-N 3.13Å; D26-Y29 PolarHBondContact OD1-N 3.27Å; Y29-K31 VanDerWaalsContact C-N 3.32Å; Y29-K31 PolarHBondContact O-N 2.92Å; Y29-Y32 WeakPolarHBondContact O-CA 3.43Å; Y29-Y32 WeakPolarHBondContact O-CB 3.36Å; Y29-Y32 PolarHBondContact O-N 3.35Å; Y29-Y32 VanDerWaalsContact O-N 3.08Å; Y29-L33 HydrophobicContact CD1-CD1 4Å; Y29-L33 HydrophobicContact CD2-CG 4.44Å; Y29-L33 HydrophobicContact CE1-CD1 3.57Å; Y29-L33 HydrophobicContact CE1-CG 4.25Å; Y29-L33 HydrophobicContact CE2-CD1 4.32Å; Y29-L33 HydrophobicContact CE2-CD2 4.14Å; Y29-L33 HydrophobicContact CE2-CG 4.1Å; Y29-L33 WeakPolarHBondContact O-CG 3.42Å; Y29-L33 PolarHBondContact O-N 3.45Å |
| 30 | Q | 96.6 | Very high | 94.4 | Very high | 67 Ų | 67 | 107.9 Ų | 107.9 | 31% | 0.313 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.1 | -39 | 175.2 | -66.8 | -55.7 | -43.8 | 0 | 0 | 112 | T23 D24 D26 Y32 L33 S34 | T23-Q30 PolarHBondContact O-NE2 3.44Å; D24-Q30 PolarHBondContact OD1-NE2 3.3Å; D26-Q30 WeakPolarHBondContact O-CG 3.37Å; D26-Q30 PolarHBondContact O-N 3.04Å; Q30-Y32 VanDerWaalsContact C-N 3.32Å; Q30-Y32 PolarHBondContact O-N 3.46Å; Q30-L33 PolarHBondContact O-N 3.38Å; Q30-S34 PolarHBondContact O-N 3.08Å; Q30-S34 PolarHBondContact O-OG 3.48Å; Q30-S34 VanDerWaalsContact O-OG 3.13Å |
| 31 | K | 95.5 | Very high | 94.2 | Very high | 138 Ų | 138 | 111.1 Ų | 111.1 | 60% | 0.6 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -62.6 | -40.6 | 171.7 | -171.9 | 177 | -179.9 | -179.1 | 0 | 111.7 | V27 N28 Y29 S34 N35 | V27-K31 WeakPolarHBondContact O-CB 3.5Å; V27-K31 PolarHBondContact O-N 3.17Å; N28-K31 PolarHBondContact O-N 3.14Å; Y29-K31 VanDerWaalsContact C-N 3.32Å; Y29-K31 PolarHBondContact O-N 2.92Å; K31-S34 WeakPolarHBondContact CA-OG 3.47Å; K31-S34 PolarHBondContact O-N 3.42Å; K31-S34 PolarHBondContact O-OG 3.42Å; K31-N35 VanDerWaalsContact O-CG 3.31Å; K31-N35 PolarHBondContact O-N 3.13Å; K31-N35 PolarHBondContact O-ND2 3.23Å; K31-N35 PolarHBondContact O-OD1 2.99Å |
| 32 | Y | 95 | Very high | 94 | Very high | 167 Ų | 167 | 113 Ų | 113 | 66% | 0.655 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.8 | -45.2 | 175.3 | 176.5 | -95 | 0 | 0 | 0 | 112 | N28 Y29 Q30 S34 N35 | N28-Y32 WeakPolarHBondContact O-CB 3.32Å; N28-Y32 PolarHBondContact O-N 3.23Å; Y29-Y32 WeakPolarHBondContact O-CA 3.43Å; Y29-Y32 WeakPolarHBondContact O-CB 3.36Å; Y29-Y32 PolarHBondContact O-N 3.35Å; Y29-Y32 VanDerWaalsContact O-N 3.08Å; Q30-Y32 VanDerWaalsContact C-N 3.32Å; Q30-Y32 PolarHBondContact O-N 3.46Å; Y32-S34 VanDerWaalsContact C-N 3.31Å; Y32-S34 PolarHBondContact O-N 2.86Å; Y32-N35 WeakPolarHBondContact O-CB 3.45Å; Y32-N35 PolarHBondContact O-N 3.48Å |
| 33 | L | 93.9 | Very high | 93.6 | Very high | 92 Ų | 92 | 109.8 Ų | 109.8 | 48% | 0.482 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -64.7 | -31.7 | 178 | -70.2 | 177.3 | 0 | 0 | 0 | 113.5 | Y29 Q30 N35 | Y29-L33 HydrophobicContact CD1-CD1 4Å; Y29-L33 HydrophobicContact CD2-CG 4.44Å; Y29-L33 HydrophobicContact CE1-CD1 3.57Å; Y29-L33 HydrophobicContact CE1-CG 4.25Å; Y29-L33 HydrophobicContact CE2-CD1 4.32Å; Y29-L33 HydrophobicContact CE2-CD2 4.14Å; Y29-L33 HydrophobicContact CE2-CG 4.1Å; Y29-L33 WeakPolarHBondContact O-CG 3.42Å; Y29-L33 PolarHBondContact O-N 3.45Å; Q30-L33 PolarHBondContact O-N 3.38Å; L33-N35 VanDerWaalsContact C-N 3.33Å |
| 34 | S | 93.1 | Very high | 93.2 | Very high | 91 Ų | 91 | 111.4 Ų | 111.4 | 64% | 0.636 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -78.9 | -13.9 | 177.4 | 59.2 | 0 | 0 | 0 | 0 | 114 | Q30 K31 Y32 A36 | Q30-S34 PolarHBondContact O-N 3.08Å; Q30-S34 PolarHBondContact O-OG 3.48Å; Q30-S34 VanDerWaalsContact O-OG 3.13Å; K31-S34 WeakPolarHBondContact CA-OG 3.47Å; K31-S34 PolarHBondContact O-N 3.42Å; K31-S34 PolarHBondContact O-OG 3.42Å; Y32-S34 VanDerWaalsContact C-N 3.31Å; Y32-S34 PolarHBondContact O-N 2.86Å; S34-A36 PolarHBondContact O-N 3.41Å |
| 35 | N | 91.2 | Very high | 92.9 | Very high | 95 Ų | 95 | 110.3 Ų | 110.3 | 51% | 0.508 | 60% | 0.6 | S | S | . | * | S | Bend | trans | -69.4 | 132.9 | 175.2 | -69.9 | -31.3 | 0 | 0 | 0 | 110 | K31 Y32 L33 | K31-N35 VanDerWaalsContact O-CG 3.31Å; K31-N35 PolarHBondContact O-N 3.13Å; K31-N35 PolarHBondContact O-ND2 3.23Å; K31-N35 PolarHBondContact O-OD1 2.99Å; Y32-N35 WeakPolarHBondContact O-CB 3.45Å; Y32-N35 PolarHBondContact O-N 3.48Å; L33-N35 VanDerWaalsContact C-N 3.33Å |
| 36 | A | 88.1 | Confident | 92.3 | Very high | 86 Ų | 86 | 109.8 Ų | 109.8 | 71% | 0.711 | 59% | 0.594 | S | S | * | * | trans | -60.7 | 145.4 | 167.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | S34 V38 | S34-A36 PolarHBondContact O-N 3.41Å; A36-V38 PolarHBondContact O-N 3.02Å | ||
| 37 | N | 87.6 | Confident | 91.6 | Very high | 164 Ų | 164 | 113 Ų | 113 | 88% | 0.877 | 61% | 0.611 | S | S | * | * | trans | -55.4 | 115 | 174.3 | -69.9 | -33.2 | 0 | 0 | 0 | 109.5 | P39 | N37-P39 WeakPolarHBondContact O-CD 3.32Š| ||
| 38 | V | 89.4 | Confident | 90.9 | Very high | 131 Ų | 131 | 113 Ų | 113 | 79% | 0.794 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 120.3 | 177.7 | -178.6 | 0 | 0 | 0 | 0 | 107.7 | A36 | A36-V38 PolarHBondContact O-N 3.02Š|
| 39 | P | 91.7 | Very high | 89.8 | Confident | 98 Ų | 98 | 111 Ų | 111 | 64% | 0.636 | 59% | 0.592 | S | S | * | * | P | Polyproline II helix | trans | -64 | 150.5 | 176.3 | 27.9 | -34 | 0 | 0 | 0 | 109.9 | N37 | N37-P39 WeakPolarHBondContact O-CD 3.32Š|
| 40 | P | 93.8 | Very high | 88.4 | Confident | 107 Ų | 107 | 109.8 Ų | 109.8 | 70% | 0.695 | 59% | 0.591 | S | S | * | * | P | Polyproline II helix | trans | -59 | 152.3 | 175.8 | 26.6 | -34.6 | 0 | 0 | 0 | 110.8 | I42 | P40-I42 PolarHBondContact O-N 3.37Š|
| 41 | P | 93.4 | Very high | 86.8 | Confident | 122 Ų | 122 | 114 Ų | 114 | 79% | 0.792 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -63 | 130.9 | -179.8 | 26.6 | -34.1 | 0 | 0 | 0 | 110.8 | ||
| 42 | I | 91.7 | Very high | 85.1 | Confident | 153 Ų | 153 | 114.4 Ų | 114.4 | 79% | 0.785 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -98.7 | 120.9 | 172.1 | -60.2 | 173.4 | 0 | 0 | 0 | 107.5 | P40 P44 | P40-I42 PolarHBondContact O-N 3.37Å; I42-P44 WeakPolarHBondContact O-CD 3.44Å |
| 43 | I | 89.3 | Confident | 83.4 | Confident | 96 Ų | 96 | 115.6 Ų | 115.6 | 49% | 0.492 | 61% | 0.611 | S | S | . | * | trans | -95.1 | 106.8 | 174.9 | -55.6 | 172.2 | 0 | 0 | 0 | 107.9 | W46 I49 | I43-W46 HydrophobicContact CB-CE3 4.3Å; I43-W46 HydrophobicContact CD1-CE3 3.91Å; I43-W46 HydrophobicContact CD1-CZ3 3.82Å; I43-W46 HydrophobicContact CG2-CE3 3.94Å; I43-I49 HydrophobicContact CG2-CD1 4.15Å | ||
| 44 | P | 88.6 | Confident | 81.8 | Confident | 90 Ų | 90 | 118.4 Ų | 118.4 | 58% | 0.584 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.3 | 147.8 | 175.5 | 31.1 | -35.4 | 0 | 0 | 0 | 109.6 | I42 W46 | I42-P44 WeakPolarHBondContact O-CD 3.44Å; P44-W46 VanDerWaalsContact C-N 3.28Å; P44-W46 PolarHBondContact O-N 3.47Å |
| 45 | H | 88.7 | Confident | 80.2 | Confident | 120 Ų | 120 | 118.6 Ų | 118.6 | 56% | 0.556 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 58.3 | 32.3 | 175.3 | -50.7 | -78.3 | 0 | 0 | 0 | 115.2 | D47 E48 I49 | H45-D47 PolarHBondContact O-N 3.46Å; H45-E48 HydrophobicContact CB-CB 4.09Å; H45-E48 HydrophobicContact CB-CG 4.07Å; H45-E48 IonicContact CE1-OE1 3.71Å; H45-E48 IonicContact CG-OE1 3.55Å; H45-E48 IonicContact CG-OE2 3.78Å; H45-E48 IonicContact ND1-OE1 2.76Å; H45-E48 PolarHBondContact ND1-OE1 3.34Å; H45-E48 IonicContact ND1-OE2 3.68Å; H45-E48 WeakPolarHBondContact O-CB 3.14Å; H45-E48 PolarHBondContact O-N 3.42Å; H45-I49 PolarHBondContact O-N 3.21Å |
| 46 | W | 85.5 | Confident | 78.5 | Confident | 145 Ų | 145 | 121 Ų | 121 | 55% | 0.549 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -50 | -36.1 | 176.7 | -178.6 | -107.4 | 0 | 0 | 0 | 113.4 | I43 P44 I49 N50 | I43-W46 HydrophobicContact CB-CE3 4.3Å; I43-W46 HydrophobicContact CD1-CE3 3.91Å; I43-W46 HydrophobicContact CD1-CZ3 3.82Å; I43-W46 HydrophobicContact CG2-CE3 3.94Å; P44-W46 VanDerWaalsContact C-N 3.28Å; P44-W46 PolarHBondContact O-N 3.47Å; W46-I49 HydrophobicContact CE3-CD1 4.5Å; W46-N50 PolarHBondContact NE1-ND2 2.76Å; W46-N50 PolarHBondContact O-N 2.88Å; W46-N50 PolarHBondContact O-ND2 3.25Å |
| 47 | D | 83.3 | Confident | 77 | Confident | 97 Ų | 97 | 127.4 Ų | 127.4 | 52% | 0.519 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -68.1 | -34.1 | 177.2 | -74.9 | -5 | 0 | 0 | 0 | 113.3 | H45 N50 R51 | H45-D47 PolarHBondContact O-N 3.46Å; D47-N50 PolarHBondContact O-N 3.29Å; D47-R51 WeakPolarHBondContact O-CB 3.18Å; D47-R51 WeakPolarHBondContact O-CG 3.49Å; D47-R51 PolarHBondContact O-N 3.24Å; D47-R51 IonicContact OD2-NH2 3.66Å |
| 48 | E | 79.6 | Confident | 75.6 | Confident | 115 Ų | 115 | 122.6 Ų | 122.6 | 54% | 0.537 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -69.8 | -41.5 | -178.8 | -65.3 | 173.3 | -154.6 | 0 | 0 | 110.7 | H45 N50 R51 | H45-E48 HydrophobicContact CB-CB 4.09Å; H45-E48 HydrophobicContact CB-CG 4.07Å; H45-E48 IonicContact CE1-OE1 3.71Å; H45-E48 IonicContact CG-OE1 3.55Å; H45-E48 IonicContact CG-OE2 3.78Å; H45-E48 IonicContact ND1-OE1 2.76Å; H45-E48 PolarHBondContact ND1-OE1 3.34Å; H45-E48 IonicContact ND1-OE2 3.68Å; H45-E48 WeakPolarHBondContact O-CB 3.14Å; H45-E48 PolarHBondContact O-N 3.42Å; E48-N50 PolarHBondContact O-N 3.38Å; E48-R51 PolarHBondContact O-N 3.06Å |
| 49 | I | 72.4 | Confident | 74 | Confident | 83 Ų | 83 | 123 Ų | 123 | 43% | 0.426 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -56.6 | -35.6 | 174.8 | -61.7 | 169.8 | 0 | 0 | 0 | 111.2 | I43 H45 W46 | I43-I49 HydrophobicContact CG2-CD1 4.15Å; H45-I49 PolarHBondContact O-N 3.21Å; W46-I49 HydrophobicContact CE3-CD1 4.5Å |
| 50 | N | 68.7 | Low | 72.3 | Confident | 49 Ų | 49 | 127.7 Ų | 127.7 | 26% | 0.262 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -86.3 | -29.2 | -179.1 | -72.1 | -58.7 | 0 | 0 | 0 | 113.2 | W46 D47 E48 E52 R53 F54 | W46-N50 PolarHBondContact NE1-ND2 2.76Å; W46-N50 PolarHBondContact O-N 2.88Å; W46-N50 PolarHBondContact O-ND2 3.25Å; D47-N50 PolarHBondContact O-N 3.29Å; E48-N50 PolarHBondContact O-N 3.38Å; N50-E52 VanDerWaalsContact C-N 3.33Å; N50-E52 PolarHBondContact O-N 3.46Å; N50-R53 PolarHBondContact O-N 3.24Å; N50-F54 WeakPolarHBondContact O-CD2 3.49Å |
| 51 | R | 63.4 | Low | 70.6 | Confident | 154 Ų | 154 | 127.8 Ų | 127.8 | 58% | 0.581 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66 | -31.7 | -178.9 | -78.8 | 170.8 | -156.1 | -115.6 | 5.7 | 113.2 | D47 E48 R53 F54 N55 | D47-R51 WeakPolarHBondContact O-CB 3.18Å; D47-R51 WeakPolarHBondContact O-CG 3.49Å; D47-R51 PolarHBondContact O-N 3.24Å; D47-R51 IonicContact OD2-NH2 3.66Å; E48-R51 PolarHBondContact O-N 3.06Å; R51-R53 PolarHBondContact O-N 2.89Å; R51-F54 PolarHBondContact O-N 3.35Å; R51-N55 PolarHBondContact O-N 3.28Å; R51-N55 PolarHBondContact O-ND2 3.28Å |
| 52 | E | 59.4 | Low | 69 | Low | 147 Ų | 147 | 125.9 Ų | 125.9 | 69% | 0.687 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -59.6 | -32.2 | 176.3 | -70.5 | -171.2 | 162 | 0 | 0 | 112.5 | N50 F54 | N50-E52 VanDerWaalsContact C-N 3.33Å; N50-E52 PolarHBondContact O-N 3.46Å; E52-F54 PolarHBondContact O-N 3.21Å |
| 53 | R | 59.5 | Low | 67.5 | Low | 193 Ų | 193 | 123.3 Ų | 123.3 | 73% | 0.728 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -73.4 | -26.7 | -179.1 | -60.9 | -172.5 | -176 | -165.2 | 1.5 | 113.5 | N50 R51 | N50-R53 PolarHBondContact O-N 3.24Å; R51-R53 PolarHBondContact O-N 2.89Å |
| 54 | F | 59.8 | Low | 66.1 | Low | 151 Ų | 151 | 126.3 Ų | 126.3 | 66% | 0.662 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -90.2 | -20.8 | -175.8 | -66.2 | -73.6 | 0 | 0 | 0 | 113.7 | N50 R51 E52 H56 R57 | N50-F54 WeakPolarHBondContact O-CD2 3.49Å; R51-F54 PolarHBondContact O-N 3.35Å; E52-F54 PolarHBondContact O-N 3.21Å; F54-H56 VanDerWaalsContact C-N 3.33Å; F54-H56 PolarHBondContact O-N 3.4Å; F54-R57 PolarHBondContact O-N 3.17Å |
| 55 | N | 58.3 | Low | 64.7 | Low | 94 Ų | 94 | 130.6 Ų | 130.6 | 50% | 0.503 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -73.4 | -19.9 | -175.8 | -72.1 | -29.1 | 0 | 0 | 0 | 114.1 | R51 R57 S58 | R51-N55 PolarHBondContact O-N 3.28Å; R51-N55 PolarHBondContact O-ND2 3.28Å; N55-R57 VanDerWaalsContact C-N 3.3Å; N55-R57 PolarHBondContact O-N 2.98Å; N55-S58 PolarHBondContact O-OG 3.41Å |
| 56 | H | 57.1 | Low | 63.3 | Low | 146 Ų | 146 | 131.2 Ų | 131.2 | 68% | 0.676 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -72.9 | -20.4 | 177.1 | -68.2 | -51.9 | 0 | 0 | 0 | 114 | F54 | F54-H56 VanDerWaalsContact C-N 3.33Å; F54-H56 PolarHBondContact O-N 3.4Å |
| 57 | R | 55.1 | Low | 62 | Low | 221 Ų | 221 | 129.2 Ų | 129.2 | 83% | 0.834 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -84.9 | -31.1 | -178 | -156.5 | 173.3 | -169.7 | -174.7 | 2.8 | 112.7 | F54 N55 | F54-R57 PolarHBondContact O-N 3.17Å; N55-R57 VanDerWaalsContact C-N 3.3Å; N55-R57 PolarHBondContact O-N 2.98Å |
| 58 | S | 58.2 | Low | 60.9 | Low | 63 Ų | 63 | 132.2 Ų | 132.2 | 44% | 0.441 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -75 | -31.6 | -179.3 | 64.8 | 0 | 0 | 0 | 0 | 112.7 | N55 N61 | N55-S58 PolarHBondContact O-OG 3.41Å; S58-N61 PolarHBondContact O-N 3.04Å |
| 59 | Q | 57.8 | Low | 60 | Low | 138 Ų | 138 | 131.5 Ų | 131.5 | 65% | 0.645 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -69.7 | -34.1 | 180 | -70.8 | -163.8 | -7.9 | 0 | 0 | 113.3 | N61 | Q59-N61 VanDerWaalsContact C-N 3.31Å; Q59-N61 PolarHBondContact O-N 3.05Å |
| 60 | R | 55.8 | Low | 59.4 | Low | 198 Ų | 198 | 132.5 Ų | 132.5 | 75% | 0.747 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -65.5 | -33.8 | 176.5 | -83.9 | -171.5 | -178.8 | 178.9 | -0.9 | 112.7 | Y64 | R60-Y64 WeakPolarHBondContact O-CD2 3.24Å |
| 61 | N | 57.4 | Low | 59.1 | Low | 108 Ų | 108 | 137.8 Ų | 137.8 | 58% | 0.578 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -80.8 | -24 | -172.3 | -133.3 | -3.9 | 0 | 0 | 0 | 113.4 | S58 Q59 | S58-N61 PolarHBondContact O-N 3.04Å; Q59-N61 VanDerWaalsContact C-N 3.31Å; Q59-N61 PolarHBondContact O-N 3.05Å |
| 62 | N | 59.7 | Low | 58.9 | Low | 83 Ų | 83 | 137.9 Ų | 137.9 | 44% | 0.444 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -73.9 | -37.5 | 176.3 | -77.8 | -19 | 0 | 0 | 0 | 112 | Y64 R65 F66 | N62-Y64 VanDerWaalsContact C-N 3.31Å; N62-Y64 PolarHBondContact O-N 3.1Å; N62-R65 PolarHBondContact O-N 3.31Å; N62-R65 VanDerWaalsContact O-N 3.1Å; N62-F66 HydrophobicContact CB-CD2 4.27Å; N62-F66 HydrophobicContact CB-CE2 4.08Å; N62-F66 WeakPolarHBondContact O-CD2 3.43Å; N62-F66 PolarHBondContact O-N 3.4Å |
| 63 | N | 60.3 | Low | 58.9 | Low | 98 Ų | 98 | 140.6 Ų | 140.6 | 52% | 0.524 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -62 | -36.5 | -178.7 | -73.5 | -9.3 | 0 | 0 | 0 | 113 | Q67 | N63-Q67 WeakPolarHBondContact O-CB 3.09Å; N63-Q67 VanDerWaalsContact O-CG 3.24Å; N63-Q67 WeakPolarHBondContact O-CG 3.16Å; N63-Q67 PolarHBondContact O-N 3.36Å |
| 64 | Y | 59.7 | Low | 59 | Low | 159 Ų | 159 | 137.9 Ų | 137.9 | 62% | 0.624 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -69.3 | -32.7 | 175.8 | -69.1 | -73.7 | 0 | 0 | 0 | 113.3 | R60 N62 R68 | R60-Y64 WeakPolarHBondContact O-CD2 3.24Å; N62-Y64 VanDerWaalsContact C-N 3.31Å; N62-Y64 PolarHBondContact O-N 3.1Å; Y64-R68 WeakPolarHBondContact O-CB 3.16Å; Y64-R68 PolarHBondContact O-N 3.48Å |
| 65 | R | 58.6 | Low | 59 | Low | 181 Ų | 181 | 134.9 Ų | 134.9 | 68% | 0.683 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -72.6 | -40.9 | 176.6 | -74.6 | -173.9 | 176.6 | -173.8 | -0.8 | 112.1 | N62 R68 N69 | N62-R65 PolarHBondContact O-N 3.31Å; N62-R65 VanDerWaalsContact O-N 3.1Å; R65-R68 PolarHBondContact O-N 3.24Å; R65-N69 PolarHBondContact O-N 3.37Å |
| 66 | F | 59.4 | Low | 59 | Low | 132 Ų | 132 | 137.4 Ų | 137.4 | 58% | 0.579 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -67.3 | -40.6 | 176.6 | -73.7 | -69.2 | 0 | 0 | 0 | 112.2 | N62 R68 N69 N70 | N62-F66 HydrophobicContact CB-CD2 4.27Å; N62-F66 HydrophobicContact CB-CE2 4.08Å; N62-F66 WeakPolarHBondContact O-CD2 3.43Å; N62-F66 PolarHBondContact O-N 3.4Å; F66-R68 PolarHBondContact O-N 3.38Å; F66-N69 PolarHBondContact O-N 3.46Å; F66-N70 PolarHBondContact O-N 3.17Å |
| 67 | Q | 59.7 | Low | 58.7 | Low | 103 Ų | 103 | 140.9 Ų | 140.9 | 48% | 0.481 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -61.7 | -44.1 | 175.2 | -73.5 | 174.7 | 16.2 | 0 | 0 | 111.7 | N63 N69 N70 F71 | N63-Q67 WeakPolarHBondContact O-CB 3.09Å; N63-Q67 VanDerWaalsContact O-CG 3.24Å; N63-Q67 WeakPolarHBondContact O-CG 3.16Å; N63-Q67 PolarHBondContact O-N 3.36Å; Q67-N69 VanDerWaalsContact C-N 3.32Å; Q67-N69 PolarHBondContact O-N 3.17Å; Q67-N70 PolarHBondContact O-N 3.2Å; Q67-F71 WeakPolarHBondContact O-CD2 3.44Å; Q67-F71 PolarHBondContact O-N 3.39Å |
| 68 | R | 58.4 | Low | 58.9 | Low | 160 Ų | 160 | 136.9 Ų | 136.9 | 60% | 0.604 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -63.7 | -35.2 | -179.9 | -165.5 | -178.4 | -175.7 | -151.7 | 4.2 | 113.4 | Y64 R65 F66 R72 | Y64-R68 WeakPolarHBondContact O-CB 3.16Å; Y64-R68 PolarHBondContact O-N 3.48Å; R65-R68 PolarHBondContact O-N 3.24Å; F66-R68 PolarHBondContact O-N 3.38Å; R68-R72 PolarHBondContact O-N 3.45Å |
| 69 | N | 60.9 | Low | 59 | Low | 101 Ų | 101 | 140.8 Ų | 140.8 | 54% | 0.54 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -72 | -31 | 177.7 | -76.5 | -12.9 | 0 | 0 | 0 | 112.4 | R65 F66 Q67 R73 | R65-N69 PolarHBondContact O-N 3.37Å; F66-N69 PolarHBondContact O-N 3.46Å; Q67-N69 VanDerWaalsContact C-N 3.32Å; Q67-N69 PolarHBondContact O-N 3.17Å; N69-R73 PolarHBondContact O-N 3.41Å |
| 70 | N | 61.1 | Low | 59 | Low | 103 Ų | 103 | 140.9 Ų | 140.9 | 55% | 0.551 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -71.5 | -38.3 | 175.5 | -71.7 | -15.1 | 0 | 0 | 0 | 112.2 | F66 Q67 R72 R73 N74 | F66-N70 PolarHBondContact O-N 3.17Å; Q67-N70 PolarHBondContact O-N 3.2Å; N70-R72 VanDerWaalsContact C-N 3.32Å; N70-R72 PolarHBondContact O-N 3.38Å; N70-R73 PolarHBondContact O-N 3.23Å; N70-N74 PolarHBondContact O-N 3.37Å |
| 71 | F | 61.2 | Low | 59.2 | Low | 161 Ų | 161 | 137.6 Ų | 137.6 | 71% | 0.706 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -65.7 | -31.6 | 175.7 | -77.7 | -71 | 0 | 0 | 0 | 113.6 | Q67 | Q67-F71 WeakPolarHBondContact O-CD2 3.44Å; Q67-F71 PolarHBondContact O-N 3.39Å |
| 72 | R | 59.3 | Low | 59.3 | Low | 156 Ų | 156 | 139.4 Ų | 139.4 | 59% | 0.589 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -76.1 | -25.9 | 177.8 | -77.1 | -174.4 | 171.6 | -166 | -5.6 | 114.1 | R68 N70 | R68-R72 PolarHBondContact O-N 3.45Å; N70-R72 VanDerWaalsContact C-N 3.32Å; N70-R72 PolarHBondContact O-N 3.38Å |
| 73 | R | 59.5 | Low | 59.3 | Low | 203 Ų | 203 | 143.2 Ų | 143.2 | 77% | 0.766 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -75.9 | -30.9 | 176.8 | -97.7 | -174 | 172.9 | -175.3 | -2.5 | 112.6 | N69 N70 | N69-R73 PolarHBondContact O-N 3.41Å; N70-R73 PolarHBondContact O-N 3.23Å |
| 74 | N | 61 | Low | 59.3 | Low | 136 Ų | 136 | 146.4 Ų | 146.4 | 73% | 0.727 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92 | 7.6 | -175.2 | -65.4 | 1.5 | 0 | 0 | 0 | 113.9 | N70 | N70-N74 PolarHBondContact O-N 3.37Š|
| 75 | S | 60.8 | Low | 59.2 | Low | 88 Ų | 88 | 145.5 Ų | 145.5 | 62% | 0.615 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.7 | 17.6 | 179.2 | 89.7 | 0 | 0 | 0 | 0 | 113.6 | ||
| 76 | L | 59.3 | Low | 59.3 | Low | 148 Ų | 148 | 142.5 Ų | 142.5 | 78% | 0.775 | 68% | 0.675 | S | S | * | * | trans | -122.8 | 10.5 | -175.9 | -85.7 | 163.4 | 0 | 0 | 0 | 113.7 | ||||
| 77 | D | 50.8 | Low | 59.3 | Low | 219 Ų | 219 | 143.5 Ų | 143.5 | 100% | 1.171 | 68% | 0.684 | S | S | * | * | trans | -119.1 | 0 | 166.3 | -66.6 | -40 | 0 | 0 | 0 | 108.8 |
Retrieved 77 of 77 residues in 28.3 ms
(Link to these results)