| 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 | 44.2 | Very low | 51.8 | Low | 249 Ų | 249 | 174.7 Ų | 174.7 | 100% | 1.227 | 88% | 0.875 | S | S | * | * | 0 | 82.7 | 0 | -144.2 | 175.8 | -73.9 | 0 | 0 | 105.3 | |||||
| 2 | E | 45.2 | Very low | 52 | Low | 187 Ų | 187 | 169.4 Ų | 169.4 | 87% | 0.874 | 86% | 0.862 | S | S | * | * | trans | -85.2 | 114.8 | -173.3 | -74.3 | 163.6 | 114.6 | 0 | 0 | 109.8 | ||||
| 3 | L | 55 | Low | 51.5 | Low | 174 Ų | 174 | 168 Ų | 168 | 91% | 0.911 | 86% | 0.858 | S | S | * | * | trans | -149.6 | 71.3 | 157.3 | -76.3 | -177.9 | 0 | 0 | 0 | 108 | ||||
| 4 | M | 56.6 | Low | 51.6 | Low | 180 Ų | 180 | 166.7 Ų | 166.7 | 89% | 0.887 | 85% | 0.854 | S | S | * | * | trans | -146.8 | 82.1 | 166.8 | -72.1 | -165.1 | -63.8 | 0 | 0 | 108.1 | ||||
| 5 | S | 59.7 | Low | 51.3 | Low | 109 Ų | 109 | 165.6 Ų | 165.6 | 76% | 0.762 | 85% | 0.851 | S | S | * | * | trans | -165.3 | 9.1 | 168.9 | -80.3 | 0 | 0 | 0 | 0 | 116.1 | E7 | S5-E7 PolarHBondContact O-N 3.46Š| ||
| 6 | L | 53.1 | Low | 50.9 | Low | 172 Ų | 172 | 164.9 Ų | 164.9 | 90% | 0.901 | 85% | 0.849 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 55.1 | -176.7 | -141.5 | 81.8 | 0 | 0 | 0 | 113.1 | ||
| 7 | E | 52.9 | Low | 50.6 | Low | 195 Ų | 195 | 162.6 Ų | 162.6 | 91% | 0.911 | 85% | 0.85 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.9 | -1.3 | 169.5 | -92.6 | -164.8 | 125.9 | 0 | 0 | 114.5 | S5 | S5-E7 PolarHBondContact O-N 3.46Š|
| 8 | Q | 54.9 | Low | 50.1 | Low | 171 Ų | 171 | 163.4 Ų | 163.4 | 80% | 0.799 | 86% | 0.855 | S | S | * | * | S | Bend | trans | -98.2 | 8.7 | -163.9 | -142.9 | 150.7 | 37.9 | 0 | 0 | 116.6 | ||
| 9 | N | 52.5 | Low | 49.9 | Very low | 150 Ų | 150 | 162.8 Ų | 162.8 | 80% | 0.802 | 85% | 0.852 | S | S | * | * | trans | -109.5 | 12.8 | -167.1 | -64.5 | -16.8 | 0 | 0 | 0 | 116 | ||||
| 10 | M | 48.4 | Very low | 49.3 | Very low | 160 Ų | 160 | 161.9 Ų | 161.9 | 79% | 0.788 | 85% | 0.849 | S | S | * | * | S | Bend | trans | -92.6 | -5.2 | -176.2 | -167.1 | 152.1 | 154.9 | 0 | 0 | 114.9 | ||
| 11 | F | 47.7 | Very low | 49.2 | Very low | 175 Ų | 175 | 159 Ų | 159 | 77% | 0.768 | 84% | 0.842 | S | S | * | * | trans | -127.3 | 108.6 | 178.8 | -62.4 | -74.4 | 0 | 0 | 0 | 111.3 | N13 | F11-N13 PolarHBondContact O-N 3.07Š| ||
| 12 | P | 54.2 | Low | 49 | Very low | 111 Ų | 111 | 153.2 Ų | 153.2 | 72% | 0.721 | 82% | 0.82 | S | S | * | * | trans | -75.8 | 115.3 | 170.4 | 28.8 | -28 | 0 | 0 | 0 | 109.4 | N14 | P12-N14 PolarHBondContact O-N 3.17Š| ||
| 13 | N | 44.7 | Very low | 49.1 | Very low | 151 Ų | 151 | 151.3 Ų | 151.3 | 81% | 0.807 | 82% | 0.816 | S | S | * | * | trans | -74 | 113.9 | 162 | -66.6 | -43.3 | 0 | 0 | 0 | 107.8 | F11 | F11-N13 PolarHBondContact O-N 3.07Š| ||
| 14 | N | 53.6 | Low | 48.5 | Very low | 150 Ų | 150 | 151.8 Ų | 151.8 | 80% | 0.802 | 81% | 0.814 | S | S | * | * | trans | -126 | 99.7 | 162.7 | -75.2 | -38 | 0 | 0 | 0 | 107.3 | P12 | P12-N14 PolarHBondContact O-N 3.17Š| ||
| 15 | D | 46.1 | Very low | 48 | Very low | 150 Ų | 150 | 150.5 Ų | 150.5 | 80% | 0.802 | 81% | 0.81 | S | S | * | * | trans | -74.5 | 161.6 | 155.6 | -75.5 | -51.7 | 0 | 0 | 0 | 109.6 | ||||
| 16 | D | 46.3 | Very low | 47.7 | Very low | 154 Ų | 154 | 150.6 Ų | 150.6 | 82% | 0.824 | 81% | 0.811 | S | S | * | * | trans | 83.6 | 107.1 | 175.4 | -66.9 | -28.8 | 0 | 0 | 0 | 118.3 | ||||
| 17 | C | 44.9 | Very low | 47.9 | Very low | 127 Ų | 127 | 146.3 Ų | 146.3 | 86% | 0.858 | 80% | 0.801 | S | S | * | * | -173.2 | 105.6 | 112.4 | -88.3 | 0 | 0 | 0 | 0 | 109.4 | N19 | C17-N19 PolarHBondContact O-N 2.8Š| |||
| 18 | N | 42.5 | Very low | 48.2 | Very low | 176 Ų | 176 | 142.5 Ų | 142.5 | 94% | 0.941 | 79% | 0.792 | S | S | * | * | trans | -58.4 | 123.4 | 155 | -105.7 | -23.6 | 0 | 0 | 0 | 108.5 | ||||
| 19 | N | 45.6 | Very low | 48.4 | Very low | 152 Ų | 152 | 138.8 Ų | 138.8 | 81% | 0.813 | 79% | 0.791 | S | S | * | * | trans | -146 | 124.1 | 154.9 | -155.5 | 7.5 | 0 | 0 | 0 | 109.5 | C17 | C17-N19 PolarHBondContact O-N 2.8Š| ||
| 20 | D | 39 | Very low | 49.1 | Very low | 145 Ų | 145 | 136.1 Ų | 136.1 | 78% | 0.775 | 78% | 0.78 | S | S | * | * | trans | -58.6 | 144.2 | 179.8 | -70.6 | -59.5 | 0 | 0 | 0 | 112.7 | ||||
| 21 | S | 46.6 | Very low | 50.4 | Low | 100 Ų | 100 | 133.9 Ų | 133.9 | 70% | 0.699 | 77% | 0.767 | S | S | * | * | trans | 133.7 | 111.7 | 137.2 | -65.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 22 | V | 40.1 | Very low | 51.9 | Low | 129 Ų | 129 | 130.1 Ų | 130.1 | 78% | 0.782 | 76% | 0.759 | S | S | * | * | trans | 40.7 | 87.9 | 134.7 | -173.3 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 23 | N | 47.2 | Very low | 53.1 | Low | 147 Ų | 147 | 129 Ų | 129 | 79% | 0.786 | 75% | 0.746 | S | S | * | * | trans | -133.7 | 113.9 | 145.1 | -79.8 | -54.1 | 0 | 0 | 0 | 108.9 | D25 | N23-D25 VanDerWaalsContact C-N 3.25Å; N23-D25 PolarHBondContact O-N 3.2Å | ||
| 24 | Q | 41.2 | Very low | 55.1 | Low | 184 Ų | 184 | 125.5 Ų | 125.5 | 86% | 0.86 | 73% | 0.728 | S | S | * | * | trans | -60.6 | 88.8 | 160.8 | -67.5 | 171.4 | -10.3 | 0 | 0 | 107.7 | ||||
| 25 | D | 47.8 | Very low | 56.8 | Low | 153 Ų | 153 | 122 Ų | 122 | 82% | 0.818 | 71% | 0.712 | S | S | * | * | trans | -101 | 96.5 | 162.9 | -93.1 | -27.4 | 0 | 0 | 0 | 108 | N23 A27 | N23-D25 VanDerWaalsContact C-N 3.25Å; N23-D25 PolarHBondContact O-N 3.2Å; D25-A27 PolarHBondContact O-N 2.8Å | ||
| 26 | S | 51.6 | Low | 58.9 | Low | 110 Ų | 110 | 120 Ų | 120 | 77% | 0.769 | 70% | 0.698 | S | S | * | * | trans | -35.6 | 108.3 | 161 | -61.3 | 0 | 0 | 0 | 0 | 109.5 | P28 | S26-P28 VanDerWaalsContact O-N 3.14Š| ||
| 27 | A | 59 | Low | 60.9 | Low | 83 Ų | 83 | 119.6 Ų | 119.6 | 69% | 0.686 | 69% | 0.685 | S | S | * | * | trans | -49.4 | 125.6 | 149.8 | 0 | 0 | 0 | 0 | 0 | 105 | D25 A29 | D25-A27 PolarHBondContact O-N 2.8Å; A27-A29 VanDerWaalsContact C-N 3.34Å; A27-A29 PolarHBondContact O-N 2.91Å | ||
| 28 | P | 57.9 | Low | 63 | Low | 114 Ų | 114 | 119 Ų | 119 | 74% | 0.74 | 67% | 0.671 | S | S | * | * | trans | -57 | 108.1 | -179.8 | 21.9 | -30.4 | 0 | 0 | 0 | 105.8 | S26 V30 | S26-P28 VanDerWaalsContact O-N 3.14Å; P28-V30 PolarHBondContact O-N 3.43Å | ||
| 29 | A | 60 | Low | 65.4 | Low | 94 Ų | 94 | 116 Ų | 116 | 78% | 0.777 | 65% | 0.651 | S | S | * | * | trans | -64.3 | 96.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 104.3 | A27 H31 | A27-A29 VanDerWaalsContact C-N 3.34Å; A27-A29 PolarHBondContact O-N 2.91Å; A29-H31 PolarHBondContact O-N 3.28Å | ||
| 30 | V | 65.8 | Low | 67.6 | Low | 93 Ų | 93 | 111.5 Ų | 111.5 | 56% | 0.564 | 64% | 0.635 | S | S | * | * | trans | -57.2 | 111.1 | 176.2 | -178.5 | 0 | 0 | 0 | 0 | 104.8 | P28 V32 D34 V35 | P28-V30 PolarHBondContact O-N 3.43Å; V30-V32 PolarHBondContact O-N 2.98Å; V30-D34 HydrophobicContact CG1-CB 4.02Å; V30-V35 HydrophobicContact CB-CG2 4.48Å; V30-V35 HydrophobicContact CG1-CG2 3.62Å | ||
| 31 | H | 76.9 | Confident | 69.9 | Low | 113 Ų | 113 | 113 Ų | 113 | 52% | 0.523 | 63% | 0.63 | S | S | . | * | trans | -61.6 | 142.2 | -173.4 | -146.9 | -99.6 | 0 | 0 | 0 | 107.3 | A29 D33 D34 V35 | A29-H31 PolarHBondContact O-N 3.28Å; H31-D33 IonicContact CE1-OD2 3.67Å; H31-D33 PolarHBondContact CE1-OD2 3.45Å; H31-D33 IonicContact ND1-OD2 2.9Å; H31-D33 PolarHBondContact ND1-OD2 2.91Å; H31-D33 PolarHBondContact O-N 2.87Å; H31-D34 WeakPolarHBondContact O-CA 3.36Å; H31-D34 WeakPolarHBondContact O-CB 3.43Å; H31-D34 PolarHBondContact O-N 2.99Å; H31-V35 PolarHBondContact O-N 2.74Å | ||
| 32 | V | 78.5 | Confident | 72 | Confident | 97 Ų | 97 | 112.7 Ų | 112.7 | 59% | 0.588 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -54.1 | -33.5 | 177.6 | 175 | 0 | 0 | 0 | 0 | 110.3 | V30 D34 V35 Q36 | V30-V32 PolarHBondContact O-N 2.98Å; V32-D34 VanDerWaalsContact C-N 3.33Å; V32-D34 PolarHBondContact O-N 2.76Å; V32-V35 PolarHBondContact O-N 2.91Å; V32-Q36 HydrophobicContact CG1-CG 4.33Å; V32-Q36 WeakPolarHBondContact O-CG 3.46Å; V32-Q36 PolarHBondContact O-N 3.15Å |
| 33 | D | 80.7 | Confident | 74.4 | Confident | 86 Ų | 86 | 111.5 Ų | 111.5 | 46% | 0.46 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -63.3 | -33.6 | 173.9 | -58.4 | -41.5 | 0 | 0 | 0 | 113.7 | H31 R37 | H31-D33 IonicContact CE1-OD2 3.67Å; H31-D33 PolarHBondContact CE1-OD2 3.45Å; H31-D33 IonicContact ND1-OD2 2.9Å; H31-D33 PolarHBondContact ND1-OD2 2.91Å; H31-D33 PolarHBondContact O-N 2.87Å; D33-R37 WeakPolarHBondContact O-CB 3.44Å; D33-R37 PolarHBondContact O-N 3.45Å |
| 34 | D | 86.1 | Confident | 76.4 | Confident | 78 Ų | 78 | 110.8 Ų | 110.8 | 42% | 0.417 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -71.2 | -40.1 | 175.8 | -68.3 | -35.6 | 0 | 0 | 0 | 110.9 | V30 H31 V32 R37 M38 | V30-D34 HydrophobicContact CG1-CB 4.02Å; H31-D34 WeakPolarHBondContact O-CA 3.36Å; H31-D34 WeakPolarHBondContact O-CB 3.43Å; H31-D34 PolarHBondContact O-N 2.99Å; V32-D34 VanDerWaalsContact C-N 3.33Å; V32-D34 PolarHBondContact O-N 2.76Å; D34-R37 PolarHBondContact O-N 2.83Å; D34-M38 WeakPolarHBondContact O-CB 3.36Å; D34-M38 PolarHBondContact O-N 2.88Å |
| 35 | V | 88.1 | Confident | 78.4 | Confident | 78 Ų | 78 | 104.9 Ų | 104.9 | 47% | 0.473 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -64 | -49.3 | 175 | -177.5 | 0 | 0 | 0 | 0 | 110.4 | V30 H31 V32 R37 M38 E39 | V30-V35 HydrophobicContact CB-CG2 4.48Å; V30-V35 HydrophobicContact CG1-CG2 3.62Å; H31-V35 PolarHBondContact O-N 2.74Å; V32-V35 PolarHBondContact O-N 2.91Å; V35-R37 VanDerWaalsContact C-N 3.31Å; V35-R37 PolarHBondContact O-N 3.47Å; V35-M38 WeakPolarHBondContact O-CB 3.33Å; V35-M38 PolarHBondContact O-N 3.14Å; V35-M38 VanDerWaalsContact O-N 3.14Å; V35-E39 WeakPolarHBondContact O-CB 3.44Å; V35-E39 PolarHBondContact O-N 2.9Å |
| 36 | Q | 90.3 | Very high | 80.3 | Confident | 108 Ų | 108 | 102.2 Ų | 102.2 | 51% | 0.505 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.5 | -38.7 | 177.9 | -72.3 | 179.2 | 3.1 | 0 | 0 | 111.8 | V32 M38 E39 A40 | V32-Q36 HydrophobicContact CG1-CG 4.33Å; V32-Q36 WeakPolarHBondContact O-CG 3.46Å; V32-Q36 PolarHBondContact O-N 3.15Å; Q36-M38 VanDerWaalsContact C-N 3.35Å; Q36-E39 PolarHBondContact O-N 3.22Å; Q36-A40 WeakPolarHBondContact O-CB 3.36Å; Q36-A40 PolarHBondContact O-N 3.08Å |
| 37 | R | 90 | Very high | 82 | Confident | 145 Ų | 145 | 101.9 Ų | 101.9 | 55% | 0.547 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.8 | -38.7 | 174.9 | -175 | -177.3 | -62.1 | -170.6 | 0.8 | 111.7 | D33 D34 V35 R41 | D33-R37 WeakPolarHBondContact O-CB 3.44Å; D33-R37 PolarHBondContact O-N 3.45Å; D34-R37 PolarHBondContact O-N 2.83Å; V35-R37 VanDerWaalsContact C-N 3.31Å; V35-R37 PolarHBondContact O-N 3.47Å; R37-R41 VanDerWaalsContact O-CG 3.29Å; R37-R41 WeakPolarHBondContact O-CG 3.1Å; R37-R41 PolarHBondContact O-N 2.9Å; R37-R41 VanDerWaalsContact O-N 3.12Å |
| 38 | M | 88 | Confident | 83.1 | Confident | 114 Ų | 114 | 100.1 Ų | 100.1 | 56% | 0.562 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -65.7 | -47.3 | 175.1 | -171.7 | -177.4 | -54.1 | 0 | 0 | 110.9 | D34 V35 Q36 A40 R41 L42 | D34-M38 WeakPolarHBondContact O-CB 3.36Å; D34-M38 PolarHBondContact O-N 2.88Å; V35-M38 WeakPolarHBondContact O-CB 3.33Å; V35-M38 PolarHBondContact O-N 3.14Å; V35-M38 VanDerWaalsContact O-N 3.14Å; Q36-M38 VanDerWaalsContact C-N 3.35Å; M38-A40 PolarHBondContact O-N 3.12Å; M38-R41 WeakPolarHBondContact O-CB 3.36Å; M38-R41 PolarHBondContact O-N 3.4Å; M38-R41 VanDerWaalsContact O-N 3.15Å; M38-L42 HydrophobicContact CG-CD1 4.24Å; M38-L42 WeakPolarHBondContact O-CG 3.45Å; M38-L42 PolarHBondContact O-N 2.83Å |
| 39 | E | 93.2 | Very high | 84.3 | Confident | 112 Ų | 112 | 99.6 Ų | 99.6 | 52% | 0.523 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -56.9 | -48.9 | 175.7 | -176.6 | -176.2 | -166.9 | 0 | 0 | 111.4 | V35 Q36 R41 L42 L43 | V35-E39 WeakPolarHBondContact O-CB 3.44Å; V35-E39 PolarHBondContact O-N 2.9Å; Q36-E39 PolarHBondContact O-N 3.22Å; E39-R41 VanDerWaalsContact C-N 3.27Å; E39-R41 PolarHBondContact O-N 3.07Å; E39-L42 PolarHBondContact O-N 3.47Å; E39-L42 VanDerWaalsContact O-N 3.08Å; E39-L43 HydrophobicContact CG-CD1 4.11Å; E39-L43 HydrophobicContact CG-CG 4.42Å; E39-L43 WeakPolarHBondContact O-CG 3.36Å; E39-L43 PolarHBondContact O-N 2.93Å |
| 40 | A | 91.6 | Very high | 85.5 | Confident | 59 Ų | 59 | 101.6 Ų | 101.6 | 49% | 0.488 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.2 | -38.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | Q36 M38 K44 | Q36-A40 WeakPolarHBondContact O-CB 3.36Å; Q36-A40 PolarHBondContact O-N 3.08Å; M38-A40 PolarHBondContact O-N 3.12Å; A40-K44 WeakPolarHBondContact O-CB 3.29Å; A40-K44 PolarHBondContact O-N 3.3Å |
| 41 | R | 87.3 | Confident | 86.2 | Confident | 176 Ų | 176 | 101.4 Ų | 101.4 | 66% | 0.664 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.3 | -41.5 | 174.3 | -73.8 | 174.9 | -178.7 | -170.7 | 1 | 111.8 | R37 M38 E39 K44 L45 | R37-R41 VanDerWaalsContact O-CG 3.29Å; R37-R41 WeakPolarHBondContact O-CG 3.1Å; R37-R41 PolarHBondContact O-N 2.9Å; R37-R41 VanDerWaalsContact O-N 3.12Å; M38-R41 WeakPolarHBondContact O-CB 3.36Å; M38-R41 PolarHBondContact O-N 3.4Å; M38-R41 VanDerWaalsContact O-N 3.15Å; E39-R41 VanDerWaalsContact C-N 3.27Å; E39-R41 PolarHBondContact O-N 3.07Å; R41-K44 PolarHBondContact O-N 3.33Å; R41-L45 WeakPolarHBondContact O-CB 3.37Å; R41-L45 PolarHBondContact O-N 2.93Å |
| 42 | L | 90.1 | Very high | 85.9 | Confident | 94 Ų | 94 | 99.3 Ų | 99.3 | 49% | 0.492 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67.5 | -41.5 | 178.2 | -69.3 | 174.7 | 0 | 0 | 0 | 112.1 | M38 E39 L45 L46 | M38-L42 HydrophobicContact CG-CD1 4.24Å; M38-L42 WeakPolarHBondContact O-CG 3.45Å; M38-L42 PolarHBondContact O-N 2.83Å; E39-L42 PolarHBondContact O-N 3.47Å; E39-L42 VanDerWaalsContact O-N 3.08Å; L42-L45 VanDerWaalsContact O-CB 3.31Å; L42-L45 WeakPolarHBondContact O-CB 3.31Å; L42-L45 PolarHBondContact O-N 3.27Å; L42-L46 WeakPolarHBondContact O-CG 3.41Å; L42-L46 PolarHBondContact O-N 3.22Å |
| 43 | L | 91.8 | Very high | 85.5 | Confident | 103 Ų | 103 | 101 Ų | 101 | 54% | 0.539 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.7 | -42.7 | 175.1 | -71.9 | 174.4 | 0 | 0 | 0 | 111.6 | E39 L45 L46 D47 | E39-L43 HydrophobicContact CG-CD1 4.11Å; E39-L43 HydrophobicContact CG-CG 4.42Å; E39-L43 WeakPolarHBondContact O-CG 3.36Å; E39-L43 PolarHBondContact O-N 2.93Å; L43-L45 VanDerWaalsContact C-N 3.31Å; L43-L45 PolarHBondContact O-N 3.31Å; L43-L46 PolarHBondContact O-N 3.41Å; L43-D47 PolarHBondContact O-N 3.23Å |
| 44 | K | 87.8 | Confident | 84.6 | Confident | 132 Ų | 132 | 100.5 Ų | 100.5 | 57% | 0.574 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -60.9 | -42.1 | 172.8 | -172.6 | -173.5 | -179.3 | -154.4 | 0 | 111.6 | A40 R41 L46 D47 E48 | A40-K44 WeakPolarHBondContact O-CB 3.29Å; A40-K44 PolarHBondContact O-N 3.3Å; R41-K44 PolarHBondContact O-N 3.33Å; K44-L46 VanDerWaalsContact C-N 3.33Å; K44-L46 PolarHBondContact O-N 2.91Å; K44-D47 PolarHBondContact O-N 3.04Å; K44-E48 WeakPolarHBondContact CE-OE1 3.5Å; K44-E48 IonicContact NZ-OE1 3.2Å; K44-E48 WeakPolarHBondContact O-CB 3.1Å; K44-E48 WeakPolarHBondContact O-CG 3.14Å; K44-E48 PolarHBondContact O-N 2.92Å |
| 45 | L | 83.2 | Confident | 83.3 | Confident | 61 Ų | 61 | 97.5 Ų | 97.5 | 32% | 0.319 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.9 | -44.1 | 176.3 | -159.7 | 79.1 | 0 | 0 | 0 | 111.2 | R41 L42 L43 E48 F49 | R41-L45 WeakPolarHBondContact O-CB 3.37Å; R41-L45 PolarHBondContact O-N 2.93Å; L42-L45 VanDerWaalsContact O-CB 3.31Å; L42-L45 WeakPolarHBondContact O-CB 3.31Å; L42-L45 PolarHBondContact O-N 3.27Å; L43-L45 VanDerWaalsContact C-N 3.31Å; L43-L45 PolarHBondContact O-N 3.31Å; L45-E48 PolarHBondContact O-N 3.49Å; L45-F49 HydrophobicContact CD2-CE2 3.94Å; L45-F49 HydrophobicContact CG-CD2 4.07Å; L45-F49 HydrophobicContact CG-CE2 3.82Å; L45-F49 WeakPolarHBondContact O-CD2 3.49Å; L45-F49 PolarHBondContact O-N 3.48Å |
| 46 | L | 88 | Confident | 82.1 | Confident | 96 Ų | 96 | 99 Ų | 99 | 50% | 0.503 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.5 | -42.1 | 177.1 | -75.3 | 170.4 | 0 | 0 | 0 | 112.3 | L42 L43 K44 F49 N50 | L42-L46 WeakPolarHBondContact O-CG 3.41Å; L42-L46 PolarHBondContact O-N 3.22Å; L43-L46 PolarHBondContact O-N 3.41Å; K44-L46 VanDerWaalsContact C-N 3.33Å; K44-L46 PolarHBondContact O-N 2.91Å; L46-F49 PolarHBondContact O-N 3.38Å; L46-N50 WeakPolarHBondContact O-CB 2.81Å; L46-N50 VanDerWaalsContact O-CG 3.28Å; L46-N50 PolarHBondContact O-N 2.93Å; L46-N50 PolarHBondContact O-ND2 2.86Å |
| 47 | D | 87.4 | Confident | 80.6 | Confident | 104 Ų | 104 | 95.2 Ų | 95.2 | 56% | 0.556 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62 | -44.6 | 174.7 | -170.7 | 48.9 | 0 | 0 | 0 | 111.2 | L43 K44 F49 N50 V51 | L43-D47 PolarHBondContact O-N 3.23Å; K44-D47 PolarHBondContact O-N 3.04Å; D47-F49 PolarHBondContact O-N 3.46Å; D47-N50 PolarHBondContact O-N 3Å; D47-V51 WeakPolarHBondContact O-CG2 3.3Å; D47-V51 PolarHBondContact O-N 3.38Å; D47-V51 VanDerWaalsContact O-N 3.16Å |
| 48 | E | 83.1 | Confident | 79.1 | Confident | 45 Ų | 45 | 94.7 Ų | 94.7 | 21% | 0.21 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -58.7 | -43.9 | 173.8 | -73.9 | 175.3 | -173.4 | 0 | 0 | 112.1 | K44 L45 V51 G52 K53 | K44-E48 WeakPolarHBondContact CE-OE1 3.5Å; K44-E48 IonicContact NZ-OE1 3.2Å; K44-E48 WeakPolarHBondContact O-CB 3.1Å; K44-E48 WeakPolarHBondContact O-CG 3.14Å; K44-E48 PolarHBondContact O-N 2.92Å; L45-E48 PolarHBondContact O-N 3.49Å; E48-V51 WeakPolarHBondContact O-CG2 3.14Å; E48-V51 PolarHBondContact O-N 3.44Å; E48-G52 PolarHBondContact O-N 2.86Å; E48-K53 HydrophobicContact CB-CB 4.09Å; E48-K53 HydrophobicContact CG-CD 4.29Å; E48-K53 WeakPolarHBondContact O-CA 3.35Å; E48-K53 WeakPolarHBondContact O-CB 3.47Å; E48-K53 PolarHBondContact O-N 3.34Å |
| 49 | F | 82.6 | Confident | 77.8 | Confident | 103 Ų | 103 | 95.4 Ų | 95.4 | 45% | 0.452 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62 | -43.1 | 174.8 | -86.5 | -65.2 | 0 | 0 | 0 | 112.7 | L45 L46 D47 V51 G52 S55 F56 | L45-F49 HydrophobicContact CD2-CE2 3.94Å; L45-F49 HydrophobicContact CG-CD2 4.07Å; L45-F49 HydrophobicContact CG-CE2 3.82Å; L45-F49 WeakPolarHBondContact O-CD2 3.49Å; L45-F49 PolarHBondContact O-N 3.48Å; L46-F49 PolarHBondContact O-N 3.38Å; D47-F49 PolarHBondContact O-N 3.46Å; F49-V51 VanDerWaalsContact C-N 3.3Å; F49-V51 PolarHBondContact O-N 3.16Å; F49-G52 PolarHBondContact O-N 3.44Å; F49-S55 VanDerWaalsContact CE1-OG 3.3Å; F49-S55 WeakPolarHBondContact CE1-OG 3.4Å; F49-S55 WeakPolarHBondContact CE2-OG 3.37Å; F49-S55 WeakPolarHBondContact CZ-OG 3.45Å; F49-F56 HydrophobicContact CZ-CE2 4.13Å |
| 50 | N | 84 | Confident | 76.4 | Confident | 136 Ų | 136 | 91.6 Ų | 91.6 | 73% | 0.727 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.7 | -31.3 | -178.1 | -75.2 | -30.8 | 0 | 0 | 0 | 112.9 | L46 D47 G52 | L46-N50 WeakPolarHBondContact O-CB 2.81Å; L46-N50 VanDerWaalsContact O-CG 3.28Å; L46-N50 PolarHBondContact O-N 2.93Å; L46-N50 PolarHBondContact O-ND2 2.86Å; D47-N50 PolarHBondContact O-N 3Å; N50-G52 VanDerWaalsContact C-N 3.3Å |
| 51 | V | 82.4 | Confident | 75.5 | Confident | 90 Ų | 90 | 90.4 Ų | 90.4 | 55% | 0.545 | 49% | 0.489 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.2 | 7 | 174.4 | -57.8 | 0 | 0 | 0 | 0 | 113.3 | D47 E48 F49 K53 | D47-V51 WeakPolarHBondContact O-CG2 3.3Å; D47-V51 PolarHBondContact O-N 3.38Å; D47-V51 VanDerWaalsContact O-N 3.16Å; E48-V51 WeakPolarHBondContact O-CG2 3.14Å; E48-V51 PolarHBondContact O-N 3.44Å; F49-V51 VanDerWaalsContact C-N 3.3Å; F49-V51 PolarHBondContact O-N 3.16Å; V51-K53 VanDerWaalsContact C-N 3.31Å; V51-K53 HydrophobicContact CG2-CB 4.33Å; V51-K53 HydrophobicContact CG2-CD 3.88Å; V51-K53 HydrophobicContact CG2-CG 3.9Å; V51-K53 PolarHBondContact O-N 2.92Å |
| 52 | G | 70.6 | Confident | 75.1 | Confident | 69 Ų | 69 | 87.9 Ų | 87.9 | 71% | 0.711 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.9 | 14.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | E48 F49 N50 S54 | E48-G52 PolarHBondContact O-N 2.86Å; F49-G52 PolarHBondContact O-N 3.44Å; N50-G52 VanDerWaalsContact C-N 3.3Å; G52-S54 PolarHBondContact O-N 3.46Å |
| 53 | K | 69 | Low | 74.7 | Confident | 131 Ų | 131 | 90.9 Ų | 90.9 | 57% | 0.57 | 49% | 0.492 | S | S | * | . | trans | -72.3 | 128 | 169.9 | -73.7 | 172.6 | -176.1 | 172.8 | 0 | 108 | E48 V51 S55 | E48-K53 HydrophobicContact CB-CB 4.09Å; E48-K53 HydrophobicContact CG-CD 4.29Å; E48-K53 WeakPolarHBondContact O-CA 3.35Å; E48-K53 WeakPolarHBondContact O-CB 3.47Å; E48-K53 PolarHBondContact O-N 3.34Å; V51-K53 VanDerWaalsContact C-N 3.31Å; V51-K53 HydrophobicContact CG2-CB 4.33Å; V51-K53 HydrophobicContact CG2-CD 3.88Å; V51-K53 HydrophobicContact CG2-CG 3.9Å; V51-K53 PolarHBondContact O-N 2.92Å; K53-S55 VanDerWaalsContact C-N 3.35Å; K53-S55 PolarHBondContact O-N 3.37Å | ||
| 54 | S | 62.9 | Low | 74.4 | Confident | 76 Ų | 76 | 91 Ų | 91 | 53% | 0.531 | 49% | 0.488 | S | S | . | . | trans | -61.2 | 102.4 | 168.5 | -177.5 | 0 | 0 | 0 | 0 | 107.7 | G52 F56 G57 | G52-S54 PolarHBondContact O-N 3.46Å; S54-F56 PolarHBondContact O-N 3Å; S54-G57 PolarHBondContact O-N 3.43Å | ||
| 55 | S | 58.8 | Low | 74.4 | Confident | 15 Ų | 15 | 88.1 Ų | 88.1 | 11% | 0.105 | 48% | 0.479 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -10.7 | -177.3 | 66.4 | 0 | 0 | 0 | 0 | 113.1 | F49 K53 G57 | F49-S55 VanDerWaalsContact CE1-OG 3.3Å; F49-S55 WeakPolarHBondContact CE1-OG 3.4Å; F49-S55 WeakPolarHBondContact CE2-OG 3.37Å; F49-S55 WeakPolarHBondContact CZ-OG 3.45Å; K53-S55 VanDerWaalsContact C-N 3.35Å; K53-S55 PolarHBondContact O-N 3.37Å; S55-G57 VanDerWaalsContact C-N 3.34Å |
| 56 | F | 62.2 | Low | 74.7 | Confident | 111 Ų | 111 | 88.7 Ų | 88.7 | 49% | 0.487 | 48% | 0.482 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | 4.7 | 174.5 | -57.8 | -76.7 | 0 | 0 | 0 | 113.9 | F49 S54 C60 Y62 | F49-F56 HydrophobicContact CZ-CE2 4.13Å; S54-F56 PolarHBondContact O-N 3Å; F56-C60 HydrophobicContact CB-CB 3.57Å; F56-C60 WeakPolarHBondContact CB-SG 3.37Å; F56-C60 WeakPolarHBondContact O-CB 3.17Å; F56-Y62 HydrophobicContact CB-CD2 4.36Å; F56-Y62 HydrophobicContact CB-CE2 3.94Å; F56-Y62 AromaticContact CD1-CE2 3.71Å; F56-Y62 HydrophobicContact CD1-CE2 3.71Å; F56-Y62 HydrophobicContact CD2-CD2 4.19Å; F56-Y62 AromaticContact CD2-CE2 3.67Å; F56-Y62 HydrophobicContact CD2-CE2 3.67Å; F56-Y62 HydrophobicContact CE1-CE2 4.05Å; F56-Y62 HydrophobicContact CE2-CE2 4.02Å; F56-Y62 HydrophobicContact CG-CD2 4.23Å; F56-Y62 AromaticContact CG-CE2 3.5Å; F56-Y62 HydrophobicContact CG-CE2 3.5Å; F56-Y62 HydrophobicContact CZ-CE2 4.19Å |
| 57 | G | 58.2 | Low | 74.7 | Confident | 28 Ų | 28 | 86.8 Ų | 86.8 | 29% | 0.289 | 48% | 0.477 | S | S | . | . | trans | 80.4 | 159.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | S54 S55 N59 C60 | S54-G57 PolarHBondContact O-N 3.43Å; S55-G57 VanDerWaalsContact C-N 3.34Å; G57-N59 PolarHBondContact O-N 3.08Å; G57-N59 VanDerWaalsContact O-N 3.08Å; G57-C60 WeakPolarHBondContact O-CB 2.98Å; G57-C60 PolarHBondContact O-N 3.19Å | ||
| 58 | P | 58.3 | Low | 75 | Confident | 133 Ų | 133 | 82.5 Ų | 82.5 | 86% | 0.864 | 45% | 0.453 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.9 | -14.6 | -178.5 | 27.4 | -35.3 | 0 | 0 | 0 | 113.4 | ||
| 59 | N | 61.8 | Low | 75.5 | Confident | 129 Ų | 129 | 87 Ų | 87 | 69% | 0.69 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.5 | 10.6 | 177.3 | -62.4 | -38.9 | 0 | 0 | 0 | 112.6 | G57 P61 | G57-N59 PolarHBondContact O-N 3.08Å; G57-N59 VanDerWaalsContact O-N 3.08Å; N59-P61 VanDerWaalsContact O-CD 3.29Å; N59-P61 WeakPolarHBondContact O-CD 3.29Å |
| 60 | C | 62.8 | Low | 76.1 | Confident | 32 Ų | 32 | 85.6 Ų | 85.6 | 22% | 0.216 | 47% | 0.466 | C | S | . | . | trans | -64.8 | 120.7 | 178.5 | -162.7 | 0 | 0 | 0 | 0 | 110.2 | F56 G57 Y62 | F56-C60 HydrophobicContact CB-CB 3.57Å; F56-C60 WeakPolarHBondContact CB-SG 3.37Å; F56-C60 WeakPolarHBondContact O-CB 3.17Å; G57-C60 WeakPolarHBondContact O-CB 2.98Å; G57-C60 PolarHBondContact O-N 3.19Å; C60-Y62 HydrophobicContact CB-CD2 4.25Å; C60-Y62 PolarHBondContact O-N 2.73Å; C60-Y62 VanDerWaalsContact O-N 3.09Å; C60-Y62 WeakPolarHBondContact SG-CD2 3.31Å; C60-Y62 WeakPolarHBondContact SG-CE2 3.41Å | ||
| 61 | P | 73 | Confident | 76.7 | Confident | 34 Ų | 34 | 81.5 Ų | 81.5 | 22% | 0.221 | 44% | 0.442 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.6 | 9.1 | -175.3 | 32.4 | -35.6 | 0 | 0 | 0 | 112.9 | N59 E63 K64 L65 L134 | N59-P61 VanDerWaalsContact O-CD 3.29Å; N59-P61 WeakPolarHBondContact O-CD 3.29Å; P61-E63 PolarHBondContact O-N 3.09Å; P61-K64 CarbonylContact O-C 3.52Å; P61-K64 WeakPolarHBondContact O-CA 3.38Å; P61-K64 WeakPolarHBondContact O-CB 3.33Å; P61-K64 PolarHBondContact O-N 3.21Å; P61-L65 HydrophobicContact CB-CD1 4.24Å; P61-L65 HydrophobicContact CB-CG 4.19Å; P61-L65 HydrophobicContact CG-CD1 3.9Å; P61-L65 HydrophobicContact CG-CG 4.38Å; P61-L65 WeakPolarHBondContact O-CB 3.47Å; P61-L65 WeakPolarHBondContact O-CG 3.37Å; P61-L65 PolarHBondContact O-N 2.9Å; P61-L134 HydrophobicContact CB-CD1 3.58Å |
| 62 | Y | 79.1 | Confident | 77.3 | Confident | 123 Ų | 123 | 81.7 Ų | 81.7 | 48% | 0.482 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -54.2 | -47 | -173.5 | -74.9 | -49.9 | 0 | 0 | 0 | 113.3 | F56 C60 K64 L65 D66 | F56-Y62 HydrophobicContact CB-CD2 4.36Å; F56-Y62 HydrophobicContact CB-CE2 3.94Å; F56-Y62 AromaticContact CD1-CE2 3.71Å; F56-Y62 HydrophobicContact CD1-CE2 3.71Å; F56-Y62 HydrophobicContact CD2-CD2 4.19Å; F56-Y62 AromaticContact CD2-CE2 3.67Å; F56-Y62 HydrophobicContact CD2-CE2 3.67Å; F56-Y62 HydrophobicContact CE1-CE2 4.05Å; F56-Y62 HydrophobicContact CE2-CE2 4.02Å; F56-Y62 HydrophobicContact CG-CD2 4.23Å; F56-Y62 AromaticContact CG-CE2 3.5Å; F56-Y62 HydrophobicContact CG-CE2 3.5Å; F56-Y62 HydrophobicContact CZ-CE2 4.19Å; C60-Y62 HydrophobicContact CB-CD2 4.25Å; C60-Y62 PolarHBondContact O-N 2.73Å; C60-Y62 VanDerWaalsContact O-N 3.09Å; C60-Y62 WeakPolarHBondContact SG-CD2 3.31Å; C60-Y62 WeakPolarHBondContact SG-CE2 3.41Å; Y62-K64 PolarHBondContact O-N 3.16Å; Y62-L65 HydrophobicContact CD1-CD1 4.49Å; Y62-L65 CarbonylContact O-C 3.59Å; Y62-L65 PolarHBondContact O-N 3.28Å; Y62-L65 VanDerWaalsContact O-N 3.16Å; Y62-D66 VanDerWaalsContact O-CB 3.31Å; Y62-D66 WeakPolarHBondContact O-CB 3.43Å; Y62-D66 PolarHBondContact O-N 3.29Å |
| 63 | E | 81.3 | Confident | 78.5 | Confident | 157 Ų | 157 | 81 Ų | 81 | 73% | 0.734 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -59.6 | -37.9 | 177.2 | -62.7 | -59.2 | 144.5 | 0 | 0 | 112 | P61 S67 | P61-E63 PolarHBondContact O-N 3.09Å; E63-S67 VanDerWaalsContact O-CB 3.32Å; E63-S67 WeakPolarHBondContact O-CB 3.36Å; E63-S67 PolarHBondContact O-N 2.95Å |
| 64 | K | 85.2 | Confident | 79.8 | Confident | 105 Ų | 105 | 78.7 Ų | 78.7 | 46% | 0.457 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -72.5 | -40.1 | 177.2 | -63.2 | 179.9 | -179.4 | 176.2 | 0 | 111.5 | P61 Y62 S67 I68 L134 | P61-K64 CarbonylContact O-C 3.52Å; P61-K64 WeakPolarHBondContact O-CA 3.38Å; P61-K64 WeakPolarHBondContact O-CB 3.33Å; P61-K64 PolarHBondContact O-N 3.21Å; Y62-K64 PolarHBondContact O-N 3.16Å; K64-S67 WeakPolarHBondContact O-CB 3.42Å; K64-S67 PolarHBondContact O-N 3.29Å; K64-I68 VanDerWaalsContact O-CG1 3.29Å; K64-I68 WeakPolarHBondContact O-CG1 3.46Å; K64-I68 PolarHBondContact O-N 3.35Å; K64-L134 HydrophobicContact CB-CD1 4.07Å |
| 65 | L | 89.3 | Confident | 81.4 | Confident | 73 Ų | 73 | 76.1 Ų | 76.1 | 38% | 0.382 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -66.5 | -40.7 | 176.6 | -72.6 | 173.5 | 0 | 0 | 0 | 111.1 | P61 Y62 I68 R69 L134 | P61-L65 HydrophobicContact CB-CD1 4.24Å; P61-L65 HydrophobicContact CB-CG 4.19Å; P61-L65 HydrophobicContact CG-CD1 3.9Å; P61-L65 HydrophobicContact CG-CG 4.38Å; P61-L65 WeakPolarHBondContact O-CB 3.47Å; P61-L65 WeakPolarHBondContact O-CG 3.37Å; P61-L65 PolarHBondContact O-N 2.9Å; Y62-L65 HydrophobicContact CD1-CD1 4.49Å; Y62-L65 CarbonylContact O-C 3.59Å; Y62-L65 PolarHBondContact O-N 3.28Å; Y62-L65 VanDerWaalsContact O-N 3.16Å; L65-I68 PolarHBondContact O-N 3.37Å; L65-R69 WeakPolarHBondContact O-CB 3.4Å; L65-R69 PolarHBondContact O-N 3.48Å; L65-L134 HydrophobicContact CD2-CD1 4.11Å; L65-L134 HydrophobicContact CD2-CD2 3.53Å; L65-L134 HydrophobicContact CD2-CG 4.48Å; L65-L134 HydrophobicContact CG-CD1 4.28Å |
| 66 | D | 88.2 | Confident | 83 | Confident | 72 Ų | 72 | 80.3 Ų | 80.3 | 39% | 0.385 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -65.7 | -42.1 | 174.8 | -166.3 | 70.3 | 0 | 0 | 0 | 110.3 | Y62 I68 R69 N70 | Y62-D66 VanDerWaalsContact O-CB 3.31Å; Y62-D66 WeakPolarHBondContact O-CB 3.43Å; Y62-D66 PolarHBondContact O-N 3.29Å; D66-I68 PolarHBondContact O-N 2.9Å; D66-R69 WeakPolarHBondContact O-CB 3.29Å; D66-R69 PolarHBondContact O-N 3.31Å; D66-N70 WeakPolarHBondContact O-CB 3.44Å; D66-N70 PolarHBondContact O-N 2.81Å; D66-N70 PolarHBondContact O-ND2 2.75Å; D66-N70 PolarHBondContact OD2-ND2 2.95Å |
| 67 | S | 89.2 | Confident | 84.7 | Confident | 57 Ų | 57 | 82.1 Ų | 82.1 | 40% | 0.399 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -58.3 | -45.9 | 171.2 | -176.2 | 0 | 0 | 0 | 0 | 112.6 | E63 K64 N70 Q71 | E63-S67 VanDerWaalsContact O-CB 3.32Å; E63-S67 WeakPolarHBondContact O-CB 3.36Å; E63-S67 PolarHBondContact O-N 2.95Å; K64-S67 WeakPolarHBondContact O-CB 3.42Å; K64-S67 PolarHBondContact O-N 3.29Å; S67-N70 PolarHBondContact O-N 3.44Å; S67-Q71 WeakPolarHBondContact O-CG 3.32Å; S67-Q71 PolarHBondContact O-N 2.9Å |
| 68 | I | 92.6 | Very high | 86.5 | Confident | 13 Ų | 13 | 81.8 Ų | 81.8 | 7% | 0.067 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -62 | -44.4 | 175.7 | -73.7 | 164.6 | 0 | 0 | 0 | 110.9 | K64 L65 D66 N70 Q71 Q72 L127 A130 I131 L134 | K64-I68 VanDerWaalsContact O-CG1 3.29Å; K64-I68 WeakPolarHBondContact O-CG1 3.46Å; K64-I68 PolarHBondContact O-N 3.35Å; L65-I68 PolarHBondContact O-N 3.37Å; D66-I68 PolarHBondContact O-N 2.9Å; I68-N70 VanDerWaalsContact C-N 3.34Å; I68-N70 PolarHBondContact O-N 3.31Å; I68-Q71 WeakPolarHBondContact O-CB 3.38Å; I68-Q71 PolarHBondContact O-N 3.41Å; I68-Q72 WeakPolarHBondContact O-CG 3.35Å; I68-Q72 PolarHBondContact O-N 2.95Å; I68-L127 HydrophobicContact CG2-CD1 3.91Å; I68-A130 HydrophobicContact CD1-CB 4.47Å; I68-A130 HydrophobicContact CG1-CB 3.82Å; I68-I131 HydrophobicContact CD1-CG1 4.22Å; I68-I131 HydrophobicContact CG1-CG1 4.46Å; I68-I131 HydrophobicContact CG2-CG1 4.19Å; I68-L134 HydrophobicContact CD1-CB 4Å; I68-L134 HydrophobicContact CD1-CD2 3.76Å; I68-L134 HydrophobicContact CD1-CG 4.32Å |
| 69 | R | 94.5 | Very high | 88.2 | Confident | 139 Ų | 139 | 79.5 Ų | 79.5 | 53% | 0.525 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58.1 | -48.3 | 175.7 | 178.3 | -168.1 | 169.5 | -177.5 | 2.4 | 110.6 | L65 D66 Q71 Q72 E73 | L65-R69 WeakPolarHBondContact O-CB 3.4Å; L65-R69 PolarHBondContact O-N 3.48Å; D66-R69 WeakPolarHBondContact O-CB 3.29Å; D66-R69 PolarHBondContact O-N 3.31Å; R69-Q71 VanDerWaalsContact C-N 3.3Å; R69-Q71 PolarHBondContact O-N 2.82Å; R69-Q72 WeakPolarHBondContact O-CB 3.4Å; R69-Q72 PolarHBondContact O-N 3.12Å; R69-Q72 VanDerWaalsContact O-N 3.12Å; R69-E73 HydrophobicContact CG-CG 4.5Å; R69-E73 IonicContact CZ-OE1 3.55Å; R69-E73 IonicContact NE-OE1 3.21Å; R69-E73 PolarHBondContact NE-OE1 2.89Å; R69-E73 IonicContact NH2-OE1 2.8Å; R69-E73 PolarHBondContact NH2-OE1 3.24Å; R69-E73 WeakPolarHBondContact O-CG 3.33Å; R69-E73 PolarHBondContact O-N 3.38Å |
| 70 | N | 94.6 | Very high | 89.8 | Confident | 74 Ų | 74 | 79.6 Ų | 79.6 | 40% | 0.396 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59.9 | -41.9 | 178.5 | -70.2 | -35.6 | 0 | 0 | 0 | 111.4 | D66 S67 I68 Q72 E73 E74 | D66-N70 WeakPolarHBondContact O-CB 3.44Å; D66-N70 PolarHBondContact O-N 2.81Å; D66-N70 PolarHBondContact O-ND2 2.75Å; D66-N70 PolarHBondContact OD2-ND2 2.95Å; S67-N70 PolarHBondContact O-N 3.44Å; I68-N70 VanDerWaalsContact C-N 3.34Å; I68-N70 PolarHBondContact O-N 3.31Å; N70-Q72 PolarHBondContact O-N 3.03Å; N70-E73 PolarHBondContact O-N 3.19Å; N70-E74 WeakPolarHBondContact O-CB 3.47Å; N70-E74 PolarHBondContact O-N 3.18Å |
| 71 | Q | 95.8 | Very high | 91.3 | Very high | 50 Ų | 50 | 82 Ų | 82 | 23% | 0.234 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -62.1 | -41.1 | 174.3 | -72.9 | 178.2 | -22.8 | 0 | 0 | 112.5 | S67 I68 R69 E74 L75 L127 | S67-Q71 WeakPolarHBondContact O-CG 3.32Å; S67-Q71 PolarHBondContact O-N 2.9Å; I68-Q71 WeakPolarHBondContact O-CB 3.38Å; I68-Q71 PolarHBondContact O-N 3.41Å; R69-Q71 VanDerWaalsContact C-N 3.3Å; R69-Q71 PolarHBondContact O-N 2.82Å; Q71-E74 PolarHBondContact O-N 3Å; Q71-L75 PolarHBondContact O-N 3.06Å; Q71-L127 HydrophobicContact CB-CD1 4.03Å |
| 72 | Q | 95.3 | Very high | 92.4 | Very high | 94 Ų | 94 | 80.8 Ų | 80.8 | 44% | 0.439 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64.3 | -45 | 175.3 | -71.5 | 173.5 | -19.1 | 0 | 0 | 111.8 | I68 R69 N70 E74 L75 M76 L127 | I68-Q72 WeakPolarHBondContact O-CG 3.35Å; I68-Q72 PolarHBondContact O-N 2.95Å; R69-Q72 WeakPolarHBondContact O-CB 3.4Å; R69-Q72 PolarHBondContact O-N 3.12Å; R69-Q72 VanDerWaalsContact O-N 3.12Å; N70-Q72 PolarHBondContact O-N 3.03Å; Q72-E74 VanDerWaalsContact C-N 3.33Å; Q72-E74 PolarHBondContact O-N 3.24Å; Q72-L75 WeakPolarHBondContact O-CB 3.48Å; Q72-L75 PolarHBondContact O-N 3.29Å; Q72-M76 WeakPolarHBondContact O-CG 3.06Å; Q72-M76 PolarHBondContact O-N 3.48Å; Q72-L127 HydrophobicContact CG-CD1 3.95Å; Q72-L127 HydrophobicContact CG-CD2 3.95Å |
| 73 | E | 96.8 | Very high | 93 | Very high | 55 Ų | 55 | 78.1 Ų | 78.1 | 26% | 0.257 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.7 | -38.1 | 177.5 | -66.2 | -176.1 | -171.2 | 0 | 0 | 111.9 | R69 N70 M76 R77 | R69-E73 HydrophobicContact CG-CG 4.5Å; R69-E73 IonicContact CZ-OE1 3.55Å; R69-E73 IonicContact NE-OE1 3.21Å; R69-E73 PolarHBondContact NE-OE1 2.89Å; R69-E73 IonicContact NH2-OE1 2.8Å; R69-E73 PolarHBondContact NH2-OE1 3.24Å; R69-E73 WeakPolarHBondContact O-CG 3.33Å; R69-E73 PolarHBondContact O-N 3.38Å; N70-E73 PolarHBondContact O-N 3.19Å; E73-M76 PolarHBondContact O-N 2.98Å; E73-R77 VanDerWaalsContact CB-NH1 3.26Å; E73-R77 WeakPolarHBondContact O-CG 3.43Å; E73-R77 PolarHBondContact O-N 3.35Å; E73-R77 IonicContact OE2-CZ 3.51Å; E73-R77 IonicContact OE2-NH1 2.7Å; E73-R77 IonicContact OE2-NH2 3.1Å; E73-R77 PolarHBondContact OE2-NH2 3.23Å |
| 74 | E | 95.5 | Very high | 93.6 | Very high | 82 Ų | 82 | 78.7 Ų | 78.7 | 38% | 0.383 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -65.8 | -39.6 | 175.9 | -163.3 | -177.8 | 179.4 | 0 | 0 | 112.1 | N70 Q71 Q72 M76 R77 L78 R123 | N70-E74 WeakPolarHBondContact O-CB 3.47Å; N70-E74 PolarHBondContact O-N 3.18Å; Q71-E74 PolarHBondContact O-N 3Å; Q72-E74 VanDerWaalsContact C-N 3.33Å; Q72-E74 PolarHBondContact O-N 3.24Å; E74-M76 VanDerWaalsContact C-N 3.34Å; E74-R77 PolarHBondContact O-N 2.95Å; E74-L78 WeakPolarHBondContact O-CB 3.31Å; E74-L78 PolarHBondContact O-N 3.42Å; E74-R123 VanDerWaalsContact CD-CZ 3.46Å; E74-R123 IonicContact OE1-CZ 2.73Å; E74-R123 IonicContact OE1-NH1 2.88Å; E74-R123 PolarHBondContact OE1-NH1 3.24Å; E74-R123 IonicContact OE1-NH2 3.89Å; E74-R123 PolarHBondContact OE1-NH2 3.41Å; E74-R123 IonicContact OE2-CZ 2.9Å; E74-R123 IonicContact OE2-NH1 2.91Å; E74-R123 PolarHBondContact OE2-NH1 2.93Å |
| 75 | L | 96.2 | Very high | 93.8 | Very high | 22 Ų | 22 | 77.9 Ų | 77.9 | 12% | 0.115 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -59.2 | -44.2 | 171.2 | -86.9 | 167.3 | 0 | 0 | 0 | 111.9 | Q71 Q72 L78 H79 L120 R123 L124 L127 | Q71-L75 PolarHBondContact O-N 3.06Å; Q72-L75 WeakPolarHBondContact O-CB 3.48Å; Q72-L75 PolarHBondContact O-N 3.29Å; L75-L78 PolarHBondContact O-N 3.31Å; L75-H79 PolarHBondContact O-N 3.03Å; L75-L120 HydrophobicContact CD2-CD2 4.49Å; L75-R123 HydrophobicContact CD2-CB 3.42Å; L75-R123 VanDerWaalsContact CD2-CB 3.42Å; L75-R123 HydrophobicContact CD2-CG 4.39Å; L75-R123 HydrophobicContact CG-CB 4.03Å; L75-L124 HydrophobicContact CD1-CD2 4.08Å; L75-L124 HydrophobicContact CD2-CD2 4.47Å; L75-L124 HydrophobicContact CD2-CG 4.41Å; L75-L127 HydrophobicContact CD1-CB 4.22Å; L75-L127 HydrophobicContact CD1-CD2 3.55Å; L75-L127 HydrophobicContact CD1-CG 4.49Å |
| 76 | M | 94.2 | Very high | 93.8 | Very high | 103 Ų | 103 | 76.1 Ų | 76.1 | 51% | 0.507 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 176.6 | -71.6 | -56.5 | -57.3 | 0 | 0 | 112 | Q72 E73 E74 L78 H79 F80 | Q72-M76 WeakPolarHBondContact O-CG 3.06Å; Q72-M76 PolarHBondContact O-N 3.48Å; E73-M76 PolarHBondContact O-N 2.98Å; E74-M76 VanDerWaalsContact C-N 3.34Å; M76-L78 VanDerWaalsContact C-N 3.34Å; M76-L78 PolarHBondContact O-N 3.49Å; M76-H79 WeakPolarHBondContact O-CB 3.45Å; M76-H79 PolarHBondContact O-N 3.03Å; M76-F80 HydrophobicContact CE-CE2 3.89Å; M76-F80 HydrophobicContact CE-CZ 4.03Å; M76-F80 WeakPolarHBondContact O-CD2 3.36Å; M76-F80 PolarHBondContact O-N 3.4Å |
| 77 | R | 96.6 | Very high | 93.8 | Very high | 150 Ų | 150 | 78.5 Ų | 78.5 | 57% | 0.566 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -60.6 | -44.3 | 175.2 | -70.6 | 178 | -168.9 | 100.1 | 5.2 | 111.4 | E73 E74 H79 F80 E81 | E73-R77 VanDerWaalsContact CB-NH1 3.26Å; E73-R77 WeakPolarHBondContact O-CG 3.43Å; E73-R77 PolarHBondContact O-N 3.35Å; E73-R77 IonicContact OE2-CZ 3.51Å; E73-R77 IonicContact OE2-NH1 2.7Å; E73-R77 IonicContact OE2-NH2 3.1Å; E73-R77 PolarHBondContact OE2-NH2 3.23Å; E74-R77 PolarHBondContact O-N 2.95Å; R77-H79 VanDerWaalsContact C-N 3.35Å; R77-H79 PolarHBondContact O-N 3.3Å; R77-F80 PolarHBondContact O-N 3.48Å; R77-E81 PolarHBondContact O-N 3.21Å |
| 78 | L | 96.6 | Very high | 93.7 | Very high | 20 Ų | 20 | 79 Ų | 79 | 11% | 0.105 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -60.6 | -44.8 | 176.9 | 179.5 | 67.8 | 0 | 0 | 0 | 111.2 | E74 L75 M76 F80 E81 Q82 A119 L120 R123 | E74-L78 WeakPolarHBondContact O-CB 3.31Å; E74-L78 PolarHBondContact O-N 3.42Å; L75-L78 PolarHBondContact O-N 3.31Å; M76-L78 VanDerWaalsContact C-N 3.34Å; M76-L78 PolarHBondContact O-N 3.49Å; L78-F80 PolarHBondContact O-N 3Å; L78-E81 PolarHBondContact O-N 2.89Å; L78-E81 VanDerWaalsContact O-N 3.16Å; L78-Q82 HydrophobicContact CD1-CG 3.91Å; L78-Q82 HydrophobicContact CG-CG 4.04Å; L78-Q82 WeakPolarHBondContact O-CB 3.42Å; L78-Q82 VanDerWaalsContact O-CG 3.24Å; L78-Q82 WeakPolarHBondContact O-CG 3.37Å; L78-Q82 PolarHBondContact O-N 3.36Å; L78-A119 HydrophobicContact CD2-CB 4.08Å; L78-L120 HydrophobicContact CD2-CD2 4.13Å; L78-R123 VanDerWaalsContact CD2-CD 3.48Å |
| 79 | H | 93.2 | Very high | 93.4 | Very high | 85 Ų | 85 | 79.2 Ų | 79.2 | 39% | 0.394 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -54.2 | -51.9 | 178.2 | -176.9 | -71.7 | 0 | 0 | 0 | 111.2 | L75 M76 R77 E81 Q82 D83 | L75-H79 PolarHBondContact O-N 3.03Å; M76-H79 WeakPolarHBondContact O-CB 3.45Å; M76-H79 PolarHBondContact O-N 3.03Å; R77-H79 VanDerWaalsContact C-N 3.35Å; R77-H79 PolarHBondContact O-N 3.3Å; H79-E81 VanDerWaalsContact C-N 3.33Å; H79-E81 PolarHBondContact O-N 3.46Å; H79-Q82 PolarHBondContact O-N 3.5Å; H79-D83 IonicContact CE1-OD1 3.45Å; H79-D83 IonicContact CE1-OD2 3.8Å; H79-D83 PolarHBondContact CE1-OD2 2.7Å; H79-D83 IonicContact ND1-OD2 2.67Å; H79-D83 PolarHBondContact ND1-OD2 2.97Å; H79-D83 WeakPolarHBondContact O-CB 3.46Å; H79-D83 PolarHBondContact O-N 3.32Å |
| 80 | F | 95.8 | Very high | 93 | Very high | 131 Ų | 131 | 75.4 Ų | 75.4 | 58% | 0.575 | 35% | 0.353 | S | S | * | . | H | α-helix | trans | -63.5 | -37.3 | 178.3 | -66.9 | -59.1 | 0 | 0 | 0 | 113 | M76 R77 L78 R84 | M76-F80 HydrophobicContact CE-CE2 3.89Å; M76-F80 HydrophobicContact CE-CZ 4.03Å; M76-F80 WeakPolarHBondContact O-CD2 3.36Å; M76-F80 PolarHBondContact O-N 3.4Å; R77-F80 PolarHBondContact O-N 3.48Å; L78-F80 PolarHBondContact O-N 3Å; F80-R84 WeakPolarHBondContact O-CB 3.2Å; F80-R84 PolarHBondContact O-N 2.73Å |
| 81 | E | 95.3 | Very high | 92.5 | Very high | 82 Ų | 82 | 79 Ų | 79 | 38% | 0.383 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -64.6 | -44 | 176.2 | -169.4 | -169.3 | 157.1 | 0 | 0 | 111.6 | R77 L78 H79 R84 K85 | R77-E81 PolarHBondContact O-N 3.21Å; L78-E81 PolarHBondContact O-N 2.89Å; L78-E81 VanDerWaalsContact O-N 3.16Å; H79-E81 VanDerWaalsContact C-N 3.33Å; H79-E81 PolarHBondContact O-N 3.46Å; E81-R84 PolarHBondContact O-N 2.88Å; E81-K85 WeakPolarHBondContact O-CG 3.46Å; E81-K85 PolarHBondContact O-N 3.46Å; E81-K85 WeakPolarHBondContact OE1-CE 3.38Å; E81-K85 IonicContact OE1-NZ 2.65Å; E81-K85 PolarHBondContact OE1-NZ 2.91Å |
| 82 | Q | 94.9 | Very high | 91.5 | Very high | 9 Ų | 9 | 81.1 Ų | 81.1 | 4% | 0.042 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -65.6 | -45.4 | 178.3 | -71 | 178.2 | -24.2 | 0 | 0 | 111.2 | L78 H79 R84 K85 M86 N116 L120 | L78-Q82 HydrophobicContact CD1-CG 3.91Å; L78-Q82 HydrophobicContact CG-CG 4.04Å; L78-Q82 WeakPolarHBondContact O-CB 3.42Å; L78-Q82 VanDerWaalsContact O-CG 3.24Å; L78-Q82 WeakPolarHBondContact O-CG 3.37Å; L78-Q82 PolarHBondContact O-N 3.36Å; H79-Q82 PolarHBondContact O-N 3.5Å; Q82-R84 VanDerWaalsContact C-N 3.28Å; Q82-R84 PolarHBondContact O-N 2.9Å; Q82-K85 WeakPolarHBondContact O-CB 3.47Å; Q82-K85 PolarHBondContact O-N 2.93Å; Q82-K85 VanDerWaalsContact O-N 3.13Å; Q82-M86 VanDerWaalsContact O-CG 3.32Å; Q82-M86 WeakPolarHBondContact O-CG 3.07Å; Q82-M86 PolarHBondContact O-N 2.91Å; Q82-N116 HydrophobicContact CG-CB 4.17Å; Q82-N116 PolarHBondContact NE2-O 3.04Å; Q82-L120 VanDerWaalsContact OE1-CG 3.3Å |
| 83 | D | 92.7 | Very high | 90.1 | Very high | 68 Ų | 68 | 78 Ų | 78 | 36% | 0.364 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -55.7 | -45 | 174.2 | -76.1 | -16.7 | 0 | 0 | 0 | 111.3 | H79 K85 M86 M87 | H79-D83 IonicContact CE1-OD1 3.45Å; H79-D83 IonicContact CE1-OD2 3.8Å; H79-D83 PolarHBondContact CE1-OD2 2.7Å; H79-D83 IonicContact ND1-OD2 2.67Å; H79-D83 PolarHBondContact ND1-OD2 2.97Å; H79-D83 WeakPolarHBondContact O-CB 3.46Å; H79-D83 PolarHBondContact O-N 3.32Å; D83-K85 PolarHBondContact O-N 3.25Å; D83-M86 PolarHBondContact O-N 2.84Å; D83-M87 WeakPolarHBondContact O-CG 3.02Å; D83-M87 PolarHBondContact O-N 3.21Å |
| 84 | R | 92.4 | Very high | 88.3 | Confident | 169 Ų | 169 | 79 Ų | 79 | 64% | 0.638 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -61.2 | -43.7 | 176.7 | -169.1 | -178.5 | 69.2 | 171.9 | 0.8 | 112.2 | F80 E81 Q82 M86 M87 S88 | F80-R84 WeakPolarHBondContact O-CB 3.2Å; F80-R84 PolarHBondContact O-N 2.73Å; E81-R84 PolarHBondContact O-N 2.88Å; Q82-R84 VanDerWaalsContact C-N 3.28Å; Q82-R84 PolarHBondContact O-N 2.9Å; R84-M86 VanDerWaalsContact C-N 3.35Å; R84-M87 PolarHBondContact O-N 2.95Å; R84-S88 PolarHBondContact O-N 3.5Å; R84-S88 VanDerWaalsContact O-N 3.13Å |
| 85 | K | 91 | Very high | 86.6 | Confident | 88 Ų | 88 | 80.8 Ų | 80.8 | 38% | 0.383 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -61.9 | -43.4 | 175.3 | -71.7 | 173.4 | -174.8 | 167.5 | 0 | 111.2 | E81 Q82 D83 S88 I89 T112 | E81-K85 WeakPolarHBondContact O-CG 3.46Å; E81-K85 PolarHBondContact O-N 3.46Å; E81-K85 WeakPolarHBondContact OE1-CE 3.38Å; E81-K85 IonicContact OE1-NZ 2.65Å; E81-K85 PolarHBondContact OE1-NZ 2.91Å; Q82-K85 WeakPolarHBondContact O-CB 3.47Å; Q82-K85 PolarHBondContact O-N 2.93Å; Q82-K85 VanDerWaalsContact O-N 3.13Å; D83-K85 PolarHBondContact O-N 3.25Å; K85-S88 PolarHBondContact O-N 3.43Å; K85-I89 WeakPolarHBondContact O-CG1 3.28Å; K85-I89 PolarHBondContact O-N 3.38Å; K85-I89 VanDerWaalsContact O-N 3.16Å; K85-T112 HydrophobicContact CB-CG2 4.4Å |
| 86 | M | 89.1 | Confident | 84.6 | Confident | 35 Ų | 35 | 85.3 Ų | 85.3 | 17% | 0.172 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -65 | -41.8 | 178.4 | -68 | -50 | -61.3 | 0 | 0 | 112.1 | Q82 D83 R84 S88 I89 L90 L104 T112 N116 | Q82-M86 VanDerWaalsContact O-CG 3.32Å; Q82-M86 WeakPolarHBondContact O-CG 3.07Å; Q82-M86 PolarHBondContact O-N 2.91Å; D83-M86 PolarHBondContact O-N 2.84Å; R84-M86 VanDerWaalsContact C-N 3.35Å; M86-S88 VanDerWaalsContact C-N 3.32Å; M86-S88 PolarHBondContact O-N 3.35Å; M86-I89 PolarHBondContact O-N 3.38Å; M86-I89 HydrophobicContact SD-CD1 4.28Å; M86-L90 WeakPolarHBondContact O-CD1 3.18Å; M86-L90 PolarHBondContact O-N 3.42Å; M86-L104 HydrophobicContact CE-CD2 3.18Å; M86-T112 HydrophobicContact SD-CG2 4.01Å; M86-N116 PolarHBondContact SD-ND2 3.42Å |
| 87 | M | 88 | Confident | 82.8 | Confident | 122 Ų | 122 | 85.8 Ų | 85.8 | 60% | 0.601 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -59.4 | -42.6 | 175 | -74.8 | -171 | -72.3 | 0 | 0 | 111.8 | D83 R84 I89 L90 E91 | D83-M87 WeakPolarHBondContact O-CG 3.02Å; D83-M87 PolarHBondContact O-N 3.21Å; R84-M87 PolarHBondContact O-N 2.95Å; M87-I89 VanDerWaalsContact C-N 3.32Å; M87-I89 PolarHBondContact O-N 3.34Å; M87-L90 PolarHBondContact O-N 2.85Å; M87-E91 WeakPolarHBondContact O-CB 3.44Å; M87-E91 PolarHBondContact O-N 3.42Å |
| 88 | S | 87.5 | Confident | 81 | Confident | 67 Ų | 67 | 85.8 Ų | 85.8 | 47% | 0.469 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -61 | -39.2 | 175.6 | 177.8 | 0 | 0 | 0 | 0 | 112.5 | R84 K85 M86 E91 T92 | R84-S88 PolarHBondContact O-N 3.5Å; R84-S88 VanDerWaalsContact O-N 3.13Å; K85-S88 PolarHBondContact O-N 3.43Å; M86-S88 VanDerWaalsContact C-N 3.32Å; M86-S88 PolarHBondContact O-N 3.35Å; S88-E91 PolarHBondContact O-N 3.27Å; S88-T92 WeakPolarHBondContact O-CG2 3.48Å; S88-T92 PolarHBondContact O-N 3.16Å; S88-T92 VanDerWaalsContact O-N 3.07Å; S88-T92 PolarHBondContact O-OG1 3.42Å |
| 89 | I | 86.4 | Confident | 79.5 | Confident | 18 Ų | 18 | 94.2 Ų | 94.2 | 9% | 0.092 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -65.5 | -44.4 | 175.5 | -67.8 | 165.9 | 0 | 0 | 0 | 110.7 | K85 M86 M87 E91 T92 G93 A103 L104 T112 | K85-I89 WeakPolarHBondContact O-CG1 3.28Å; K85-I89 PolarHBondContact O-N 3.38Å; K85-I89 VanDerWaalsContact O-N 3.16Å; M86-I89 PolarHBondContact O-N 3.38Å; M86-I89 HydrophobicContact SD-CD1 4.28Å; M87-I89 VanDerWaalsContact C-N 3.32Å; M87-I89 PolarHBondContact O-N 3.34Å; I89-E91 PolarHBondContact O-N 2.85Å; I89-T92 PolarHBondContact O-OG1 3.05Å; I89-G93 PolarHBondContact O-N 2.88Å; I89-A103 HydrophobicContact CG2-CB 3.87Å; I89-A103 WeakPolarHBondContact O-CB 3.45Å; I89-L104 HydrophobicContact CG2-CD2 4.38Å; I89-T112 VanDerWaalsContact CD1-CB 3.46Å; I89-T112 HydrophobicContact CD1-CG2 3.59Å; I89-T112 VanDerWaalsContact CD1-OG1 3.22Å; I89-T112 WeakPolarHBondContact CD1-OG1 3.45Å |
| 90 | L | 86 | Confident | 78.3 | Confident | 59 Ų | 59 | 93.4 Ų | 93.4 | 31% | 0.309 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63 | -40.9 | 177.7 | -93 | 80.3 | 0 | 0 | 0 | 112.4 | M86 M87 G93 S94 P100 L104 | M86-L90 WeakPolarHBondContact O-CD1 3.18Å; M86-L90 PolarHBondContact O-N 3.42Å; M87-L90 PolarHBondContact O-N 2.85Å; L90-G93 PolarHBondContact O-N 2.91Å; L90-S94 PolarHBondContact O-N 3.34Å; L90-P100 HydrophobicContact CB-CB 4.48Å; L90-P100 HydrophobicContact CD2-CB 3.66Å; L90-P100 HydrophobicContact CG-CB 3.95Å; L90-L104 HydrophobicContact CD1-CD2 3.69Å; L90-L104 HydrophobicContact CD1-CG 4.2Å |
| 91 | E | 83.1 | Confident | 77.5 | Confident | 149 Ų | 149 | 90.9 Ų | 90.9 | 70% | 0.696 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -66.2 | -44.3 | -179.7 | -171.9 | 177.7 | 179.6 | 0 | 0 | 111.6 | M87 S88 I89 G93 S94 | M87-E91 WeakPolarHBondContact O-CB 3.44Å; M87-E91 PolarHBondContact O-N 3.42Å; S88-E91 PolarHBondContact O-N 3.27Å; I89-E91 PolarHBondContact O-N 2.85Å; E91-G93 VanDerWaalsContact C-N 3.28Å; E91-G93 PolarHBondContact O-N 3.4Å; E91-S94 WeakPolarHBondContact O-CB 3.24Å; E91-S94 PolarHBondContact O-N 3.29Å |
| 92 | T | 75.3 | Confident | 76.8 | Confident | 96 Ų | 96 | 92.9 Ų | 92.9 | 59% | 0.589 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -63.4 | -32.9 | 177.8 | 51.6 | 0 | 0 | 0 | 0 | 112.8 | S88 I89 S94 | S88-T92 WeakPolarHBondContact O-CG2 3.48Å; S88-T92 PolarHBondContact O-N 3.16Å; S88-T92 VanDerWaalsContact O-N 3.07Å; S88-T92 PolarHBondContact O-OG1 3.42Å; I89-T92 PolarHBondContact O-OG1 3.05Å; T92-S94 VanDerWaalsContact C-N 3.33Å |
| 93 | G | 64.5 | Low | 76.3 | Confident | 28 Ų | 28 | 92.6 Ų | 92.6 | 29% | 0.289 | 48% | 0.482 | S | S | . | . | G | 310 helix | trans | -80.4 | -7.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | I89 L90 E91 | I89-G93 PolarHBondContact O-N 2.88Å; L90-G93 PolarHBondContact O-N 2.91Å; E91-G93 VanDerWaalsContact C-N 3.28Å; E91-G93 PolarHBondContact O-N 3.4Å |
| 94 | S | 60.6 | Low | 75.9 | Confident | 76 Ų | 76 | 92 Ų | 92 | 53% | 0.531 | 48% | 0.479 | S | S | . | . | G | 310 helix | trans | -89.1 | -0.8 | -175.7 | -171.4 | 0 | 0 | 0 | 0 | 114.2 | L90 E91 T92 L96 | L90-S94 PolarHBondContact O-N 3.34Å; E91-S94 WeakPolarHBondContact O-CB 3.24Å; E91-S94 PolarHBondContact O-N 3.29Å; T92-S94 VanDerWaalsContact C-N 3.33Å; S94-L96 PolarHBondContact O-N 2.93Å |
| 95 | T | 58.6 | Low | 75.7 | Confident | 119 Ų | 119 | 89.1 Ų | 89.1 | 73% | 0.73 | 48% | 0.476 | S | S | * | . | G | 310 helix | trans | -68.6 | -13.1 | 179.5 | 54.3 | 0 | 0 | 0 | 0 | 113.9 | ||
| 96 | L | 55.1 | Low | 75.6 | Confident | 117 Ų | 117 | 88.1 Ų | 88.1 | 61% | 0.613 | 48% | 0.477 | S | S | * | . | S | Bend | trans | -116.5 | 136.2 | 165.4 | -78.4 | 79.9 | 0 | 0 | 0 | 107.3 | S94 R98 | S94-L96 PolarHBondContact O-N 2.93Å; L96-R98 PolarHBondContact O-N 3.42Å |
| 97 | A | 57 | Low | 75.7 | Confident | 114 Ų | 114 | 91 Ų | 91 | 94% | 0.942 | 49% | 0.493 | S | S | * | . | S | Bend | trans | -57.3 | 47.3 | -178.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 98 | R | 58 | Low | 75.8 | Confident | 150 Ų | 150 | 90.6 Ų | 90.6 | 57% | 0.566 | 49% | 0.49 | S | S | * | . | S | Bend | trans | -136.7 | 106.8 | -170.6 | -84.3 | 171.3 | 157.8 | -166.2 | 4.6 | 108.3 | L96 R102 | L96-R98 PolarHBondContact O-N 3.42Å; R98-R102 VanDerWaalsContact CD-NH1 3.3Å; R98-R102 VanDerWaalsContact NH1-NH1 3.11Å |
| 99 | R | 65.1 | Low | 76 | Confident | 197 Ų | 197 | 87.4 Ų | 87.4 | 74% | 0.743 | 47% | 0.467 | S | S | * | . | trans | 9.2 | 122.3 | 171.7 | -76.4 | 167.6 | 85.7 | 152.2 | 0.8 | 115.7 | V101 R102 | R99-V101 PolarHBondContact O-N 3Å; R99-R102 PolarHBondContact O-N 3.42Å | ||
| 100 | P | 68.7 | Low | 76.3 | Confident | 67 Ų | 67 | 94 Ų | 94 | 44% | 0.435 | 49% | 0.491 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.4 | -26.2 | -179.2 | 21.3 | -33.2 | 0 | 0 | 0 | 113.8 | L90 R102 A103 | L90-P100 HydrophobicContact CB-CB 4.48Å; L90-P100 HydrophobicContact CD2-CB 3.66Å; L90-P100 HydrophobicContact CG-CB 3.95Å; P100-R102 PolarHBondContact O-N 3.32Å; P100-R102 VanDerWaalsContact O-N 3.13Å; P100-A103 WeakPolarHBondContact O-CB 3.41Å; P100-A103 PolarHBondContact O-N 2.9Å; P100-A103 VanDerWaalsContact O-N 3.13Å |
| 101 | V | 78 | Confident | 76.7 | Confident | 78 Ų | 78 | 96.8 Ų | 96.8 | 47% | 0.473 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -54.8 | -27.9 | 173.7 | -175.3 | 0 | 0 | 0 | 0 | 113.4 | R99 A103 L104 L105 | R99-V101 PolarHBondContact O-N 3Å; V101-A103 VanDerWaalsContact C-N 3.28Å; V101-A103 PolarHBondContact O-N 3.34Å; V101-L104 WeakPolarHBondContact O-CB 3.17Å; V101-L104 PolarHBondContact O-N 2.67Å; V101-L104 VanDerWaalsContact O-N 3.15Å; V101-L105 PolarHBondContact O-N 3.04Å |
| 102 | R | 81.7 | Confident | 77.2 | Confident | 125 Ų | 125 | 90.5 Ų | 90.5 | 47% | 0.472 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.3 | -31.8 | 179.1 | -69.6 | -164.7 | -179.7 | -158.8 | -0.8 | 112.9 | R98 R99 P100 L104 L105 T106 | R98-R102 VanDerWaalsContact CD-NH1 3.3Å; R98-R102 VanDerWaalsContact NH1-NH1 3.11Å; R99-R102 PolarHBondContact O-N 3.42Å; P100-R102 PolarHBondContact O-N 3.32Å; P100-R102 VanDerWaalsContact O-N 3.13Å; R102-L104 PolarHBondContact O-N 3.43Å; R102-L105 WeakPolarHBondContact O-CB 3.5Å; R102-L105 PolarHBondContact O-N 3.13Å; R102-L105 VanDerWaalsContact O-N 3.08Å; R102-T106 PolarHBondContact O-N 2.9Å |
| 103 | A | 82.7 | Confident | 78 | Confident | 3 Ų | 3 | 88.2 Ų | 88.2 | 3% | 0.025 | 46% | 0.458 | C | S | . | . | H | α-helix | trans | -60.3 | -37.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | I89 P100 V101 L105 T106 | I89-A103 HydrophobicContact CG2-CB 3.87Å; I89-A103 WeakPolarHBondContact O-CB 3.45Å; P100-A103 WeakPolarHBondContact O-CB 3.41Å; P100-A103 PolarHBondContact O-N 2.9Å; P100-A103 VanDerWaalsContact O-N 3.13Å; V101-A103 VanDerWaalsContact C-N 3.28Å; V101-A103 PolarHBondContact O-N 3.34Å; A103-L105 PolarHBondContact O-N 3.43Å; A103-T106 WeakPolarHBondContact O-CB 3.38Å; A103-T106 WeakPolarHBondContact O-CG2 2.97Å; A103-T106 PolarHBondContact O-N 3.21Å; A103-T106 PolarHBondContact O-OG1 3.4Å |
| 104 | L | 85.7 | Confident | 79.5 | Confident | 54 Ų | 54 | 93.3 Ų | 93.3 | 28% | 0.283 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -69.5 | -19.5 | 177.8 | -54.7 | -178.1 | 0 | 0 | 0 | 113.5 | M86 I89 L90 V101 R102 R110 | M86-L104 HydrophobicContact CE-CD2 3.18Å; I89-L104 HydrophobicContact CG2-CD2 4.38Å; L90-L104 HydrophobicContact CD1-CD2 3.69Å; L90-L104 HydrophobicContact CD1-CG 4.2Å; V101-L104 WeakPolarHBondContact O-CB 3.17Å; V101-L104 PolarHBondContact O-N 2.67Å; V101-L104 VanDerWaalsContact O-N 3.15Å; R102-L104 PolarHBondContact O-N 3.43Å; L104-R110 WeakPolarHBondContact O-CG 3.43Å |
| 105 | L | 87.3 | Confident | 81.2 | Confident | 110 Ų | 110 | 92.2 Ų | 92.2 | 58% | 0.576 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -87.9 | -10.9 | 177 | -60.2 | 177.9 | 0 | 0 | 0 | 112.8 | V101 R102 A103 R110 | V101-L105 PolarHBondContact O-N 3.04Å; R102-L105 WeakPolarHBondContact O-CB 3.5Å; R102-L105 PolarHBondContact O-N 3.13Å; R102-L105 VanDerWaalsContact O-N 3.08Å; A103-L105 PolarHBondContact O-N 3.43Å; L105-R110 VanDerWaalsContact O-CZ 3.3Å; L105-R110 PolarHBondContact O-NE 2.84Å; L105-R110 VanDerWaalsContact O-NE 3.09Å; L105-R110 PolarHBondContact O-NH2 3.13Å |
| 106 | T | 89 | Confident | 83 | Confident | 66 Ų | 66 | 87.4 Ų | 87.4 | 41% | 0.405 | 44% | 0.438 | S | S | . | . | S | Bend | trans | -61.8 | 158.3 | 170.1 | 68.2 | 0 | 0 | 0 | 0 | 110 | R102 A103 E108 G109 R110 | R102-T106 PolarHBondContact O-N 2.9Å; A103-T106 WeakPolarHBondContact O-CB 3.38Å; A103-T106 WeakPolarHBondContact O-CG2 2.97Å; A103-T106 PolarHBondContact O-N 3.21Å; A103-T106 PolarHBondContact O-OG1 3.4Å; T106-E108 PolarHBondContact O-N 3.18Å; T106-G109 PolarHBondContact O-N 2.96Å; T106-G109 PolarHBondContact OG1-N 3.24Å; T106-R110 WeakPolarHBondContact O-CG 3.29Å; T106-R110 PolarHBondContact O-N 2.86Å |
| 107 | D | 91 | Very high | 84.9 | Confident | 97 Ų | 97 | 86.1 Ų | 86.1 | 52% | 0.519 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59 | -39.9 | 174.4 | -175.9 | 58.5 | 0 | 0 | 0 | 110.8 | R110 K111 | D107-R110 PolarHBondContact O-N 3.47Å; D107-K111 WeakPolarHBondContact O-CB 3.36Å; D107-K111 VanDerWaalsContact O-CG 3.31Å; D107-K111 WeakPolarHBondContact O-CG 3.46Å; D107-K111 PolarHBondContact O-N 3Å; D107-K111 WeakPolarHBondContact OD2-CE 3.32Å; D107-K111 IonicContact OD2-NZ 2.9Å; D107-K111 PolarHBondContact OD2-NZ 2.98Å |
| 108 | E | 90.2 | Very high | 86.8 | Confident | 113 Ų | 113 | 84.6 Ų | 84.6 | 53% | 0.528 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62 | -52.6 | 175.6 | -171.4 | 56.4 | -147.9 | 0 | 0 | 111.7 | T106 R110 K111 T112 | T106-E108 PolarHBondContact O-N 3.18Å; E108-R110 PolarHBondContact O-N 3.49Å; E108-K111 PolarHBondContact O-N 3.41Å; E108-K111 VanDerWaalsContact O-N 3.08Å; E108-T112 PolarHBondContact O-N 2.9Å; E108-T112 PolarHBondContact O-OG1 3.46Å; E108-T112 PolarHBondContact OE1-OG1 3.17Å |
| 109 | G | 91.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 79.2 Ų | 79.2 | 0% | 0 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -56.5 | -38.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | T106 T113 | T106-G109 PolarHBondContact O-N 2.96Å; T106-G109 PolarHBondContact OG1-N 3.24Å; G109-T113 VanDerWaalsContact O-CB 3.29Å; G109-T113 WeakPolarHBondContact O-CB 3.48Å; G109-T113 PolarHBondContact O-N 2.88Å; G109-T113 PolarHBondContact O-OG1 3.29Å |
| 110 | R | 93 | Very high | 90.1 | Very high | 155 Ų | 155 | 72.2 Ų | 72.2 | 59% | 0.585 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -68.1 | -45.3 | 175 | -76.6 | -173.5 | -96.6 | -169.2 | -6.5 | 112.4 | L104 L105 T106 D107 E108 T113 K114 | L104-R110 WeakPolarHBondContact O-CG 3.43Å; L105-R110 VanDerWaalsContact O-CZ 3.3Å; L105-R110 PolarHBondContact O-NE 2.84Å; L105-R110 VanDerWaalsContact O-NE 3.09Å; L105-R110 PolarHBondContact O-NH2 3.13Å; T106-R110 WeakPolarHBondContact O-CG 3.29Å; T106-R110 PolarHBondContact O-N 2.86Å; D107-R110 PolarHBondContact O-N 3.47Å; E108-R110 PolarHBondContact O-N 3.49Å; R110-T113 PolarHBondContact O-N 3.22Å; R110-K114 VanDerWaalsContact O-CB 3.3Å; R110-K114 WeakPolarHBondContact O-CB 3.35Å; R110-K114 PolarHBondContact O-N 3.31Å |
| 111 | K | 94.7 | Very high | 91.5 | Very high | 119 Ų | 119 | 72.2 Ų | 72.2 | 52% | 0.517 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -61.1 | -47 | 177 | -77.9 | 171.3 | 174 | 168.9 | 0 | 111.7 | D107 E108 K114 A115 | D107-K111 WeakPolarHBondContact O-CB 3.36Å; D107-K111 VanDerWaalsContact O-CG 3.31Å; D107-K111 WeakPolarHBondContact O-CG 3.46Å; D107-K111 PolarHBondContact O-N 3Å; D107-K111 WeakPolarHBondContact OD2-CE 3.32Å; D107-K111 IonicContact OD2-NZ 2.9Å; D107-K111 PolarHBondContact OD2-NZ 2.98Å; E108-K111 PolarHBondContact O-N 3.41Å; E108-K111 VanDerWaalsContact O-N 3.08Å; K111-K114 PolarHBondContact O-N 2.94Å; K111-A115 WeakPolarHBondContact O-CB 3.34Å; K111-A115 PolarHBondContact O-N 3.05Å |
| 112 | T | 93.3 | Very high | 92.4 | Very high | 17 Ų | 17 | 72.5 Ų | 72.5 | 10% | 0.104 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -64.1 | -46.6 | 178.1 | -46.9 | 0 | 0 | 0 | 0 | 111.6 | K85 M86 I89 E108 K114 A115 N116 | K85-T112 HydrophobicContact CB-CG2 4.4Å; M86-T112 HydrophobicContact SD-CG2 4.01Å; I89-T112 VanDerWaalsContact CD1-CB 3.46Å; I89-T112 HydrophobicContact CD1-CG2 3.59Å; I89-T112 VanDerWaalsContact CD1-OG1 3.22Å; I89-T112 WeakPolarHBondContact CD1-OG1 3.45Å; E108-T112 PolarHBondContact O-N 2.9Å; E108-T112 PolarHBondContact O-OG1 3.46Å; E108-T112 PolarHBondContact OE1-OG1 3.17Å; T112-K114 VanDerWaalsContact C-N 3.31Å; T112-K114 PolarHBondContact O-N 3.13Å; T112-A115 PolarHBondContact O-N 3.4Å; T112-N116 WeakPolarHBondContact O-CB 3.31Å; T112-N116 PolarHBondContact O-N 3.19Å; T112-N116 PolarHBondContact O-OD1 3.22Å |
| 113 | T | 93 | Very high | 93.1 | Very high | 47 Ų | 47 | 70.3 Ų | 70.3 | 29% | 0.288 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -59.5 | -44.5 | 178.5 | -58 | 0 | 0 | 0 | 0 | 111 | G109 R110 N116 I117 | G109-T113 VanDerWaalsContact O-CB 3.29Å; G109-T113 WeakPolarHBondContact O-CB 3.48Å; G109-T113 PolarHBondContact O-N 2.88Å; G109-T113 PolarHBondContact O-OG1 3.29Å; R110-T113 PolarHBondContact O-N 3.22Å; T113-N116 PolarHBondContact O-N 2.88Å; T113-I117 HydrophobicContact CG2-CD1 3.96Å; T113-I117 WeakPolarHBondContact O-CG1 3.42Å; T113-I117 PolarHBondContact O-N 3.07Å |
| 114 | K | 95.8 | Very high | 93.7 | Very high | 135 Ų | 135 | 74.8 Ų | 74.8 | 59% | 0.587 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -60.7 | -51.8 | 176.4 | 175.7 | 168.4 | 177.9 | 155.6 | 0 | 111.7 | R110 K111 T112 N116 I117 D118 | R110-K114 VanDerWaalsContact O-CB 3.3Å; R110-K114 WeakPolarHBondContact O-CB 3.35Å; R110-K114 PolarHBondContact O-N 3.31Å; K111-K114 PolarHBondContact O-N 2.94Å; T112-K114 VanDerWaalsContact C-N 3.31Å; T112-K114 PolarHBondContact O-N 3.13Å; K114-N116 PolarHBondContact O-N 3.21Å; K114-I117 PolarHBondContact O-N 3.47Å; K114-D118 WeakPolarHBondContact CG-OD2 3.5Å; K114-D118 WeakPolarHBondContact O-CB 3.3Å; K114-D118 VanDerWaalsContact O-CG 3.27Å; K114-D118 PolarHBondContact O-N 2.89Å |
| 115 | A | 95.8 | Very high | 94.2 | Very high | 54 Ų | 54 | 78 Ų | 78 | 45% | 0.446 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -58.9 | -36.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | K111 T112 A119 | K111-A115 WeakPolarHBondContact O-CB 3.34Å; K111-A115 PolarHBondContact O-N 3.05Å; T112-A115 PolarHBondContact O-N 3.4Å; A115-A119 WeakPolarHBondContact O-CB 3.17Å; A115-A119 PolarHBondContact O-N 3.33Å |
| 116 | N | 95.3 | Very high | 94.6 | Very high | 17 Ų | 17 | 75.5 Ų | 75.5 | 9% | 0.091 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -65.2 | -48.2 | 176.7 | -71.5 | -6 | 0 | 0 | 0 | 111.7 | Q82 M86 T112 T113 K114 A119 L120 | Q82-N116 HydrophobicContact CG-CB 4.17Å; Q82-N116 PolarHBondContact NE2-O 3.04Å; M86-N116 PolarHBondContact SD-ND2 3.42Å; T112-N116 WeakPolarHBondContact O-CB 3.31Å; T112-N116 PolarHBondContact O-N 3.19Å; T112-N116 PolarHBondContact O-OD1 3.22Å; T113-N116 PolarHBondContact O-N 2.88Å; K114-N116 PolarHBondContact O-N 3.21Å; N116-A119 PolarHBondContact O-N 3.25Å; N116-L120 WeakPolarHBondContact O-CB 3.48Å; N116-L120 VanDerWaalsContact O-CG 3.3Å; N116-L120 WeakPolarHBondContact O-CG 3.48Å; N116-L120 PolarHBondContact O-N 3.33Å |
| 117 | I | 95.9 | Very high | 94.9 | Very high | 91 Ų | 91 | 73.3 Ų | 73.3 | 47% | 0.467 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.2 | -47.5 | 177.5 | -68.3 | 167.6 | 0 | 0 | 0 | 110.4 | T113 K114 A119 L120 V121 | T113-I117 HydrophobicContact CG2-CD1 3.96Å; T113-I117 WeakPolarHBondContact O-CG1 3.42Å; T113-I117 PolarHBondContact O-N 3.07Å; K114-I117 PolarHBondContact O-N 3.47Å; I117-A119 VanDerWaalsContact C-N 3.33Å; I117-A119 PolarHBondContact O-N 3.46Å; I117-L120 PolarHBondContact O-N 3.01Å; I117-V121 HydrophobicContact CG2-CG2 4.2Å; I117-V121 WeakPolarHBondContact O-CG2 3.35Å; I117-V121 PolarHBondContact O-N 3.01Å |
| 118 | D | 97.4 | Very high | 95.1 | Very high | 82 Ų | 82 | 72.4 Ų | 72.4 | 44% | 0.439 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -57.4 | -47.4 | 179.8 | -68.9 | -20.4 | 0 | 0 | 0 | 110.5 | K114 L120 V121 T122 | K114-D118 WeakPolarHBondContact CG-OD2 3.5Å; K114-D118 WeakPolarHBondContact O-CB 3.3Å; K114-D118 VanDerWaalsContact O-CG 3.27Å; K114-D118 PolarHBondContact O-N 2.89Å; D118-L120 PolarHBondContact O-N 3.49Å; D118-V121 PolarHBondContact O-N 3.18Å; D118-T122 PolarHBondContact O-N 3.33Å; D118-T122 PolarHBondContact O-OG1 3.16Å; D118-T122 VanDerWaalsContact O-OG1 3.1Å |
| 119 | A | 96.9 | Very high | 95.3 | Very high | 36 Ų | 36 | 74.3 Ų | 74.3 | 30% | 0.298 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -63.7 | -40.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | L78 A115 N116 I117 R123 | L78-A119 HydrophobicContact CD2-CB 4.08Å; A115-A119 WeakPolarHBondContact O-CB 3.17Å; A115-A119 PolarHBondContact O-N 3.33Å; N116-A119 PolarHBondContact O-N 3.25Å; I117-A119 VanDerWaalsContact C-N 3.33Å; I117-A119 PolarHBondContact O-N 3.46Å; A119-R123 WeakPolarHBondContact O-CG 3.18Å; A119-R123 PolarHBondContact O-N 2.7Å |
| 120 | L | 96 | Very high | 95.2 | Very high | 50 Ų | 50 | 75.2 Ų | 75.2 | 26% | 0.262 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.4 | -47.2 | 177.1 | -75.3 | 169.6 | 0 | 0 | 0 | 111.2 | L75 L78 Q82 N116 I117 D118 R123 L124 | L75-L120 HydrophobicContact CD2-CD2 4.49Å; L78-L120 HydrophobicContact CD2-CD2 4.13Å; Q82-L120 VanDerWaalsContact OE1-CG 3.3Å; N116-L120 WeakPolarHBondContact O-CB 3.48Å; N116-L120 VanDerWaalsContact O-CG 3.3Å; N116-L120 WeakPolarHBondContact O-CG 3.48Å; N116-L120 PolarHBondContact O-N 3.33Å; I117-L120 PolarHBondContact O-N 3.01Å; D118-L120 PolarHBondContact O-N 3.49Å; L120-R123 PolarHBondContact O-N 3.03Å; L120-L124 WeakPolarHBondContact O-CB 3.33Å; L120-L124 VanDerWaalsContact O-CG 3.29Å; L120-L124 WeakPolarHBondContact O-CG 3.33Å; L120-L124 PolarHBondContact O-N 3.3Å |
| 121 | V | 96.8 | Very high | 95.1 | Very high | 67 Ų | 67 | 70.7 Ų | 70.7 | 41% | 0.406 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -59.4 | -50.6 | 179.6 | 170.6 | 0 | 0 | 0 | 0 | 110.4 | I117 D118 R123 L124 E125 | I117-V121 HydrophobicContact CG2-CG2 4.2Å; I117-V121 WeakPolarHBondContact O-CG2 3.35Å; I117-V121 PolarHBondContact O-N 3.01Å; D118-V121 PolarHBondContact O-N 3.18Å; V121-R123 VanDerWaalsContact C-N 3.3Å; V121-R123 PolarHBondContact O-N 3.03Å; V121-L124 PolarHBondContact O-N 3.27Å; V121-E125 HydrophobicContact CG1-CG 4.35Å; V121-E125 WeakPolarHBondContact O-CB 3.35Å; V121-E125 VanDerWaalsContact O-CG 3.31Å; V121-E125 WeakPolarHBondContact O-CG 3.4Å; V121-E125 PolarHBondContact O-N 2.92Å |
| 122 | T | 97 | Very high | 94.8 | Very high | 84 Ų | 84 | 69.2 Ų | 69.2 | 52% | 0.515 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -58.1 | -40.9 | 179.3 | -60.6 | 0 | 0 | 0 | 0 | 112.8 | D118 S126 | D118-T122 PolarHBondContact O-N 3.33Å; D118-T122 PolarHBondContact O-OG1 3.16Å; D118-T122 VanDerWaalsContact O-OG1 3.1Å; T122-S126 PolarHBondContact O-N 2.89Å; T122-S126 VanDerWaalsContact O-N 3.13Å; T122-S126 PolarHBondContact O-OG 3.39Å |
| 123 | R | 95.7 | Very high | 94.4 | Very high | 79 Ų | 79 | 71.2 Ų | 71.2 | 30% | 0.298 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -72.8 | -39.1 | 178.9 | -71.8 | -175.2 | -179.3 | -77.4 | 11 | 112.6 | E74 L75 L78 A119 L120 V121 E125 S126 L127 | E74-R123 VanDerWaalsContact CD-CZ 3.46Å; E74-R123 IonicContact OE1-CZ 2.73Å; E74-R123 IonicContact OE1-NH1 2.88Å; E74-R123 PolarHBondContact OE1-NH1 3.24Å; E74-R123 IonicContact OE1-NH2 3.89Å; E74-R123 PolarHBondContact OE1-NH2 3.41Å; E74-R123 IonicContact OE2-CZ 2.9Å; E74-R123 IonicContact OE2-NH1 2.91Å; E74-R123 PolarHBondContact OE2-NH1 2.93Å; L75-R123 HydrophobicContact CD2-CB 3.42Å; L75-R123 VanDerWaalsContact CD2-CB 3.42Å; L75-R123 HydrophobicContact CD2-CG 4.39Å; L75-R123 HydrophobicContact CG-CB 4.03Å; L78-R123 VanDerWaalsContact CD2-CD 3.48Å; A119-R123 WeakPolarHBondContact O-CG 3.18Å; A119-R123 PolarHBondContact O-N 2.7Å; L120-R123 PolarHBondContact O-N 3.03Å; V121-R123 VanDerWaalsContact C-N 3.3Å; V121-R123 PolarHBondContact O-N 3.03Å; R123-E125 VanDerWaalsContact C-N 3.35Å; R123-S126 PolarHBondContact O-N 3.43Å; R123-L127 WeakPolarHBondContact O-CB 3.22Å; R123-L127 PolarHBondContact O-N 2.87Å |
| 124 | L | 96.7 | Very high | 93.9 | Very high | 97 Ų | 97 | 70.3 Ų | 70.3 | 51% | 0.508 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -64.7 | -39.5 | 175.3 | -75.3 | 171.9 | 0 | 0 | 0 | 111.6 | L75 L120 V121 S126 L127 S128 | L75-L124 HydrophobicContact CD1-CD2 4.08Å; L75-L124 HydrophobicContact CD2-CD2 4.47Å; L75-L124 HydrophobicContact CD2-CG 4.41Å; L120-L124 WeakPolarHBondContact O-CB 3.33Å; L120-L124 VanDerWaalsContact O-CG 3.29Å; L120-L124 WeakPolarHBondContact O-CG 3.33Å; L120-L124 PolarHBondContact O-N 3.3Å; V121-L124 PolarHBondContact O-N 3.27Å; L124-S126 VanDerWaalsContact C-N 3.34Å; L124-L127 PolarHBondContact O-N 3.04Å; L124-S128 WeakPolarHBondContact O-CB 3.39Å; L124-S128 PolarHBondContact O-N 2.87Å |
| 125 | E | 96.7 | Very high | 92.7 | Very high | 123 Ų | 123 | 70.2 Ų | 70.2 | 58% | 0.575 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -60.3 | -44.6 | 173 | -74 | 172.8 | 164.7 | 0 | 0 | 111.4 | V121 R123 S128 Y129 | V121-E125 HydrophobicContact CG1-CG 4.35Å; V121-E125 WeakPolarHBondContact O-CB 3.35Å; V121-E125 VanDerWaalsContact O-CG 3.31Å; V121-E125 WeakPolarHBondContact O-CG 3.4Å; V121-E125 PolarHBondContact O-N 2.92Å; R123-E125 VanDerWaalsContact C-N 3.35Å; E125-S128 PolarHBondContact O-N 2.89Å; E125-Y129 WeakPolarHBondContact O-CB 3.5Å; E125-Y129 PolarHBondContact O-N 3.5Å |
| 126 | S | 95.2 | Very high | 91.1 | Very high | 57 Ų | 57 | 74 Ų | 74 | 40% | 0.399 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -63.6 | -44.2 | 177.8 | -60.3 | 0 | 0 | 0 | 0 | 112.4 | T122 R123 L124 Y129 A130 | T122-S126 PolarHBondContact O-N 2.89Å; T122-S126 VanDerWaalsContact O-N 3.13Å; T122-S126 PolarHBondContact O-OG 3.39Å; R123-S126 PolarHBondContact O-N 3.43Å; L124-S126 VanDerWaalsContact C-N 3.34Å; S126-Y129 PolarHBondContact O-N 3.15Å; S126-A130 PolarHBondContact O-N 3.1Å |
| 127 | L | 95.5 | Very high | 89.5 | Confident | 19 Ų | 19 | 75.1 Ų | 75.1 | 10% | 0.099 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -64.1 | -45.1 | 175.7 | 176.7 | 62.4 | 0 | 0 | 0 | 111.4 | I68 Q71 Q72 L75 R123 L124 Y129 A130 I131 | I68-L127 HydrophobicContact CG2-CD1 3.91Å; Q71-L127 HydrophobicContact CB-CD1 4.03Å; Q72-L127 HydrophobicContact CG-CD1 3.95Å; Q72-L127 HydrophobicContact CG-CD2 3.95Å; L75-L127 HydrophobicContact CD1-CB 4.22Å; L75-L127 HydrophobicContact CD1-CD2 3.55Å; L75-L127 HydrophobicContact CD1-CG 4.49Å; R123-L127 WeakPolarHBondContact O-CB 3.22Å; R123-L127 PolarHBondContact O-N 2.87Å; L124-L127 PolarHBondContact O-N 3.04Å; L127-Y129 VanDerWaalsContact C-N 3.31Å; L127-Y129 PolarHBondContact O-N 2.61Å; L127-A130 PolarHBondContact O-N 3.13Å; L127-I131 HydrophobicContact CD1-CD1 3.88Å; L127-I131 HydrophobicContact CD1-CG1 4.16Å; L127-I131 HydrophobicContact CD2-CD1 4.46Å; L127-I131 HydrophobicContact CG-CD1 3.83Å; L127-I131 HydrophobicContact CG-CG1 4.48Å; L127-I131 WeakPolarHBondContact O-CG1 3.37Å; L127-I131 PolarHBondContact O-N 3.37Å |
| 128 | S | 94.8 | Very high | 87.7 | Confident | 78 Ų | 78 | 75 Ų | 75 | 55% | 0.545 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -57.4 | -45.4 | 176.3 | -179.4 | 0 | 0 | 0 | 0 | 111.2 | L124 E125 A130 I131 H132 | L124-S128 WeakPolarHBondContact O-CB 3.39Å; L124-S128 PolarHBondContact O-N 2.87Å; E125-S128 PolarHBondContact O-N 2.89Å; S128-A130 PolarHBondContact O-N 3.13Å; S128-I131 PolarHBondContact O-N 3.46Å; S128-H132 VanDerWaalsContact O-CB 3.28Å; S128-H132 WeakPolarHBondContact O-CB 3.37Å; S128-H132 PolarHBondContact O-N 3.31Å |
| 129 | Y | 93.2 | Very high | 85.7 | Confident | 153 Ų | 153 | 80 Ų | 80 | 60% | 0.6 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -62.8 | -42.1 | 176.3 | -177.9 | -102.4 | 0 | 0 | 0 | 112.7 | E125 S126 L127 H132 N133 | E125-Y129 WeakPolarHBondContact O-CB 3.5Å; E125-Y129 PolarHBondContact O-N 3.5Å; S126-Y129 PolarHBondContact O-N 3.15Å; L127-Y129 VanDerWaalsContact C-N 3.31Å; L127-Y129 PolarHBondContact O-N 2.61Å; Y129-H132 PolarHBondContact O-N 3.2Å; Y129-N133 WeakPolarHBondContact CE1-ND2 3.46Å; Y129-N133 WeakPolarHBondContact O-CB 3.5Å; Y129-N133 PolarHBondContact O-N 2.64Å; Y129-N133 PolarHBondContact OH-ND2 3.4Å |
| 130 | A | 91.6 | Very high | 83.6 | Confident | 19 Ų | 19 | 83.6 Ų | 83.6 | 16% | 0.157 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -64 | -44.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | I68 S126 L127 S128 N133 L134 | I68-A130 HydrophobicContact CD1-CB 4.47Å; I68-A130 HydrophobicContact CG1-CB 3.82Å; S126-A130 PolarHBondContact O-N 3.1Å; L127-A130 PolarHBondContact O-N 3.13Å; S128-A130 PolarHBondContact O-N 3.13Å; A130-N133 PolarHBondContact O-N 3.22Å; A130-L134 PolarHBondContact O-N 3.03Å |
| 131 | I | 89.6 | Confident | 81.4 | Confident | 60 Ų | 60 | 93.1 Ų | 93.1 | 31% | 0.308 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.4 | -45.3 | 175.8 | -67.7 | 168.6 | 0 | 0 | 0 | 110.5 | I68 L127 S128 N133 L134 H135 | I68-I131 HydrophobicContact CD1-CG1 4.22Å; I68-I131 HydrophobicContact CG1-CG1 4.46Å; I68-I131 HydrophobicContact CG2-CG1 4.19Å; L127-I131 HydrophobicContact CD1-CD1 3.88Å; L127-I131 HydrophobicContact CD1-CG1 4.16Å; L127-I131 HydrophobicContact CD2-CD1 4.46Å; L127-I131 HydrophobicContact CG-CD1 3.83Å; L127-I131 HydrophobicContact CG-CG1 4.48Å; L127-I131 WeakPolarHBondContact O-CG1 3.37Å; L127-I131 PolarHBondContact O-N 3.37Å; S128-I131 PolarHBondContact O-N 3.46Å; I131-N133 VanDerWaalsContact C-N 3.34Å; I131-N133 PolarHBondContact O-N 3.08Å; I131-L134 VanDerWaalsContact O-CB 3.31Å; I131-L134 WeakPolarHBondContact O-CB 3.38Å; I131-L134 PolarHBondContact O-N 3.42Å; I131-H135 PolarHBondContact O-CD2 2.96Å; I131-H135 PolarHBondContact O-N 3.36Å |
| 132 | H | 87.7 | Confident | 78.8 | Confident | 89 Ų | 89 | 99 Ų | 99 | 41% | 0.412 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -54.2 | -52.7 | 174.9 | 178.2 | -85.8 | 0 | 0 | 0 | 110.2 | S128 Y129 L134 H135 Y136 | S128-H132 VanDerWaalsContact O-CB 3.28Å; S128-H132 WeakPolarHBondContact O-CB 3.37Å; S128-H132 PolarHBondContact O-N 3.31Å; Y129-H132 PolarHBondContact O-N 3.2Å; H132-L134 VanDerWaalsContact C-N 3.26Å; H132-L134 PolarHBondContact O-N 2.94Å; H132-H135 WeakPolarHBondContact O-CB 3.4Å; H132-H135 PolarHBondContact O-N 3.39Å; H132-Y136 AromaticContact CD2-CE2 3.52Å; H132-Y136 AromaticContact CE1-CD2 3.45Å; H132-Y136 VanDerWaalsContact CE1-CD2 3.45Å; H132-Y136 WeakPolarHBondContact CE1-CD2 3.31Å; H132-Y136 AromaticContact CE1-CE2 3.02Å; H132-Y136 WeakPolarHBondContact CE1-CE2 3.3Å; H132-Y136 AromaticContact CE1-CZ 3.7Å; H132-Y136 AromaticContact CG-CE2 3.74Å; H132-Y136 AromaticContact ND1-CD2 3.53Å; H132-Y136 AromaticContact ND1-CE2 3.45Å; H132-Y136 WeakPolarHBondContact ND1-CE2 3.43Å; H132-Y136 AromaticContact NE2-CD2 3.95Å; H132-Y136 AromaticContact NE2-CE2 3.07Å; H132-Y136 WeakPolarHBondContact NE2-CE2 3.47Å; H132-Y136 AromaticContact NE2-CZ 3.57Å; H132-Y136 PolarHBondContact NE2-OH 2.85Å; H132-Y136 WeakPolarHBondContact O-CD2 3.29Å; H132-Y136 PolarHBondContact O-N 3.4Å |
| 133 | N | 85.2 | Confident | 77.9 | Confident | 59 Ų | 59 | 99.8 Ų | 99.8 | 32% | 0.316 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.2 | -28.4 | -179.9 | -73.9 | -14 | 0 | 0 | 0 | 114.4 | Y129 A130 I131 H135 Y136 A137 | Y129-N133 WeakPolarHBondContact CE1-ND2 3.46Å; Y129-N133 WeakPolarHBondContact O-CB 3.5Å; Y129-N133 PolarHBondContact O-N 2.64Å; Y129-N133 PolarHBondContact OH-ND2 3.4Å; A130-N133 PolarHBondContact O-N 3.22Å; I131-N133 VanDerWaalsContact C-N 3.34Å; I131-N133 PolarHBondContact O-N 3.08Å; N133-H135 VanDerWaalsContact C-N 3.33Å; N133-Y136 PolarHBondContact O-N 3.42Å; N133-A137 WeakPolarHBondContact O-CB 3.47Å; N133-A137 PolarHBondContact O-N 3.08Å |
| 134 | L | 83.3 | Confident | 77 | Confident | 28 Ų | 28 | 100.8 Ų | 100.8 | 15% | 0.147 | 51% | 0.512 | C | S | . | . | H | α-helix | trans | -62.2 | -41.7 | 171.4 | -176.3 | 72.4 | 0 | 0 | 0 | 111.2 | P61 K64 L65 I68 A130 I131 H132 | P61-L134 HydrophobicContact CB-CD1 3.58Å; K64-L134 HydrophobicContact CB-CD1 4.07Å; L65-L134 HydrophobicContact CD2-CD1 4.11Å; L65-L134 HydrophobicContact CD2-CD2 3.53Å; L65-L134 HydrophobicContact CD2-CG 4.48Å; L65-L134 HydrophobicContact CG-CD1 4.28Å; I68-L134 HydrophobicContact CD1-CB 4Å; I68-L134 HydrophobicContact CD1-CD2 3.76Å; I68-L134 HydrophobicContact CD1-CG 4.32Å; A130-L134 PolarHBondContact O-N 3.03Å; I131-L134 VanDerWaalsContact O-CB 3.31Å; I131-L134 WeakPolarHBondContact O-CB 3.38Å; I131-L134 PolarHBondContact O-N 3.42Å; H132-L134 VanDerWaalsContact C-N 3.26Å; H132-L134 PolarHBondContact O-N 2.94Å |
| 135 | H | 71.2 | Confident | 75.9 | Confident | 133 Ų | 133 | 101.1 Ų | 101.1 | 62% | 0.616 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.6 | -37.2 | 178.1 | -75.7 | -76.8 | 0 | 0 | 0 | 113.1 | I131 H132 N133 | I131-H135 PolarHBondContact O-CD2 2.96Å; I131-H135 PolarHBondContact O-N 3.36Å; H132-H135 WeakPolarHBondContact O-CB 3.4Å; H132-H135 PolarHBondContact O-N 3.39Å; N133-H135 VanDerWaalsContact C-N 3.33Å |
| 136 | Y | 62.1 | Low | 74.7 | Confident | 132 Ų | 132 | 99.8 Ų | 99.8 | 52% | 0.518 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -78.3 | -28.3 | 179 | -69.7 | -88.9 | 0 | 0 | 0 | 113.3 | H132 N133 N138 R139 | H132-Y136 AromaticContact CD2-CE2 3.52Å; H132-Y136 AromaticContact CE1-CD2 3.45Å; H132-Y136 VanDerWaalsContact CE1-CD2 3.45Å; H132-Y136 WeakPolarHBondContact CE1-CD2 3.31Å; H132-Y136 AromaticContact CE1-CE2 3.02Å; H132-Y136 WeakPolarHBondContact CE1-CE2 3.3Å; H132-Y136 AromaticContact CE1-CZ 3.7Å; H132-Y136 AromaticContact CG-CE2 3.74Å; H132-Y136 AromaticContact ND1-CD2 3.53Å; H132-Y136 AromaticContact ND1-CE2 3.45Å; H132-Y136 WeakPolarHBondContact ND1-CE2 3.43Å; H132-Y136 AromaticContact NE2-CD2 3.95Å; H132-Y136 AromaticContact NE2-CE2 3.07Å; H132-Y136 WeakPolarHBondContact NE2-CE2 3.47Å; H132-Y136 AromaticContact NE2-CZ 3.57Å; H132-Y136 PolarHBondContact NE2-OH 2.85Å; H132-Y136 WeakPolarHBondContact O-CD2 3.29Å; H132-Y136 PolarHBondContact O-N 3.4Å; N133-Y136 PolarHBondContact O-N 3.42Å; Y136-N138 PolarHBondContact O-N 2.91Å; Y136-R139 PolarHBondContact O-N 2.81Å |
| 137 | A | 61.3 | Low | 73.4 | Confident | 42 Ų | 42 | 102.4 Ų | 102.4 | 35% | 0.347 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -65.3 | -24.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | N133 | N133-A137 WeakPolarHBondContact O-CB 3.47Å; N133-A137 PolarHBondContact O-N 3.08Å |
| 138 | N | 58.3 | Low | 71.9 | Confident | 88 Ų | 88 | 108 Ų | 108 | 47% | 0.471 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.9 | 7 | -177.7 | -70.9 | -27.8 | 0 | 0 | 0 | 113.9 | Y136 P140 | Y136-N138 PolarHBondContact O-N 2.91Å; N138-P140 WeakPolarHBondContact O-CD 3.09Å |
| 139 | R | 55.9 | Low | 70.3 | Confident | 186 Ų | 186 | 110.1 Ų | 110.1 | 70% | 0.702 | 54% | 0.542 | S | S | * | . | S | Bend | trans | -83.8 | 119.8 | 174.5 | -159.2 | -173.4 | -79.2 | -137.2 | 2.6 | 109.2 | Y136 R141 | Y136-R139 PolarHBondContact O-N 2.81Å; R139-R141 PolarHBondContact O-N 3.09Å |
| 140 | P | 52.5 | Low | 68.5 | Low | 112 Ų | 112 | 106.8 Ų | 106.8 | 73% | 0.727 | 54% | 0.538 | S | S | * | . | P | Polyproline II helix | trans | -58.7 | 133.4 | 173.3 | 23.1 | -30.7 | 0 | 0 | 0 | 109.2 | N138 S142 | N138-P140 WeakPolarHBondContact O-CD 3.09Å; P140-S142 PolarHBondContact O-N 2.65Å |
| 141 | R | 48.9 | Very low | 66.6 | Low | 251 Ų | 251 | 114.2 Ų | 114.2 | 95% | 0.947 | 57% | 0.57 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 119 | 168.1 | -68.1 | -175.8 | 176.4 | 179.7 | -0.9 | 106.7 | R139 | R139-R141 PolarHBondContact O-N 3.09Š|
| 142 | S | 43.3 | Very low | 64.5 | Low | 190 Ų | 190 | 119.1 Ų | 119.1 | 100% | 1.329 | 59% | 0.594 | S | S | * | * | trans | -61.4 | 0 | 170.7 | 63.1 | 0 | 0 | 0 | 0 | 111 | P140 | P140-S142 PolarHBondContact O-N 2.65Š|
Retrieved 142 of 142 residues in 387.8 ms
(Link to these results)