| 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 | C | 35.5 | Very low | 49.7 | Very low | 182 Ų | 182 | 122.3 Ų | 122.3 | 100% | 1.23 | 73% | 0.725 | S | S | * | * | 0 | 101.1 | 0 | -50.3 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 2 | L | 34.7 | Very low | 50.6 | Low | 171 Ų | 171 | 119.8 Ų | 119.8 | 90% | 0.895 | 71% | 0.711 | S | S | * | * | cis | -122.1 | 136.6 | -1 | -138.9 | 74.5 | 0 | 0 | 0 | 105.3 | ||||
| 3 | S | 40.2 | Very low | 51.5 | Low | 103 Ų | 103 | 116 Ų | 116 | 72% | 0.72 | 69% | 0.694 | S | S | * | * | trans | -60 | 165.6 | -172.4 | -60.6 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 4 | D | 45.6 | Very low | 51.9 | Low | 146 Ų | 146 | 119.5 Ų | 119.5 | 78% | 0.781 | 70% | 0.699 | S | S | * | * | trans | 89.1 | 64.5 | 163.4 | -63.8 | -74.2 | 0 | 0 | 0 | 118.2 | ||||
| 5 | H | 51.5 | Low | 51.9 | Low | 89 Ų | 89 | 119.1 Ų | 119.1 | 41% | 0.412 | 70% | 0.698 | S | S | . | * | trans | -116.6 | 103 | 151.6 | -85.4 | -82.4 | 0 | 0 | 0 | 109 | V7 T46 K50 | H5-V7 VanDerWaalsContact C-N 3.26Å; H5-V7 PolarHBondContact O-N 2.89Å; H5-T46 VanDerWaalsContact CE1-CB 3.46Å; H5-T46 WeakPolarHBondContact CE1-CB 3.49Å; H5-T46 WeakPolarHBondContact ND1-CG2 3.21Å; H5-K50 VanDerWaalsContact CE1-CE 3.49Å; H5-K50 WeakPolarHBondContact CE1-CE 3.34Å; H5-K50 WeakPolarHBondContact NE2-CE 3.42Å | ||
| 6 | A | 54.3 | Low | 52.1 | Low | 79 Ų | 79 | 118.6 Ų | 118.6 | 65% | 0.653 | 70% | 0.697 | S | S | * | * | trans | -65.7 | 88.4 | 167.5 | 0 | 0 | 0 | 0 | 0 | 109 | F8 | A6-F8 VanDerWaalsContact C-N 3.33Å; A6-F8 HydrophobicContact CB-CD2 4Å; A6-F8 HydrophobicContact CB-CE2 4.08Å; A6-F8 PolarHBondContact O-N 3.36Å; A6-F8 VanDerWaalsContact O-N 3.15Å | ||
| 7 | V | 54.7 | Low | 52.1 | Low | 118 Ų | 118 | 118.6 Ų | 118.6 | 72% | 0.715 | 70% | 0.698 | S | S | * | * | trans | -79.4 | 86.7 | 166.9 | -175.9 | 0 | 0 | 0 | 0 | 106.8 | H5 C9 | H5-V7 VanDerWaalsContact C-N 3.26Å; H5-V7 PolarHBondContact O-N 2.89Å; V7-C9 PolarHBondContact O-N 3.28Å; V7-C9 VanDerWaalsContact O-N 3.13Å | ||
| 8 | F | 56.1 | Low | 52.4 | Low | 147 Ų | 147 | 119.6 Ų | 119.6 | 65% | 0.645 | 70% | 0.699 | S | S | * | * | trans | -78.6 | 89.1 | 168 | -87.4 | -90.5 | 0 | 0 | 0 | 108.8 | A6 L10 R44 | A6-F8 VanDerWaalsContact C-N 3.33Å; A6-F8 HydrophobicContact CB-CD2 4Å; A6-F8 HydrophobicContact CB-CE2 4.08Å; A6-F8 PolarHBondContact O-N 3.36Å; A6-F8 VanDerWaalsContact O-N 3.15Å; F8-L10 PolarHBondContact O-N 2.73Å; F8-R44 PolarHBondContact O-NH1 3.46Å | ||
| 9 | C | 58.2 | Low | 52.3 | Low | 88 Ų | 88 | 118.7 Ų | 118.7 | 60% | 0.595 | 70% | 0.698 | S | S | * | * | trans | -77.1 | 103.3 | 159.9 | -74.8 | 0 | 0 | 0 | 0 | 107.7 | V7 S11 | V7-C9 PolarHBondContact O-N 3.28Å; V7-C9 VanDerWaalsContact O-N 3.13Å; C9-S11 PolarHBondContact O-N 3.13Å | ||
| 10 | L | 58.8 | Low | 52.2 | Low | 125 Ų | 125 | 121.7 Ų | 121.7 | 65% | 0.654 | 70% | 0.704 | S | S | * | * | trans | -79.6 | 99.8 | 161.1 | -77.9 | 108.8 | 0 | 0 | 0 | 106.9 | F8 V12 | F8-L10 PolarHBondContact O-N 2.73Å; L10-V12 HydrophobicContact CB-CG2 4.19Å; L10-V12 PolarHBondContact O-N 3.16Å; L10-V12 VanDerWaalsContact O-N 3.17Å | ||
| 11 | S | 57.5 | Low | 52.2 | Low | 97 Ų | 97 | 121.9 Ų | 121.9 | 68% | 0.678 | 70% | 0.702 | S | S | * | * | trans | -74.9 | 96.6 | 166.2 | 51.8 | 0 | 0 | 0 | 0 | 108 | C9 | C9-S11 PolarHBondContact O-N 3.13Š| ||
| 12 | V | 60.8 | Low | 52.9 | Low | 92 Ų | 92 | 122.9 Ų | 122.9 | 56% | 0.558 | 69% | 0.689 | S | S | * | * | trans | -100 | 88.3 | 170.3 | -160.8 | 0 | 0 | 0 | 0 | 107.6 | L10 E14 | L10-V12 HydrophobicContact CB-CG2 4.19Å; L10-V12 PolarHBondContact O-N 3.16Å; L10-V12 VanDerWaalsContact O-N 3.17Å; V12-E14 HydrophobicContact CG1-CB 3.89Å; V12-E14 HydrophobicContact CG1-CG 4.15Å; V12-E14 WeakPolarHBondContact CG1-OE2 3.32Å; V12-E14 PolarHBondContact O-N 3.18Å; V12-E14 VanDerWaalsContact O-N 3.13Å | ||
| 13 | C | 61.8 | Low | 53.9 | Low | 71 Ų | 71 | 119.1 Ų | 119.1 | 48% | 0.48 | 67% | 0.673 | S | S | . | * | trans | -81 | 78.3 | 166.3 | -58.4 | 0 | 0 | 0 | 0 | 106.3 | C34 | C13-C34 WeakPolarHBondContact CB-SG 3.32Å; C13-C34 WeakPolarHBondContact SG-CB 3.38Å; C13-C34 CovalentContact SG-SG 2.11Å; C13-C34 PolarHBondContact SG-SG 2.76Å | ||
| 14 | E | 57.3 | Low | 54.5 | Low | 165 Ų | 165 | 123.7 Ų | 123.7 | 77% | 0.771 | 68% | 0.68 | S | S | * | * | trans | -76.5 | -23 | -165.3 | -153.2 | 165.1 | 141.7 | 0 | 0 | 114.6 | V12 | V12-E14 HydrophobicContact CG1-CB 3.89Å; V12-E14 HydrophobicContact CG1-CG 4.15Å; V12-E14 WeakPolarHBondContact CG1-OE2 3.32Å; V12-E14 PolarHBondContact O-N 3.18Å; V12-E14 VanDerWaalsContact O-N 3.13Å | ||
| 15 | V | 52.1 | Low | 55.1 | Low | 114 Ų | 114 | 120.3 Ų | 120.3 | 69% | 0.691 | 66% | 0.661 | S | S | * | * | trans | -151.1 | 103.8 | -175.4 | -166 | 0 | 0 | 0 | 0 | 112.6 | V17 | V15-V17 HydrophobicContact CG1-CG2 3.49Å; V15-V17 VanDerWaalsContact CG1-CG2 3.49Å | ||
| 16 | V | 55.3 | Low | 55.3 | Low | 111 Ų | 111 | 123.4 Ų | 123.4 | 67% | 0.673 | 68% | 0.675 | S | S | * | * | trans | -92 | 100.1 | 163.9 | -178.2 | 0 | 0 | 0 | 0 | 108.1 | L18 | V16-L18 HydrophobicContact CG1-CB 4.41Å; V16-L18 HydrophobicContact CG1-CD1 4.06Å; V16-L18 PolarHBondContact O-N 3.35Å | ||
| 17 | V | 52.4 | Low | 55.4 | Low | 119 Ų | 119 | 123.4 Ų | 123.4 | 72% | 0.721 | 68% | 0.675 | S | S | * | * | trans | -88.8 | 85.4 | 170.9 | -166.7 | 0 | 0 | 0 | 0 | 108.4 | V15 | V15-V17 HydrophobicContact CG1-CG2 3.49Å; V15-V17 VanDerWaalsContact CG1-CG2 3.49Å | ||
| 18 | L | 56.9 | Low | 55.6 | Low | 135 Ų | 135 | 121.5 Ų | 121.5 | 71% | 0.707 | 67% | 0.672 | S | S | * | * | trans | -110.8 | 106.1 | 166.9 | -111.3 | 77.4 | 0 | 0 | 0 | 109.7 | V16 | V16-L18 HydrophobicContact CG1-CB 4.41Å; V16-L18 HydrophobicContact CG1-CD1 4.06Å; V16-L18 PolarHBondContact O-N 3.35Å | ||
| 19 | P | 49.7 | Very low | 55.5 | Low | 104 Ų | 104 | 119.3 Ų | 119.3 | 68% | 0.675 | 66% | 0.662 | S | S | * | * | trans | -76.5 | 135.8 | 163.5 | 33.5 | -28.8 | 0 | 0 | 0 | 108 | ||||
| 20 | Q | 51.1 | Low | 55.6 | Low | 177 Ų | 177 | 119.7 Ų | 119.7 | 83% | 0.827 | 66% | 0.657 | S | S | * | * | S | Bend | trans | 79.5 | 45.7 | 162.9 | -45.7 | -60.9 | -17.2 | 0 | 0 | 119.7 | ||
| 21 | L | 51.4 | Low | 55.5 | Low | 127 Ų | 127 | 121.7 Ų | 121.7 | 67% | 0.665 | 66% | 0.663 | S | S | * | * | trans | -141.9 | 89.8 | 153.1 | -141.7 | 72 | 0 | 0 | 0 | 112.1 | V23 | L21-V23 HydrophobicContact CD2-CG2 4.39Å; L21-V23 HydrophobicContact CG-CG2 4.07Å; L21-V23 PolarHBondContact O-N 3.41Å | ||
| 22 | E | 50.2 | Low | 55.6 | Low | 202 Ų | 202 | 123.2 Ų | 123.2 | 94% | 0.944 | 66% | 0.66 | S | S | * | * | trans | -66.9 | 76.4 | 166.8 | -172.2 | 175.4 | 150.9 | 0 | 0 | 109.6 | ||||
| 23 | V | 55.6 | Low | 55.3 | Low | 93 Ų | 93 | 124.6 Ų | 124.6 | 56% | 0.564 | 66% | 0.658 | S | S | * | * | trans | -135.2 | 125.6 | 168.5 | -174.5 | 0 | 0 | 0 | 0 | 107.2 | L21 I25 | L21-V23 HydrophobicContact CD2-CG2 4.39Å; L21-V23 HydrophobicContact CG-CG2 4.07Å; L21-V23 PolarHBondContact O-N 3.41Å; V23-I25 VanDerWaalsContact C-N 3.25Å; V23-I25 WeakPolarHBondContact O-CG1 3.38Å; V23-I25 PolarHBondContact O-N 3.45Å | ||
| 24 | K | 53.5 | Low | 55.3 | Low | 199 Ų | 199 | 123.1 Ų | 123.1 | 87% | 0.865 | 65% | 0.648 | S | S | * | * | trans | -51 | 84.8 | 171.5 | -79.3 | 170.6 | 169.9 | 169.6 | 0 | 110.6 | H26 | K24-H26 PolarHBondContact O-N 3.39Š| ||
| 25 | I | 58.5 | Low | 55.4 | Low | 74 Ų | 74 | 121.6 Ų | 121.6 | 38% | 0.379 | 65% | 0.65 | S | S | . | * | trans | -86.6 | 102.4 | 175.3 | -66.6 | 164.4 | 0 | 0 | 0 | 106.1 | V23 A27 K29 F33 | V23-I25 VanDerWaalsContact C-N 3.25Å; V23-I25 WeakPolarHBondContact O-CG1 3.38Å; V23-I25 PolarHBondContact O-N 3.45Å; I25-A27 PolarHBondContact O-N 2.98Å; I25-K29 HydrophobicContact CG2-CB 3.67Å; I25-K29 HydrophobicContact CG2-CG 4.37Å; I25-F33 HydrophobicContact CD1-CE2 4.14Å; I25-F33 HydrophobicContact CG2-CD2 4.38Å; I25-F33 HydrophobicContact CG2-CE2 3.9Å | ||
| 26 | H | 55.9 | Low | 55.5 | Low | 155 Ų | 155 | 124.5 Ų | 124.5 | 72% | 0.718 | 66% | 0.656 | S | S | * | * | trans | -44.3 | 136 | 170.2 | -78 | -83.1 | 0 | 0 | 0 | 110.1 | K24 A28 K29 | K24-H26 PolarHBondContact O-N 3.39Å; H26-A28 PolarHBondContact O-N 2.87Å; H26-K29 PolarHBondContact O-N 3.09Å | ||
| 27 | A | 56.8 | Low | 55.6 | Low | 79 Ų | 79 | 122.6 Ų | 122.6 | 65% | 0.653 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -49.2 | -24.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | I25 K29 I30 | I25-A27 PolarHBondContact O-N 2.98Å; A27-K29 VanDerWaalsContact C-N 3.26Å; A27-K29 PolarHBondContact O-N 2.92Å; A27-I30 HydrophobicContact CB-CD1 4.5Å; A27-I30 PolarHBondContact O-N 2.11Å |
| 28 | A | 56.9 | Low | 55.7 | Low | 78 Ų | 78 | 124.4 Ų | 124.4 | 65% | 0.645 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -63.4 | -23 | 173.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | H26 | H26-A28 PolarHBondContact O-N 2.87Š|
| 29 | K | 55 | Low | 55.6 | Low | 100 Ų | 100 | 122.7 Ų | 122.7 | 44% | 0.435 | 65% | 0.646 | S | S | . | * | G | 310 helix | trans | -98.1 | -10.2 | -178.4 | -155.9 | 168.9 | -170.5 | 166.8 | 0 | 113.3 | I25 H26 A27 E31 E32 F33 | I25-K29 HydrophobicContact CG2-CB 3.67Å; I25-K29 HydrophobicContact CG2-CG 4.37Å; H26-K29 PolarHBondContact O-N 3.09Å; A27-K29 VanDerWaalsContact C-N 3.26Å; A27-K29 PolarHBondContact O-N 2.92Å; K29-E31 PolarHBondContact O-N 3.17Å; K29-E32 VanDerWaalsContact CE-OE2 3.26Å; K29-E32 WeakPolarHBondContact CE-OE2 3.47Å; K29-E32 HydrophobicContact CG-CB 4.23Å; K29-E32 HydrophobicContact CG-CG 4.24Å; K29-E32 WeakPolarHBondContact CG-OE2 2.96Å; K29-E32 WeakPolarHBondContact O-CB 3.26Å; K29-E32 PolarHBondContact O-N 3.09Å; K29-E32 VanDerWaalsContact O-N 3.09Å; K29-F33 HydrophobicContact CB-CE2 4.25Å; K29-F33 HydrophobicContact CD-CE2 3.98Å; K29-F33 HydrophobicContact CD-CZ 4.32Å; K29-F33 HydrophobicContact CG-CD2 4.24Å; K29-F33 HydrophobicContact CG-CE2 3.62Å; K29-F33 HydrophobicContact CG-CZ 4.33Å; K29-F33 WeakPolarHBondContact O-CD2 3.34Å; K29-F33 PolarHBondContact O-N 2.82Å |
| 30 | I | 60 | Low | 55.6 | Low | 96 Ų | 96 | 124.7 Ų | 124.7 | 49% | 0.492 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -64.4 | -32.6 | 174.5 | -57.7 | 175.9 | 0 | 0 | 0 | 110.1 | A27 E32 F33 C34 | A27-I30 HydrophobicContact CB-CD1 4.5Å; A27-I30 PolarHBondContact O-N 2.11Å; I30-E32 VanDerWaalsContact C-N 3.26Å; I30-E32 PolarHBondContact O-N 3.39Å; I30-F33 PolarHBondContact O-N 3.33Å; I30-C34 PolarHBondContact O-N 2.63Å; I30-C34 VanDerWaalsContact O-N 3.16Å |
| 31 | E | 57.3 | Low | 55.3 | Low | 168 Ų | 168 | 125.3 Ų | 125.3 | 79% | 0.785 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -65.4 | -27.9 | 174.1 | -59.1 | -168.3 | 168.1 | 0 | 0 | 112.7 | K29 | K29-E31 PolarHBondContact O-N 3.17Å |
| 32 | E | 58.4 | Low | 55.5 | Low | 129 Ų | 129 | 125.3 Ų | 125.3 | 60% | 0.603 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -79.3 | -21.8 | 175.9 | -53.5 | -176.3 | -173.6 | 0 | 0 | 112.5 | K29 I30 | K29-E32 VanDerWaalsContact CE-OE2 3.26Å; K29-E32 WeakPolarHBondContact CE-OE2 3.47Å; K29-E32 HydrophobicContact CG-CB 4.23Å; K29-E32 HydrophobicContact CG-CG 4.24Å; K29-E32 WeakPolarHBondContact CG-OE2 2.96Å; K29-E32 WeakPolarHBondContact O-CB 3.26Å; K29-E32 PolarHBondContact O-N 3.09Å; K29-E32 VanDerWaalsContact O-N 3.09Å; I30-E32 VanDerWaalsContact C-N 3.26Å; I30-E32 PolarHBondContact O-N 3.39Å |
| 33 | F | 55.4 | Low | 55.9 | Low | 121 Ų | 121 | 118.8 Ų | 118.8 | 53% | 0.531 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -94.3 | -14.7 | 179.4 | -66.8 | -67 | 0 | 0 | 0 | 113.9 | I25 K29 I30 V35 | I25-F33 HydrophobicContact CD1-CE2 4.14Å; I25-F33 HydrophobicContact CG2-CD2 4.38Å; I25-F33 HydrophobicContact CG2-CE2 3.9Å; K29-F33 HydrophobicContact CB-CE2 4.25Å; K29-F33 HydrophobicContact CD-CE2 3.98Å; K29-F33 HydrophobicContact CD-CZ 4.32Å; K29-F33 HydrophobicContact CG-CD2 4.24Å; K29-F33 HydrophobicContact CG-CE2 3.62Å; K29-F33 HydrophobicContact CG-CZ 4.33Å; K29-F33 WeakPolarHBondContact O-CD2 3.34Å; K29-F33 PolarHBondContact O-N 2.82Å; I30-F33 PolarHBondContact O-N 3.33Å; F33-V35 VanDerWaalsContact O-CG2 3.32Å; F33-V35 WeakPolarHBondContact O-CG2 3.44Å; F33-V35 PolarHBondContact O-N 3Å |
| 34 | C | 62.2 | Low | 56.4 | Low | 40 Ų | 40 | 120.4 Ų | 120.4 | 27% | 0.27 | 61% | 0.611 | S | S | . | * | trans | -79.5 | 65.8 | 168.2 | -148.4 | 0 | 0 | 0 | 0 | 108.6 | C13 I30 Q36 | C13-C34 WeakPolarHBondContact CB-SG 3.32Å; C13-C34 WeakPolarHBondContact SG-CB 3.38Å; C13-C34 CovalentContact SG-SG 2.11Å; C13-C34 PolarHBondContact SG-SG 2.76Å; I30-C34 PolarHBondContact O-N 2.63Å; I30-C34 VanDerWaalsContact O-N 3.16Å; C34-Q36 PolarHBondContact O-N 2.74Å; C34-Q36 VanDerWaalsContact O-N 3.09Å | ||
| 35 | V | 59.2 | Low | 57.1 | Low | 133 Ų | 133 | 114.7 Ų | 114.7 | 81% | 0.806 | 59% | 0.59 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -3.6 | -178.6 | -129.2 | 0 | 0 | 0 | 0 | 112.8 | F33 | F33-V35 VanDerWaalsContact O-CG2 3.32Å; F33-V35 WeakPolarHBondContact O-CG2 3.44Å; F33-V35 PolarHBondContact O-N 3Å |
| 36 | Q | 53.2 | Low | 57.7 | Low | 175 Ų | 175 | 114.2 Ų | 114.2 | 82% | 0.818 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -148.6 | 72.4 | -178.9 | -145.8 | 141 | 11.7 | 0 | 0 | 110.6 | C34 E38 | C34-Q36 PolarHBondContact O-N 2.74Å; C34-Q36 VanDerWaalsContact O-N 3.09Å; Q36-E38 VanDerWaalsContact C-N 3.33Å; Q36-E38 PolarHBondContact O-N 2.81Å |
| 37 | C | 58.3 | Low | 58.8 | Low | 71 Ų | 71 | 110.7 Ų | 110.7 | 48% | 0.48 | 58% | 0.58 | S | S | . | * | trans | -64.2 | 100.5 | 158.4 | -73.4 | 0 | 0 | 0 | 0 | 107.1 | C39 | C37-C39 PolarHBondContact O-N 3.3Š| ||
| 38 | E | 54 | Low | 60 | Low | 157 Ų | 157 | 112.4 Ų | 112.4 | 73% | 0.734 | 58% | 0.578 | S | S | * | * | trans | -67.6 | 89.2 | 166.6 | -149.3 | -174.6 | 146 | 0 | 0 | 106.2 | Q36 Q40 | Q36-E38 VanDerWaalsContact C-N 3.33Å; Q36-E38 PolarHBondContact O-N 2.81Å; E38-Q40 PolarHBondContact O-N 2.8Å | ||
| 39 | C | 55.9 | Low | 61.2 | Low | 99 Ų | 99 | 113.8 Ų | 113.8 | 67% | 0.669 | 57% | 0.573 | S | S | * | * | trans | -64.6 | 78.7 | 158.1 | -73.6 | 0 | 0 | 0 | 0 | 105.6 | C37 Y41 | C37-C39 PolarHBondContact O-N 3.3Å; C39-Y41 PolarHBondContact O-N 2.63Å | ||
| 40 | Q | 49.5 | Very low | 62.5 | Low | 146 Ų | 146 | 114.3 Ų | 114.3 | 68% | 0.682 | 58% | 0.576 | S | S | * | * | trans | -46.7 | 119.2 | 160.9 | -103.1 | -86.1 | -6.5 | 0 | 0 | 104.6 | E38 Q42 | E38-Q40 PolarHBondContact O-N 2.8Å; Q40-Q42 PolarHBondContact O-N 3.36Å | ||
| 41 | Y | 45 | Very low | 63.9 | Low | 190 Ų | 190 | 113.2 Ų | 113.2 | 75% | 0.745 | 57% | 0.573 | S | S | * | * | trans | -61.1 | 80.3 | 171.8 | -170.8 | -98 | 0 | 0 | 0 | 105.9 | C39 S43 | C39-Y41 PolarHBondContact O-N 2.63Å; Y41-S43 VanDerWaalsContact CD1-CB 3.46Å; Y41-S43 VanDerWaalsContact CE1-OG 3.29Å; Y41-S43 WeakPolarHBondContact CE1-OG 3.29Å; Y41-S43 PolarHBondContact O-N 3.2Å | ||
| 42 | Q | 55.4 | Low | 65.4 | Low | 126 Ų | 126 | 107.1 Ų | 107.1 | 59% | 0.589 | 55% | 0.551 | S | S | * | * | trans | -61.4 | 93.3 | 148.5 | -109.3 | -164.8 | 36.4 | 0 | 0 | 101.9 | Q40 R44 | Q40-Q42 PolarHBondContact O-N 3.36Å; Q42-R44 HydrophobicContact CB-CG 4.47Å; Q42-R44 PolarHBondContact O-N 3.08Å; Q42-R44 VanDerWaalsContact OE1-NE 3.11Å | ||
| 43 | S | 58.2 | Low | 67.1 | Low | 65 Ų | 65 | 104.7 Ų | 104.7 | 46% | 0.455 | 55% | 0.545 | S | S | . | . | trans | -59.2 | 70.2 | 162.2 | -169.4 | 0 | 0 | 0 | 0 | 106.3 | Y41 N45 | Y41-S43 VanDerWaalsContact CD1-CB 3.46Å; Y41-S43 VanDerWaalsContact CE1-OG 3.29Å; Y41-S43 WeakPolarHBondContact CE1-OG 3.29Å; Y41-S43 PolarHBondContact O-N 3.2Å; S43-N45 PolarHBondContact O-N 3.13Å | ||
| 44 | R | 65.1 | Low | 68.9 | Low | 127 Ų | 127 | 104.3 Ų | 104.3 | 48% | 0.479 | 55% | 0.547 | S | S | . | . | trans | -69.6 | 84 | 154.9 | -73 | -166.6 | 178.2 | 111.2 | -4.5 | 102 | F8 Q42 T46 | F8-R44 PolarHBondContact O-NH1 3.46Å; Q42-R44 HydrophobicContact CB-CG 4.47Å; Q42-R44 PolarHBondContact O-N 3.08Å; Q42-R44 VanDerWaalsContact OE1-NE 3.11Å; R44-T46 WeakPolarHBondContact O-CG2 3.19Å; R44-T46 PolarHBondContact O-N 2.88Å | ||
| 45 | N | 68.5 | Low | 70.4 | Confident | 80 Ų | 80 | 107.3 Ų | 107.3 | 43% | 0.428 | 56% | 0.56 | S | S | . | * | trans | -58.6 | 99.3 | 179.4 | -170 | -4.9 | 0 | 0 | 0 | 105 | S43 T47 L48 I49 | S43-N45 PolarHBondContact O-N 3.13Å; N45-T47 PolarHBondContact O-N 3.29Å; N45-T47 VanDerWaalsContact O-N 3.09Å; N45-T47 WeakPolarHBondContact OD1-CB 3.45Å; N45-T47 PolarHBondContact OD1-N 2.74Å; N45-T47 PolarHBondContact OD1-OG1 3.15Å; N45-T47 VanDerWaalsContact OD1-OG1 3.08Å; N45-L48 HydrophobicContact CB-CB 4.01Å; N45-L48 WeakPolarHBondContact O-CA 3.33Å; N45-L48 WeakPolarHBondContact O-CB 3.42Å; N45-L48 PolarHBondContact O-N 3.4Å; N45-I49 PolarHBondContact O-N 3.09Å | ||
| 46 | T | 72.2 | Confident | 72.1 | Confident | 64 Ų | 64 | 105 Ų | 105 | 39% | 0.393 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.9 | -23.2 | -176 | 52.6 | 0 | 0 | 0 | 0 | 110.1 | H5 R44 I49 K50 | H5-T46 VanDerWaalsContact CE1-CB 3.46Å; H5-T46 WeakPolarHBondContact CE1-CB 3.49Å; H5-T46 WeakPolarHBondContact ND1-CG2 3.21Å; R44-T46 WeakPolarHBondContact O-CG2 3.19Å; R44-T46 PolarHBondContact O-N 2.88Å; T46-I49 WeakPolarHBondContact O-CG2 3.32Å; T46-K50 WeakPolarHBondContact O-CB 3.16Å; T46-K50 WeakPolarHBondContact O-CD 3.26Å; T46-K50 WeakPolarHBondContact O-CG 3.33Å; T46-K50 PolarHBondContact O-N 3.39Å; T46-K50 VanDerWaalsContact O-N 3.08Å |
| 47 | T | 77.8 | Confident | 74.1 | Confident | 81 Ų | 81 | 101.4 Ų | 101.4 | 50% | 0.497 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 168.9 | -40.5 | 0 | 0 | 0 | 0 | 112.3 | N45 K50 V51 | N45-T47 PolarHBondContact O-N 3.29Å; N45-T47 VanDerWaalsContact O-N 3.09Å; N45-T47 WeakPolarHBondContact OD1-CB 3.45Å; N45-T47 PolarHBondContact OD1-N 2.74Å; N45-T47 PolarHBondContact OD1-OG1 3.15Å; N45-T47 VanDerWaalsContact OD1-OG1 3.08Å; T47-K50 PolarHBondContact O-N 2.8Å; T47-V51 HydrophobicContact CG2-CG2 4.32Å; T47-V51 WeakPolarHBondContact O-CB 3.25Å; T47-V51 WeakPolarHBondContact O-CG2 3.24Å; T47-V51 PolarHBondContact O-N 2.82Å |
| 48 | L | 81.7 | Confident | 75.9 | Confident | 115 Ų | 115 | 100.5 Ų | 100.5 | 60% | 0.602 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -64.2 | -50 | 179.2 | -163.3 | 179.4 | 0 | 0 | 0 | 110.1 | N45 K50 V51 A52 | N45-L48 HydrophobicContact CB-CB 4.01Å; N45-L48 WeakPolarHBondContact O-CA 3.33Å; N45-L48 WeakPolarHBondContact O-CB 3.42Å; N45-L48 PolarHBondContact O-N 3.4Å; L48-K50 VanDerWaalsContact C-N 3.31Å; L48-K50 PolarHBondContact O-N 3.08Å; L48-V51 PolarHBondContact O-N 3.39Å; L48-A52 HydrophobicContact CD2-CB 4.19Å; L48-A52 VanDerWaalsContact O-CB 3.26Å; L48-A52 WeakPolarHBondContact O-CB 3.35Å; L48-A52 PolarHBondContact O-N 2.96Å |
| 49 | I | 83.2 | Confident | 77.8 | Confident | 107 Ų | 107 | 97.1 Ų | 97.1 | 55% | 0.549 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.7 | -40.8 | 178.3 | -168.1 | 164.6 | 0 | 0 | 0 | 111.4 | N45 T46 A52 V53 | N45-I49 PolarHBondContact O-N 3.09Å; T46-I49 WeakPolarHBondContact O-CG2 3.32Å; I49-A52 PolarHBondContact O-N 3.2Å; I49-V53 HydrophobicContact CG1-CG2 4.48Å; I49-V53 VanDerWaalsContact O-CG2 3.25Å; I49-V53 WeakPolarHBondContact O-CG2 3.13Å; I49-V53 PolarHBondContact O-N 2.75Å |
| 50 | K | 81.7 | Confident | 79.7 | Confident | 111 Ų | 111 | 97.2 Ų | 97.2 | 48% | 0.483 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -57.8 | -50.6 | 172.7 | -78.1 | 171.7 | -179.5 | 174.5 | 0 | 111.7 | H5 T46 T47 L48 V53 I54 | H5-K50 VanDerWaalsContact CE1-CE 3.49Å; H5-K50 WeakPolarHBondContact CE1-CE 3.34Å; H5-K50 WeakPolarHBondContact NE2-CE 3.42Å; T46-K50 WeakPolarHBondContact O-CB 3.16Å; T46-K50 WeakPolarHBondContact O-CD 3.26Å; T46-K50 WeakPolarHBondContact O-CG 3.33Å; T46-K50 PolarHBondContact O-N 3.39Å; T46-K50 VanDerWaalsContact O-N 3.08Å; T47-K50 PolarHBondContact O-N 2.8Å; L48-K50 VanDerWaalsContact C-N 3.31Å; L48-K50 PolarHBondContact O-N 3.08Å; K50-V53 PolarHBondContact O-N 3.39Å; K50-I54 WeakPolarHBondContact O-CD1 3.36Å; K50-I54 VanDerWaalsContact O-CG1 3.27Å; K50-I54 WeakPolarHBondContact O-CG1 3.46Å; K50-I54 PolarHBondContact O-N 2.87Å; K50-I54 VanDerWaalsContact O-N 3.1Å |
| 51 | V | 89 | Confident | 81.9 | Confident | 73 Ų | 73 | 93.1 Ų | 93.1 | 44% | 0.442 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.9 | -42 | 179.7 | 170.6 | 0 | 0 | 0 | 0 | 110.9 | T47 L48 I54 L55 | T47-V51 HydrophobicContact CG2-CG2 4.32Å; T47-V51 WeakPolarHBondContact O-CB 3.25Å; T47-V51 WeakPolarHBondContact O-CG2 3.24Å; T47-V51 PolarHBondContact O-N 2.82Å; L48-V51 PolarHBondContact O-N 3.39Å; V51-I54 PolarHBondContact O-N 3.21Å; V51-L55 HydrophobicContact CG1-CD1 4.11Å; V51-L55 HydrophobicContact CG1-CG 4.32Å; V51-L55 WeakPolarHBondContact O-CG 3.49Å; V51-L55 PolarHBondContact O-N 2.87Å |
| 52 | A | 90.5 | Very high | 84.3 | Confident | 39 Ų | 39 | 89.5 Ų | 89.5 | 32% | 0.322 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.4 | -45.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L48 I49 I54 L55 V56 | L48-A52 HydrophobicContact CD2-CB 4.19Å; L48-A52 VanDerWaalsContact O-CB 3.26Å; L48-A52 WeakPolarHBondContact O-CB 3.35Å; L48-A52 PolarHBondContact O-N 2.96Å; I49-A52 PolarHBondContact O-N 3.2Å; A52-I54 VanDerWaalsContact C-N 3.33Å; A52-I54 PolarHBondContact O-N 3.46Å; A52-L55 PolarHBondContact O-N 3.48Å; A52-V56 WeakPolarHBondContact O-CG2 3.46Å; A52-V56 PolarHBondContact O-N 2.7Å |
| 53 | V | 92.7 | Very high | 86.1 | Confident | 78 Ų | 78 | 88.2 Ų | 88.2 | 47% | 0.473 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.2 | -44.7 | 176 | 172.2 | 0 | 0 | 0 | 0 | 110.6 | I49 K50 L55 V56 I57 | I49-V53 HydrophobicContact CG1-CG2 4.48Å; I49-V53 VanDerWaalsContact O-CG2 3.25Å; I49-V53 WeakPolarHBondContact O-CG2 3.13Å; I49-V53 PolarHBondContact O-N 2.75Å; K50-V53 PolarHBondContact O-N 3.39Å; V53-L55 PolarHBondContact O-N 3.45Å; V53-V56 PolarHBondContact O-N 3.06Å; V53-I57 HydrophobicContact CG1-CD1 3.84Å; V53-I57 VanDerWaalsContact O-CG1 3.31Å; V53-I57 WeakPolarHBondContact O-CG1 3.27Å; V53-I57 PolarHBondContact O-N 2.96Å |
| 54 | I | 92.9 | Very high | 87.8 | Confident | 113 Ų | 113 | 89.5 Ų | 89.5 | 58% | 0.579 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.8 | -43.8 | 177 | -67.1 | 165 | 0 | 0 | 0 | 111.2 | K50 V51 A52 I57 S58 | K50-I54 WeakPolarHBondContact O-CD1 3.36Å; K50-I54 VanDerWaalsContact O-CG1 3.27Å; K50-I54 WeakPolarHBondContact O-CG1 3.46Å; K50-I54 PolarHBondContact O-N 2.87Å; K50-I54 VanDerWaalsContact O-N 3.1Å; V51-I54 PolarHBondContact O-N 3.21Å; A52-I54 VanDerWaalsContact C-N 3.33Å; A52-I54 PolarHBondContact O-N 3.46Å; I54-I57 PolarHBondContact O-N 3.26Å; I54-S58 VanDerWaalsContact O-CB 3.26Å; I54-S58 WeakPolarHBondContact O-CB 3.31Å; I54-S58 PolarHBondContact O-N 3.41Å |
| 55 | L | 94 | Very high | 89.2 | Confident | 104 Ų | 104 | 87.9 Ų | 87.9 | 55% | 0.545 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.7 | -46.7 | 178 | -75.5 | 177.6 | 0 | 0 | 0 | 111.6 | V51 A52 V53 I57 S58 T59 | V51-L55 HydrophobicContact CG1-CD1 4.11Å; V51-L55 HydrophobicContact CG1-CG 4.32Å; V51-L55 WeakPolarHBondContact O-CG 3.49Å; V51-L55 PolarHBondContact O-N 2.87Å; A52-L55 PolarHBondContact O-N 3.48Å; V53-L55 PolarHBondContact O-N 3.45Å; L55-I57 PolarHBondContact O-N 3.29Å; L55-S58 WeakPolarHBondContact O-CB 3.15Å; L55-S58 PolarHBondContact O-N 3.1Å; L55-T59 WeakPolarHBondContact O-CG2 3.26Å; L55-T59 PolarHBondContact O-N 3.46Å |
| 56 | V | 95.8 | Very high | 90.3 | Very high | 85 Ų | 85 | 90.4 Ų | 90.4 | 52% | 0.515 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.1 | -49.2 | 178.5 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | A52 V53 S58 T59 I60 | A52-V56 WeakPolarHBondContact O-CG2 3.46Å; A52-V56 PolarHBondContact O-N 2.7Å; V53-V56 PolarHBondContact O-N 3.06Å; V56-S58 VanDerWaalsContact C-N 3.32Å; V56-S58 PolarHBondContact O-N 3.24Å; V56-T59 PolarHBondContact O-N 3.4Å; V56-T59 PolarHBondContact O-OG1 3.2Å; V56-I60 HydrophobicContact CG1-CD1 4.21Å; V56-I60 WeakPolarHBondContact O-CG1 3.48Å; V56-I60 PolarHBondContact O-N 3.15Å |
| 57 | I | 95.5 | Very high | 91 | Very high | 98 Ų | 98 | 92.4 Ų | 92.4 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.1 | -45.8 | 177 | -65 | 166.5 | 0 | 0 | 0 | 110.5 | V53 I54 L55 T59 I60 S61 | V53-I57 HydrophobicContact CG1-CD1 3.84Å; V53-I57 VanDerWaalsContact O-CG1 3.31Å; V53-I57 WeakPolarHBondContact O-CG1 3.27Å; V53-I57 PolarHBondContact O-N 2.96Å; I54-I57 PolarHBondContact O-N 3.26Å; L55-I57 PolarHBondContact O-N 3.29Å; I57-T59 PolarHBondContact O-N 2.87Å; I57-I60 PolarHBondContact O-N 2.92Å; I57-S61 PolarHBondContact O-N 3Å; I57-S61 PolarHBondContact O-OG 3.43Å |
| 58 | S | 95 | Very high | 91.5 | Very high | 53 Ų | 53 | 93.9 Ų | 93.9 | 37% | 0.371 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -56.9 | -46.5 | 177.6 | -178.3 | 0 | 0 | 0 | 0 | 111.8 | I54 L55 V56 I60 S61 L62 | I54-S58 VanDerWaalsContact O-CB 3.26Å; I54-S58 WeakPolarHBondContact O-CB 3.31Å; I54-S58 PolarHBondContact O-N 3.41Å; L55-S58 WeakPolarHBondContact O-CB 3.15Å; L55-S58 PolarHBondContact O-N 3.1Å; V56-S58 VanDerWaalsContact C-N 3.32Å; V56-S58 PolarHBondContact O-N 3.24Å; S58-I60 VanDerWaalsContact C-N 3.35Å; S58-I60 PolarHBondContact O-N 3.23Å; S58-S61 PolarHBondContact O-N 3.38Å; S58-L62 WeakPolarHBondContact O-CD1 3.46Å; S58-L62 PolarHBondContact O-N 2.84Å; S58-L62 WeakPolarHBondContact OG-CD1 3.43Å |
| 59 | T | 95.1 | Very high | 91.7 | Very high | 86 Ų | 86 | 93.8 Ų | 93.8 | 53% | 0.528 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.8 | -42.9 | 178.4 | 62.6 | 0 | 0 | 0 | 0 | 112.9 | L55 V56 I57 L62 L63 | L55-T59 WeakPolarHBondContact O-CG2 3.26Å; L55-T59 PolarHBondContact O-N 3.46Å; V56-T59 PolarHBondContact O-N 3.4Å; V56-T59 PolarHBondContact O-OG1 3.2Å; I57-T59 PolarHBondContact O-N 2.87Å; T59-L62 PolarHBondContact O-N 3.44Å; T59-L63 WeakPolarHBondContact O-CB 3.04Å; T59-L63 PolarHBondContact O-N 3.24Å |
| 60 | I | 95.9 | Very high | 91.7 | Very high | 101 Ų | 101 | 91.7 Ų | 91.7 | 52% | 0.518 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -65.1 | -46.2 | 177.7 | -62.2 | 168.3 | 0 | 0 | 0 | 109.7 | V56 I57 S58 L62 L63 V64 | V56-I60 HydrophobicContact CG1-CD1 4.21Å; V56-I60 WeakPolarHBondContact O-CG1 3.48Å; V56-I60 PolarHBondContact O-N 3.15Å; I57-I60 PolarHBondContact O-N 2.92Å; S58-I60 VanDerWaalsContact C-N 3.35Å; S58-I60 PolarHBondContact O-N 3.23Å; I60-L62 PolarHBondContact O-N 3.15Å; I60-L63 PolarHBondContact O-N 3.46Å; I60-L63 VanDerWaalsContact O-N 3.15Å; I60-V64 HydrophobicContact CG2-CG2 4.44Å; I60-V64 WeakPolarHBondContact O-CG2 3.39Å; I60-V64 PolarHBondContact O-N 2.91Å |
| 61 | S | 95.3 | Very high | 91.5 | Very high | 60 Ų | 60 | 92.4 Ų | 92.4 | 42% | 0.42 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.7 | -44.4 | 177.1 | -62.6 | 0 | 0 | 0 | 0 | 112.1 | I57 S58 L63 V64 V65 | I57-S61 PolarHBondContact O-N 3Å; I57-S61 PolarHBondContact O-OG 3.43Å; S58-S61 PolarHBondContact O-N 3.38Å; S61-L63 VanDerWaalsContact C-N 3.3Å; S61-L63 PolarHBondContact O-N 2.88Å; S61-V64 PolarHBondContact O-N 2.87Å; S61-V65 WeakPolarHBondContact O-CB 3.19Å; S61-V65 VanDerWaalsContact O-CG2 3.27Å; S61-V65 WeakPolarHBondContact O-CG2 3.44Å; S61-V65 PolarHBondContact O-N 3.42Å |
| 62 | L | 93.9 | Very high | 91.2 | Very high | 113 Ų | 113 | 92.5 Ų | 92.5 | 59% | 0.592 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.5 | -40.3 | 175.1 | -92 | 83.5 | 0 | 0 | 0 | 111.5 | S58 T59 I60 V65 Y66 | S58-L62 WeakPolarHBondContact O-CD1 3.46Å; S58-L62 PolarHBondContact O-N 2.84Å; S58-L62 WeakPolarHBondContact OG-CD1 3.43Å; T59-L62 PolarHBondContact O-N 3.44Å; I60-L62 PolarHBondContact O-N 3.15Å; L62-V65 PolarHBondContact O-N 2.77Å; L62-Y66 WeakPolarHBondContact O-CB 3.39Å; L62-Y66 PolarHBondContact O-N 3.48Å |
| 63 | L | 93.6 | Very high | 90.4 | Very high | 100 Ų | 100 | 92.5 Ų | 92.5 | 52% | 0.524 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.7 | -43.4 | 178.6 | -161.4 | 162 | 0 | 0 | 0 | 111.3 | T59 I60 S61 Y66 M67 | T59-L63 WeakPolarHBondContact O-CB 3.04Å; T59-L63 PolarHBondContact O-N 3.24Å; I60-L63 PolarHBondContact O-N 3.46Å; I60-L63 VanDerWaalsContact O-N 3.15Å; S61-L63 VanDerWaalsContact C-N 3.3Å; S61-L63 PolarHBondContact O-N 2.88Å; L63-Y66 WeakPolarHBondContact O-CB 3.36Å; L63-Y66 PolarHBondContact O-N 3.34Å; L63-M67 HydrophobicContact CD2-CE 4.11Å; L63-M67 HydrophobicContact CD2-CG 4.03Å; L63-M67 WeakPolarHBondContact O-CG 3.46Å; L63-M67 PolarHBondContact O-N 3.33Å |
| 64 | V | 94.7 | Very high | 89.3 | Confident | 91 Ų | 91 | 92.7 Ų | 92.7 | 55% | 0.552 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.1 | -46.1 | 175.5 | 173.7 | 0 | 0 | 0 | 0 | 110.9 | I60 S61 Y66 M67 L68 | I60-V64 HydrophobicContact CG2-CG2 4.44Å; I60-V64 WeakPolarHBondContact O-CG2 3.39Å; I60-V64 PolarHBondContact O-N 2.91Å; S61-V64 PolarHBondContact O-N 2.87Å; V64-Y66 VanDerWaalsContact C-N 3.27Å; V64-Y66 PolarHBondContact O-N 3.35Å; V64-M67 PolarHBondContact O-N 3.36Å; V64-L68 WeakPolarHBondContact O-CB 2.99Å; V64-L68 PolarHBondContact O-N 3.26Å |
| 65 | V | 94.2 | Very high | 88.2 | Confident | 94 Ų | 94 | 90.3 Ų | 90.3 | 57% | 0.57 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.7 | -38.3 | 174.6 | 171.8 | 0 | 0 | 0 | 0 | 110.6 | S61 L62 L68 F69 | S61-V65 WeakPolarHBondContact O-CB 3.19Å; S61-V65 VanDerWaalsContact O-CG2 3.27Å; S61-V65 WeakPolarHBondContact O-CG2 3.44Å; S61-V65 PolarHBondContact O-N 3.42Å; L62-V65 PolarHBondContact O-N 2.77Å; V65-L68 PolarHBondContact O-N 3.37Å; V65-F69 WeakPolarHBondContact O-CA 3.27Å; V65-F69 WeakPolarHBondContact O-CB 3.11Å; V65-F69 PolarHBondContact O-N 2.94Å |
| 66 | Y | 91.3 | Very high | 87 | Confident | 132 Ų | 132 | 90.4 Ų | 90.4 | 52% | 0.518 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.8 | -44.6 | 175.3 | 178.1 | -99.5 | 0 | 0 | 0 | 111.5 | L62 L63 V64 F69 L70 | L62-Y66 WeakPolarHBondContact O-CB 3.39Å; L62-Y66 PolarHBondContact O-N 3.48Å; L63-Y66 WeakPolarHBondContact O-CB 3.36Å; L63-Y66 PolarHBondContact O-N 3.34Å; V64-Y66 VanDerWaalsContact C-N 3.27Å; V64-Y66 PolarHBondContact O-N 3.35Å; Y66-F69 PolarHBondContact O-N 3.21Å; Y66-L70 HydrophobicContact CD1-CD1 3.78Å; Y66-L70 HydrophobicContact CD1-CG 4.28Å; Y66-L70 HydrophobicContact CE1-CD1 3.2Å; Y66-L70 HydrophobicContact CE1-CG 3.98Å; Y66-L70 HydrophobicContact CE2-CD1 4.27Å; Y66-L70 HydrophobicContact CE2-CD2 4.48Å; Y66-L70 HydrophobicContact CE2-CG 4.26Å; Y66-L70 VanDerWaalsContact CZ-CD1 3.49Å; Y66-L70 VanDerWaalsContact O-CB 3.31Å; Y66-L70 WeakPolarHBondContact O-CB 3.31Å; Y66-L70 VanDerWaalsContact O-CG 3.27Å; Y66-L70 WeakPolarHBondContact O-CG 3.5Å; Y66-L70 PolarHBondContact O-N 3.21Å |
| 67 | M | 86.5 | Confident | 85.4 | Confident | 107 Ų | 107 | 90.1 Ų | 90.1 | 53% | 0.527 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.2 | -40.5 | 175.8 | -68.1 | -62.3 | 170.2 | 0 | 0 | 112.1 | L63 V64 L70 Q71 | L63-M67 HydrophobicContact CD2-CE 4.11Å; L63-M67 HydrophobicContact CD2-CG 4.03Å; L63-M67 WeakPolarHBondContact O-CG 3.46Å; L63-M67 PolarHBondContact O-N 3.33Å; V64-M67 PolarHBondContact O-N 3.36Å; M67-L70 PolarHBondContact O-N 3.18Å; M67-Q71 WeakPolarHBondContact O-CB 3.45Å; M67-Q71 PolarHBondContact O-N 3.21Å |
| 68 | L | 88.3 | Confident | 83.7 | Confident | 111 Ų | 111 | 90 Ų | 90 | 58% | 0.581 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -65.5 | -43.8 | 175.3 | -173.6 | 69 | 0 | 0 | 0 | 111.2 | V64 V65 Q71 C72 | V64-L68 WeakPolarHBondContact O-CB 2.99Å; V64-L68 PolarHBondContact O-N 3.26Å; V65-L68 PolarHBondContact O-N 3.37Å; L68-Q71 CarbonylContact O-C 3.42Å; L68-Q71 WeakPolarHBondContact O-CA 3.31Å; L68-Q71 PolarHBondContact O-N 3.39Å; L68-Q71 VanDerWaalsContact O-N 3.14Å; L68-C72 WeakPolarHBondContact O-CB 3.42Å; L68-C72 PolarHBondContact O-N 3.34Å; L68-C72 PolarHBondContact O-SG 3.39Å; L68-C72 VanDerWaalsContact O-SG 3.35Å |
| 69 | F | 86.7 | Confident | 82.1 | Confident | 114 Ų | 114 | 94.6 Ų | 94.6 | 50% | 0.5 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.5 | -46.3 | 176.5 | 178.9 | -111.2 | 0 | 0 | 0 | 110.6 | V65 Y66 Q71 C72 L73 | V65-F69 WeakPolarHBondContact O-CA 3.27Å; V65-F69 WeakPolarHBondContact O-CB 3.11Å; V65-F69 PolarHBondContact O-N 2.94Å; Y66-F69 PolarHBondContact O-N 3.21Å; F69-Q71 PolarHBondContact O-N 3.19Å; F69-C72 CarbonylContact O-C 3.58Å; F69-C72 PolarHBondContact O-N 3.44Å; F69-C72 VanDerWaalsContact O-N 3.13Å; F69-L73 HydrophobicContact CD1-CD1 3.62Å; F69-L73 HydrophobicContact CD1-CG 3.96Å; F69-L73 HydrophobicContact CD2-CG 4.13Å; F69-L73 HydrophobicContact CE1-CD1 3.08Å; F69-L73 HydrophobicContact CE1-CD2 4.28Å; F69-L73 HydrophobicContact CE1-CG 3.67Å; F69-L73 HydrophobicContact CE2-CD1 4.13Å; F69-L73 HydrophobicContact CE2-CD2 3.82Å; F69-L73 HydrophobicContact CE2-CG 3.82Å; F69-L73 HydrophobicContact CG-CD1 4.36Å; F69-L73 HydrophobicContact CG-CG 4.21Å; F69-L73 HydrophobicContact CZ-CD1 3.38Å; F69-L73 HydrophobicContact CZ-CD2 3.7Å; F69-L73 HydrophobicContact CZ-CG 3.59Å; F69-L73 VanDerWaalsContact O-CB 3.24Å; F69-L73 WeakPolarHBondContact O-CB 3.32Å; F69-L73 VanDerWaalsContact O-CG 3.26Å; F69-L73 WeakPolarHBondContact O-CG 2.96Å; F69-L73 PolarHBondContact O-N 2.79Å |
| 70 | L | 82.3 | Confident | 80.4 | Confident | 62 Ų | 62 | 100.9 Ų | 100.9 | 33% | 0.325 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -59.8 | -36.7 | 172 | -75.6 | -175.9 | 0 | 0 | 0 | 111.8 | Y66 M67 C72 N74 | Y66-L70 HydrophobicContact CD1-CD1 3.78Å; Y66-L70 HydrophobicContact CD1-CG 4.28Å; Y66-L70 HydrophobicContact CE1-CD1 3.2Å; Y66-L70 HydrophobicContact CE1-CG 3.98Å; Y66-L70 HydrophobicContact CE2-CD1 4.27Å; Y66-L70 HydrophobicContact CE2-CD2 4.48Å; Y66-L70 HydrophobicContact CE2-CG 4.26Å; Y66-L70 VanDerWaalsContact CZ-CD1 3.49Å; Y66-L70 VanDerWaalsContact O-CB 3.31Å; Y66-L70 WeakPolarHBondContact O-CB 3.31Å; Y66-L70 VanDerWaalsContact O-CG 3.27Å; Y66-L70 WeakPolarHBondContact O-CG 3.5Å; Y66-L70 PolarHBondContact O-N 3.21Å; M67-L70 PolarHBondContact O-N 3.18Å; L70-C72 VanDerWaalsContact C-N 3.35Å; L70-N74 VanDerWaalsContact O-CB 3.28Å; L70-N74 WeakPolarHBondContact O-CB 3.49Å; L70-N74 PolarHBondContact O-N 3.41Å |
| 71 | Q | 78.9 | Confident | 78.5 | Confident | 127 Ų | 127 | 102.9 Ų | 102.9 | 59% | 0.593 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -75.4 | -19.4 | 177 | -171.7 | 61 | 10.2 | 0 | 0 | 113.5 | M67 L68 F69 P75 | M67-Q71 WeakPolarHBondContact O-CB 3.45Å; M67-Q71 PolarHBondContact O-N 3.21Å; L68-Q71 CarbonylContact O-C 3.42Å; L68-Q71 WeakPolarHBondContact O-CA 3.31Å; L68-Q71 PolarHBondContact O-N 3.39Å; L68-Q71 VanDerWaalsContact O-N 3.14Å; F69-Q71 PolarHBondContact O-N 3.19Å; Q71-P75 WeakPolarHBondContact O-CD 3.38Å; Q71-P75 WeakPolarHBondContact O-CG 3.27Å |
| 72 | C | 81.9 | Confident | 76.7 | Confident | 74 Ų | 74 | 105.9 Ų | 105.9 | 50% | 0.5 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -90.3 | -34.8 | 170.2 | -72 | 0 | 0 | 0 | 0 | 111.6 | L68 F69 L70 P75 M76 | L68-C72 WeakPolarHBondContact O-CB 3.42Å; L68-C72 PolarHBondContact O-N 3.34Å; L68-C72 PolarHBondContact O-SG 3.39Å; L68-C72 VanDerWaalsContact O-SG 3.35Å; F69-C72 CarbonylContact O-C 3.58Å; F69-C72 PolarHBondContact O-N 3.44Å; F69-C72 VanDerWaalsContact O-N 3.13Å; L70-C72 VanDerWaalsContact C-N 3.35Å; C72-P75 VanDerWaalsContact C-CD 3.46Å; C72-P75 VanDerWaalsContact O-CD 3.23Å; C72-P75 WeakPolarHBondContact O-CD 3.44Å; C72-P75 WeakPolarHBondContact O-CG 3.19Å; C72-M76 WeakPolarHBondContact O-CB 3.34Å; C72-M76 PolarHBondContact O-N 3.22Å; C72-M76 VanDerWaalsContact O-N 3.08Å |
| 73 | L | 74.5 | Confident | 75 | Confident | 40 Ų | 40 | 102.7 Ų | 102.7 | 21% | 0.209 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -67 | -40.4 | 171.6 | -76.2 | -167.4 | 0 | 0 | 0 | 110.6 | F69 M76 L77 | F69-L73 HydrophobicContact CD1-CD1 3.62Å; F69-L73 HydrophobicContact CD1-CG 3.96Å; F69-L73 HydrophobicContact CD2-CG 4.13Å; F69-L73 HydrophobicContact CE1-CD1 3.08Å; F69-L73 HydrophobicContact CE1-CD2 4.28Å; F69-L73 HydrophobicContact CE1-CG 3.67Å; F69-L73 HydrophobicContact CE2-CD1 4.13Å; F69-L73 HydrophobicContact CE2-CD2 3.82Å; F69-L73 HydrophobicContact CE2-CG 3.82Å; F69-L73 HydrophobicContact CG-CD1 4.36Å; F69-L73 HydrophobicContact CG-CG 4.21Å; F69-L73 HydrophobicContact CZ-CD1 3.38Å; F69-L73 HydrophobicContact CZ-CD2 3.7Å; F69-L73 HydrophobicContact CZ-CG 3.59Å; F69-L73 VanDerWaalsContact O-CB 3.24Å; F69-L73 WeakPolarHBondContact O-CB 3.32Å; F69-L73 VanDerWaalsContact O-CG 3.26Å; F69-L73 WeakPolarHBondContact O-CG 2.96Å; F69-L73 PolarHBondContact O-N 2.79Å; L73-M76 HydrophobicContact CD2-CE 3.56Å; L73-M76 CarbonylContact O-C 3.57Å; L73-M76 PolarHBondContact O-N 3.48Å; L73-M76 VanDerWaalsContact O-N 3.14Å; L73-L77 HydrophobicContact CB-CD1 3.76Å; L73-L77 HydrophobicContact CD2-CD1 4.37Å; L73-L77 HydrophobicContact CG-CD1 4.48Å; L73-L77 WeakPolarHBondContact O-CB 3.34Å; L73-L77 WeakPolarHBondContact O-CD1 3.4Å; L73-L77 PolarHBondContact O-N 3.42Å |
| 74 | N | 69.6 | Low | 73 | Confident | 81 Ų | 81 | 104.3 Ų | 104.3 | 43% | 0.433 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -55 | -51.6 | 177.1 | -117.7 | -27.2 | 0 | 0 | 0 | 113.3 | L70 R78 | L70-N74 VanDerWaalsContact O-CB 3.28Å; L70-N74 WeakPolarHBondContact O-CB 3.49Å; L70-N74 PolarHBondContact O-N 3.41Å; N74-R78 WeakPolarHBondContact O-CB 3.28Å; N74-R78 WeakPolarHBondContact O-CG 3.17Å; N74-R78 PolarHBondContact O-N 3.39Å |
| 75 | P | 70.4 | Confident | 70.6 | Confident | 64 Ų | 64 | 105.3 Ų | 105.3 | 42% | 0.416 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -68 | -35.2 | 175.1 | 25.4 | -31.7 | 0 | 0 | 0 | 110.6 | Q71 C72 R78 Q79 | Q71-P75 WeakPolarHBondContact O-CD 3.38Å; Q71-P75 WeakPolarHBondContact O-CG 3.27Å; C72-P75 VanDerWaalsContact C-CD 3.46Å; C72-P75 VanDerWaalsContact O-CD 3.23Å; C72-P75 WeakPolarHBondContact O-CD 3.44Å; C72-P75 WeakPolarHBondContact O-CG 3.19Å; P75-R78 CarbonylContact O-C 3.59Å; P75-R78 PolarHBondContact O-N 3.48Å; P75-Q79 WeakPolarHBondContact O-CA 3.41Å; P75-Q79 WeakPolarHBondContact O-CB 3.41Å; P75-Q79 PolarHBondContact O-N 2.87Å |
| 76 | M | 66.9 | Low | 68.3 | Low | 105 Ų | 105 | 108.4 Ų | 108.4 | 52% | 0.517 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -68.2 | -39.1 | 176.7 | -165.3 | -176.6 | 68.8 | 0 | 0 | 112.9 | C72 L73 Q79 R80 | C72-M76 WeakPolarHBondContact O-CB 3.34Å; C72-M76 PolarHBondContact O-N 3.22Å; C72-M76 VanDerWaalsContact O-N 3.08Å; L73-M76 HydrophobicContact CD2-CE 3.56Å; L73-M76 CarbonylContact O-C 3.57Å; L73-M76 PolarHBondContact O-N 3.48Å; L73-M76 VanDerWaalsContact O-N 3.14Å; M76-Q79 PolarHBondContact O-N 2.82Å; M76-R80 WeakPolarHBondContact O-CB 3.4Å; M76-R80 VanDerWaalsContact O-CG 3.23Å; M76-R80 WeakPolarHBondContact O-CG 2.93Å; M76-R80 PolarHBondContact O-N 2.74Å |
| 77 | L | 62.7 | Low | 66.4 | Low | 80 Ų | 80 | 110.4 Ų | 110.4 | 42% | 0.419 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -73 | -37.9 | 174.1 | -85.8 | 100.6 | 0 | 0 | 0 | 111.4 | L73 Q79 R81 | L73-L77 HydrophobicContact CB-CD1 3.76Å; L73-L77 HydrophobicContact CD2-CD1 4.37Å; L73-L77 HydrophobicContact CG-CD1 4.48Å; L73-L77 WeakPolarHBondContact O-CB 3.34Å; L73-L77 WeakPolarHBondContact O-CD1 3.4Å; L73-L77 PolarHBondContact O-N 3.42Å; L77-Q79 VanDerWaalsContact C-N 3.32Å; L77-R81 WeakPolarHBondContact O-CB 3.2Å; L77-R81 VanDerWaalsContact O-CG 3.25Å; L77-R81 WeakPolarHBondContact O-CG 3.02Å; L77-R81 PolarHBondContact O-N 3.24Å |
| 78 | R | 60.5 | Low | 64.8 | Low | 94 Ų | 94 | 111.2 Ų | 111.2 | 36% | 0.355 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -68.4 | -32.8 | 171.9 | -73 | 176.4 | 89.7 | -159 | 12.2 | 111 | N74 P75 R81 K82 E122 | N74-R78 WeakPolarHBondContact O-CB 3.28Å; N74-R78 WeakPolarHBondContact O-CG 3.17Å; N74-R78 PolarHBondContact O-N 3.39Å; P75-R78 CarbonylContact O-C 3.59Å; P75-R78 PolarHBondContact O-N 3.48Å; R78-R81 CarbonylContact O-C 3.51Å; R78-R81 PolarHBondContact O-N 3.11Å; R78-K82 WeakPolarHBondContact O-CB 3.22Å; R78-K82 WeakPolarHBondContact O-CG 3.41Å; R78-K82 PolarHBondContact O-N 2.69Å; R78-E122 IonicContact CZ-OE1 2.78Å; R78-E122 IonicContact NE-OE1 3.71Å; R78-E122 PolarHBondContact NE-OE1 2.84Å; R78-E122 IonicContact NH2-OE1 2.78Å; R78-E122 PolarHBondContact NH2-OE1 3.45Å; R78-E122 IonicContact NH2-OE2 3.22Å |
| 79 | Q | 60.6 | Low | 62.9 | Low | 150 Ų | 150 | 113.1 Ų | 113.1 | 70% | 0.701 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -75.2 | -36.7 | 176.8 | -171.6 | 144.5 | -33.2 | 0 | 0 | 111.7 | P75 M76 L77 R81 K82 | P75-Q79 WeakPolarHBondContact O-CA 3.41Å; P75-Q79 WeakPolarHBondContact O-CB 3.41Å; P75-Q79 PolarHBondContact O-N 2.87Å; M76-Q79 PolarHBondContact O-N 2.82Å; L77-Q79 VanDerWaalsContact C-N 3.32Å; Q79-R81 VanDerWaalsContact C-N 3.27Å; Q79-R81 PolarHBondContact O-N 3.48Å; Q79-K82 CarbonylContact O-C 3.51Å; Q79-K82 PolarHBondContact O-N 3.16Å |
| 80 | R | 60.2 | Low | 61.2 | Low | 219 Ų | 219 | 112.8 Ų | 112.8 | 83% | 0.826 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -66.6 | -27.5 | 168.1 | -71.4 | -81.6 | -170.1 | 176.6 | 1.4 | 112.8 | M76 | M76-R80 WeakPolarHBondContact O-CB 3.4Å; M76-R80 VanDerWaalsContact O-CG 3.23Å; M76-R80 WeakPolarHBondContact O-CG 2.93Å; M76-R80 PolarHBondContact O-N 2.74Å |
| 81 | R | 56.4 | Low | 59.7 | Low | 142 Ų | 142 | 115.3 Ų | 115.3 | 54% | 0.536 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -88.2 | -23 | 174.6 | -72.2 | 178.9 | -177.9 | -176.8 | 3.7 | 113.7 | L77 R78 Q79 G83 | L77-R81 WeakPolarHBondContact O-CB 3.2Å; L77-R81 VanDerWaalsContact O-CG 3.25Å; L77-R81 WeakPolarHBondContact O-CG 3.02Å; L77-R81 PolarHBondContact O-N 3.24Å; R78-R81 CarbonylContact O-C 3.51Å; R78-R81 PolarHBondContact O-N 3.11Å; Q79-R81 VanDerWaalsContact C-N 3.27Å; Q79-R81 PolarHBondContact O-N 3.48Å; R81-G83 PolarHBondContact O-N 2.91Å |
| 82 | K | 56.1 | Low | 58.2 | Low | 124 Ų | 124 | 116.6 Ų | 116.6 | 54% | 0.539 | 58% | 0.582 | S | S | . | * | trans | -86.1 | 66.4 | 170.1 | -72 | 169.3 | 178.8 | -171.7 | 0 | 108.4 | R78 Q79 | R78-K82 WeakPolarHBondContact O-CB 3.22Å; R78-K82 WeakPolarHBondContact O-CG 3.41Å; R78-K82 PolarHBondContact O-N 2.69Å; Q79-K82 CarbonylContact O-C 3.51Å; Q79-K82 PolarHBondContact O-N 3.16Å | ||
| 83 | G | 57.9 | Low | 56.6 | Low | 45 Ų | 45 | 119.7 Ų | 119.7 | 46% | 0.464 | 59% | 0.594 | S | S | . | * | trans | -57 | 164.4 | 155.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | R81 S85 | R81-G83 PolarHBondContact O-N 2.91Å; G83-S85 PolarHBondContact O-N 3.34Å | ||
| 84 | P | 53.6 | Low | 55.2 | Low | 134 Ų | 134 | 124.2 Ų | 124.2 | 87% | 0.87 | 62% | 0.618 | S | S | * | * | S | Bend | trans | -55.2 | 128.8 | -159.3 | 22.4 | -32.1 | 0 | 0 | 0 | 112.7 | ||
| 85 | S | 43.2 | Very low | 54.5 | Low | 112 Ų | 112 | 128.4 Ų | 128.4 | 78% | 0.783 | 64% | 0.639 | S | S | * | * | trans | 44 | 100.7 | 160.1 | -151.2 | 0 | 0 | 0 | 0 | 117.6 | G83 | G83-S85 PolarHBondContact O-N 3.34Š| ||
| 86 | Y | 45.7 | Very low | 53.7 | Low | 160 Ų | 160 | 134.7 Ų | 134.7 | 63% | 0.627 | 66% | 0.66 | S | S | * | * | trans | -125.6 | 101.9 | 143.8 | 73.2 | -84.8 | 0 | 0 | 0 | 107.8 | K88 | Y86-K88 PolarHBondContact O-N 2.99Š| ||
| 87 | E | 51.2 | Low | 52.9 | Low | 173 Ų | 173 | 134.9 Ų | 134.9 | 81% | 0.808 | 67% | 0.672 | S | S | * | * | trans | -55.9 | 118.1 | 167.8 | -169.2 | 164.1 | 91.8 | 0 | 0 | 108 | H89 | E87-H89 PolarHBondContact O-N 3.39Š| ||
| 88 | K | 53.3 | Low | 51.8 | Low | 124 Ų | 124 | 135.7 Ų | 135.7 | 54% | 0.539 | 69% | 0.69 | S | S | . | * | trans | -70 | 100.4 | 173.6 | -102.5 | -175.6 | 170.6 | 56.4 | 0 | 107.3 | Y86 V90 | Y86-K88 PolarHBondContact O-N 2.99Å; K88-V90 PolarHBondContact O-N 3.16Å; K88-V90 VanDerWaalsContact O-N 3.12Å | ||
| 89 | H | 48.6 | Very low | 50.9 | Low | 151 Ų | 151 | 137.1 Ų | 137.1 | 70% | 0.699 | 71% | 0.711 | S | S | * | * | trans | -61.1 | 110.4 | 157.2 | -136.8 | 90.1 | 0 | 0 | 0 | 106.6 | E87 D91 | E87-H89 PolarHBondContact O-N 3.39Å; H89-D91 IonicContact CD2-OD1 2.79Å; H89-D91 IonicContact CD2-OD2 3.78Å; H89-D91 PolarHBondContact CD2-OD2 2.84Å; H89-D91 PolarHBondContact O-N 3.43Å | ||
| 90 | V | 51 | Low | 50.2 | Low | 107 Ų | 107 | 134.1 Ų | 134.1 | 65% | 0.648 | 71% | 0.713 | S | S | * | * | trans | -85 | 75.8 | 169.3 | -158.8 | 0 | 0 | 0 | 0 | 104.4 | K88 E92 | K88-V90 PolarHBondContact O-N 3.16Å; K88-V90 VanDerWaalsContact O-N 3.12Å; V90-E92 HydrophobicContact CG1-CG 4.37Å; V90-E92 PolarHBondContact O-N 2.98Å | ||
| 91 | D | 50.9 | Low | 49.4 | Very low | 116 Ų | 116 | 129.2 Ų | 129.2 | 62% | 0.62 | 71% | 0.711 | S | S | * | * | trans | -68.7 | 93.6 | 162.9 | -90.5 | -54.1 | 0 | 0 | 0 | 106 | H89 D93 | H89-D91 IonicContact CD2-OD1 2.79Å; H89-D91 IonicContact CD2-OD2 3.78Å; H89-D91 PolarHBondContact CD2-OD2 2.84Å; H89-D91 PolarHBondContact O-N 3.43Å; D91-D93 VanDerWaalsContact C-N 3.32Å; D91-D93 PolarHBondContact O-N 3.42Å | ||
| 92 | E | 47.3 | Very low | 48.9 | Very low | 154 Ų | 154 | 126.3 Ų | 126.3 | 72% | 0.72 | 72% | 0.718 | S | S | * | * | trans | -62.3 | 100.5 | 161.6 | -70.3 | -83.7 | 123 | 0 | 0 | 106.4 | V90 N94 | V90-E92 HydrophobicContact CG1-CG 4.37Å; V90-E92 PolarHBondContact O-N 2.98Å; E92-N94 VanDerWaalsContact C-N 3.29Å; E92-N94 PolarHBondContact O-N 3.27Å | ||
| 93 | D | 49.1 | Very low | 48.4 | Very low | 139 Ų | 139 | 126.1 Ų | 126.1 | 74% | 0.743 | 73% | 0.727 | S | S | * | * | trans | -50.2 | 86 | 171.4 | -61.7 | -58.9 | 0 | 0 | 0 | 111.2 | D91 | D91-D93 VanDerWaalsContact C-N 3.32Å; D91-D93 PolarHBondContact O-N 3.42Å | ||
| 94 | N | 45.1 | Very low | 47.5 | Very low | 135 Ų | 135 | 129.8 Ų | 129.8 | 72% | 0.722 | 74% | 0.737 | S | S | * | * | trans | -115.1 | 68.4 | 164.5 | -81.4 | -36.9 | 0 | 0 | 0 | 109.4 | E92 F96 | E92-N94 VanDerWaalsContact C-N 3.29Å; E92-N94 PolarHBondContact O-N 3.27Å; N94-F96 PolarHBondContact O-N 3.29Å | ||
| 95 | I | 54.2 | Low | 47.1 | Very low | 168 Ų | 168 | 131.2 Ų | 131.2 | 86% | 0.862 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.4 | 14.7 | 175.7 | -101.9 | 155.6 | 0 | 0 | 0 | 113.9 | ||
| 96 | F | 53.8 | Low | 46.8 | Very low | 196 Ų | 196 | 130.3 Ų | 130.3 | 86% | 0.86 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.2 | 2.9 | -176.9 | -167.8 | -107.2 | 0 | 0 | 0 | 115.4 | N94 | N94-F96 PolarHBondContact O-N 3.29Š|
| 97 | S | 49.1 | Very low | 46.3 | Very low | 110 Ų | 110 | 127.5 Ų | 127.5 | 77% | 0.769 | 74% | 0.736 | S | S | * | * | trans | -133.2 | 67.7 | -176.9 | -57 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 98 | A | 40.4 | Very low | 45.8 | Very low | 96 Ų | 96 | 125 Ų | 125 | 79% | 0.793 | 73% | 0.734 | S | S | * | * | trans | -79.9 | 153.6 | 151.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 99 | P | 41.7 | Very low | 45.1 | Very low | 124 Ų | 124 | 125 Ų | 125 | 81% | 0.805 | 75% | 0.748 | S | S | * | * | cis | -134.9 | 159.3 | 14.8 | 39 | -21.8 | 0 | 0 | 0 | 114.3 | ||||
| 100 | A | 45.1 | Very low | 44.6 | Very low | 88 Ų | 88 | 121.4 Ų | 121.4 | 73% | 0.727 | 75% | 0.753 | S | S | * | * | trans | 170.1 | 128.7 | 131.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 101 | S | 44 | Very low | 44 | Very low | 115 Ų | 115 | 121.7 Ų | 121.7 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | 74.7 | 128.4 | 142.8 | 53 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 102 | A | 45.6 | Very low | 43.8 | Very low | 82 Ų | 82 | 122 Ų | 122 | 68% | 0.678 | 76% | 0.761 | S | S | * | * | trans | 88.3 | 102.8 | 140.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 103 | T | 45.8 | Very low | 44.3 | Very low | 119 Ų | 119 | 121.4 Ų | 121.4 | 73% | 0.73 | 77% | 0.767 | S | S | * | * | 58.1 | 119.5 | 103 | 24.8 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 104 | D | 39 | Very low | 44.6 | Very low | 123 Ų | 123 | 123.4 Ų | 123.4 | 66% | 0.658 | 77% | 0.772 | S | S | * | * | cis | -173.7 | 145.5 | 40.3 | -99.3 | -43.3 | 0 | 0 | 0 | 109.9 | ||||
| 105 | M | 45.2 | Very low | 45 | Very low | 163 Ų | 163 | 120.7 Ų | 120.7 | 80% | 0.803 | 76% | 0.761 | S | S | * | * | trans | 59.2 | 119.7 | 134.3 | -54.6 | -63.1 | 174.7 | 0 | 0 | 122.7 | ||||
| 106 | A | 37.7 | Very low | 45 | Very low | 93 Ų | 93 | 123.3 Ų | 123.3 | 77% | 0.769 | 76% | 0.76 | S | S | * | * | trans | 74.1 | 140.7 | 134.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 107 | S | 35 | Very low | 45.2 | Very low | 101 Ų | 101 | 122.3 Ų | 122.3 | 71% | 0.706 | 76% | 0.758 | S | S | * | * | cis | 179.3 | 162 | -6.2 | 44.9 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 108 | T | 40.5 | Very low | 45.4 | Very low | 122 Ų | 122 | 124.9 Ų | 124.9 | 75% | 0.748 | 75% | 0.751 | S | S | * | * | trans | 94.2 | 88.7 | 151 | -42.3 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 109 | S | 37.7 | Very low | 46 | Very low | 122 Ų | 122 | 126.6 Ų | 126.6 | 85% | 0.853 | 74% | 0.742 | S | S | * | * | 36.3 | 121.5 | 115.5 | -52.4 | 0 | 0 | 0 | 0 | 120.5 | |||||
| 110 | G | 38.4 | Very low | 46.7 | Very low | 76 Ų | 76 | 123.1 Ų | 123.1 | 78% | 0.784 | 72% | 0.724 | S | S | * | * | trans | 171.2 | 84.7 | 160.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 111 | S | 39 | Very low | 47.2 | Very low | 113 Ų | 113 | 121.9 Ų | 121.9 | 79% | 0.79 | 71% | 0.71 | S | S | * | * | trans | 11.5 | 117.8 | 150.9 | -169.3 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 112 | N | 46.9 | Very low | 47.7 | Very low | 124 Ų | 124 | 119 Ų | 119 | 66% | 0.663 | 68% | 0.684 | S | S | * | * | trans | -159.7 | 91 | 154.5 | -111.5 | -25.7 | 0 | 0 | 0 | 113.8 | Q114 | N112-Q114 VanDerWaalsContact C-N 3.31Å; N112-Q114 PolarHBondContact O-N 2.88Å | ||
| 113 | V | 56.4 | Low | 48.4 | Very low | 140 Ų | 140 | 117.5 Ų | 117.5 | 85% | 0.848 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -0.1 | 178.8 | 174.6 | 0 | 0 | 0 | 0 | 113 | ||
| 114 | Q | 55.5 | Low | 49.2 | Very low | 181 Ų | 181 | 115.3 Ų | 115.3 | 85% | 0.846 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.3 | 5.4 | -170.5 | -73.8 | -178.8 | -11.7 | 0 | 0 | 116.4 | N112 | N112-Q114 VanDerWaalsContact C-N 3.31Å; N112-Q114 PolarHBondContact O-N 2.88Å |
| 115 | T | 53.8 | Low | 50.2 | Low | 79 Ų | 79 | 115 Ų | 115 | 49% | 0.485 | 65% | 0.653 | S | S | . | * | S | Bend | trans | -92.1 | -14.5 | -174.1 | 46.9 | 0 | 0 | 0 | 0 | 115.2 | Q117 | T115-Q117 PolarHBondContact O-N 3.12Š|
| 116 | R | 54.1 | Low | 51 | Low | 222 Ų | 222 | 111 Ų | 111 | 84% | 0.838 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.8 | -33 | -169.4 | -111.7 | 178 | 165.9 | -172.6 | -4.3 | 115.2 | ||
| 117 | Q | 57.7 | Low | 52.2 | Low | 176 Ų | 176 | 113.9 Ų | 113.9 | 82% | 0.822 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -81.4 | -26.3 | -170.8 | -164.6 | 168.9 | -29.9 | 0 | 0 | 113.9 | T115 | T115-Q117 PolarHBondContact O-N 3.12Å |
| 118 | R | 53.8 | Low | 53.6 | Low | 163 Ų | 163 | 114.6 Ų | 114.6 | 62% | 0.615 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -88.1 | -25.4 | -179.4 | -81.2 | -178 | 167.4 | 178.1 | -0.3 | 113.8 | A120 S121 | R118-A120 PolarHBondContact O-N 3.42Å; R118-S121 PolarHBondContact O-OG 3.36Å |
| 119 | Q | 53.3 | Low | 55 | Low | 132 Ų | 132 | 115.4 Ų | 115.4 | 62% | 0.617 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63.6 | -33.4 | 169.5 | -93.4 | 170.3 | -52.3 | 0 | 0 | 111.5 | S121 S123 | Q119-S121 PolarHBondContact O-N 3.44Å; Q119-S123 WeakPolarHBondContact O-CB 3.26Å; Q119-S123 PolarHBondContact O-N 3.43Å; Q119-S123 PolarHBondContact O-OG 3.29Å |
| 120 | A | 55.3 | Low | 56.4 | Low | 51 Ų | 51 | 115.6 Ų | 115.6 | 42% | 0.421 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -59 | -50 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | R118 S123 V124 | R118-A120 PolarHBondContact O-N 3.42Å; A120-S123 PolarHBondContact O-N 3.29Å; A120-S123 PolarHBondContact O-OG 2.92Å; A120-V124 WeakPolarHBondContact O-CG2 3.48Å; A120-V124 PolarHBondContact O-N 2.87Å; A120-V124 VanDerWaalsContact O-N 3.11Å |
| 121 | S | 56.2 | Low | 57.7 | Low | 63 Ų | 63 | 119.7 Ų | 119.7 | 44% | 0.441 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -70.2 | -38.2 | -177.4 | 60.5 | 0 | 0 | 0 | 0 | 114.1 | R118 Q119 V124 L125 | R118-S121 PolarHBondContact O-OG 3.36Å; Q119-S121 PolarHBondContact O-N 3.44Å; S121-V124 PolarHBondContact O-N 3.32Å; S121-L125 PolarHBondContact O-N 2.93Å |
| 122 | E | 54.2 | Low | 59 | Low | 53 Ų | 53 | 120.3 Ų | 120.3 | 25% | 0.248 | 58% | 0.58 | C | S | . | * | H | α-helix | trans | -70 | -33.2 | 174.5 | -99.4 | -113.9 | 156.5 | 0 | 0 | 111.8 | R78 V124 K126 | R78-E122 IonicContact CZ-OE1 2.78Å; R78-E122 IonicContact NE-OE1 3.71Å; R78-E122 PolarHBondContact NE-OE1 2.84Å; R78-E122 IonicContact NH2-OE1 2.78Å; R78-E122 PolarHBondContact NH2-OE1 3.45Å; R78-E122 IonicContact NH2-OE2 3.22Å; E122-V124 VanDerWaalsContact C-N 3.35Å; E122-K126 WeakPolarHBondContact O-CB 3.32Å; E122-K126 PolarHBondContact O-N 3.42Å; E122-K126 VanDerWaalsContact O-N 3.13Å; E122-K126 IonicContact OE2-NZ 3.52Å; E122-K126 PolarHBondContact OE2-NZ 3.22Å |
| 123 | S | 60.1 | Low | 60.5 | Low | 52 Ų | 52 | 118 Ų | 118 | 36% | 0.364 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.7 | -34.1 | 176 | 75.7 | 0 | 0 | 0 | 0 | 112.2 | Q119 A120 R127 | Q119-S123 WeakPolarHBondContact O-CB 3.26Å; Q119-S123 PolarHBondContact O-N 3.43Å; Q119-S123 PolarHBondContact O-OG 3.29Å; A120-S123 PolarHBondContact O-N 3.29Å; A120-S123 PolarHBondContact O-OG 2.92Å; S123-R127 WeakPolarHBondContact O-CB 3.24Å; S123-R127 PolarHBondContact O-N 3.01Å |
| 124 | V | 62.5 | Low | 61.4 | Low | 72 Ų | 72 | 119.2 Ų | 119.2 | 44% | 0.436 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -71.8 | -44.2 | 179.3 | 175.7 | 0 | 0 | 0 | 0 | 111.3 | A120 S121 E122 R127 M128 | A120-V124 WeakPolarHBondContact O-CG2 3.48Å; A120-V124 PolarHBondContact O-N 2.87Å; A120-V124 VanDerWaalsContact O-N 3.11Å; S121-V124 PolarHBondContact O-N 3.32Å; E122-V124 VanDerWaalsContact C-N 3.35Å; V124-R127 CarbonylContact O-C 3.54Å; V124-R127 PolarHBondContact O-N 3.05Å; V124-M128 HydrophobicContact CG1-CE 4.07Å; V124-M128 HydrophobicContact CG1-SD 4.39Å; V124-M128 WeakPolarHBondContact O-CG 3.48Å; V124-M128 PolarHBondContact O-N 3.07Å |
| 125 | L | 61.7 | Low | 62.5 | Low | 116 Ų | 116 | 118.5 Ų | 118.5 | 61% | 0.607 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -67.1 | -43.9 | 178.1 | -74.4 | 169.7 | 0 | 0 | 0 | 112.6 | S121 R127 M128 E129 | S121-L125 PolarHBondContact O-N 2.93Å; L125-R127 VanDerWaalsContact C-N 3.28Å; L125-R127 PolarHBondContact O-N 3.42Å; L125-M128 WeakPolarHBondContact O-CB 3.28Å; L125-M128 PolarHBondContact O-N 3.3Å; L125-M128 VanDerWaalsContact O-N 3.16Å; L125-E129 PolarHBondContact O-N 3.44Å |
| 126 | K | 60.9 | Low | 63.8 | Low | 81 Ų | 81 | 119.8 Ų | 119.8 | 35% | 0.352 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64 | -35.1 | 172.4 | -82.7 | 175 | 175.6 | 145 | 0 | 112 | E122 M128 E129 H130 | E122-K126 WeakPolarHBondContact O-CB 3.32Å; E122-K126 PolarHBondContact O-N 3.42Å; E122-K126 VanDerWaalsContact O-N 3.13Å; E122-K126 IonicContact OE2-NZ 3.52Å; E122-K126 PolarHBondContact OE2-NZ 3.22Å; K126-M128 VanDerWaalsContact C-N 3.33Å; K126-E129 PolarHBondContact O-N 2.95Å; K126-H130 VanDerWaalsContact O-CB 3.3Å; K126-H130 WeakPolarHBondContact O-CB 3.18Å; K126-H130 PolarHBondContact O-N 2.89Å |
| 127 | R | 63.1 | Low | 65.2 | Low | 153 Ų | 153 | 112.1 Ų | 112.1 | 58% | 0.577 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -68.8 | -31.9 | 174.5 | -172.6 | 179.2 | -66.9 | -121.1 | -1.2 | 111.7 | S123 V124 L125 R131 | S123-R127 WeakPolarHBondContact O-CB 3.24Å; S123-R127 PolarHBondContact O-N 3.01Å; V124-R127 CarbonylContact O-C 3.54Å; V124-R127 PolarHBondContact O-N 3.05Å; L125-R127 VanDerWaalsContact C-N 3.28Å; L125-R127 PolarHBondContact O-N 3.42Å; R127-R131 VanDerWaalsContact O-CB 3.28Å; R127-R131 WeakPolarHBondContact O-CB 3.19Å; R127-R131 WeakPolarHBondContact O-CG 2.7Å; R127-R131 PolarHBondContact O-N 3.03Å |
| 128 | M | 64.7 | Low | 66.3 | Low | 115 Ų | 115 | 106.4 Ų | 106.4 | 57% | 0.567 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -68.6 | -44.2 | 172.5 | -75.3 | 177.6 | 170.1 | 0 | 0 | 111.5 | V124 L125 K126 R131 Q132 | V124-M128 HydrophobicContact CG1-CE 4.07Å; V124-M128 HydrophobicContact CG1-SD 4.39Å; V124-M128 WeakPolarHBondContact O-CG 3.48Å; V124-M128 PolarHBondContact O-N 3.07Å; L125-M128 WeakPolarHBondContact O-CB 3.28Å; L125-M128 PolarHBondContact O-N 3.3Å; L125-M128 VanDerWaalsContact O-N 3.16Å; K126-M128 VanDerWaalsContact C-N 3.33Å; M128-R131 PolarHBondContact O-N 3.33Å; M128-Q132 WeakPolarHBondContact O-CB 3.12Å; M128-Q132 PolarHBondContact O-N 2.7Å |
| 129 | E | 70.3 | Confident | 67.6 | Low | 140 Ų | 140 | 100.1 Ų | 100.1 | 65% | 0.654 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -63.8 | -43 | 175.2 | -168.7 | 179.1 | 162.4 | 0 | 0 | 112 | L125 K126 R131 Q132 S133 | L125-E129 PolarHBondContact O-N 3.44Å; K126-E129 PolarHBondContact O-N 2.95Å; E129-R131 VanDerWaalsContact C-N 3.32Å; E129-R131 PolarHBondContact O-N 3.14Å; E129-Q132 PolarHBondContact O-N 3.13Å; E129-S133 WeakPolarHBondContact O-CB 3.1Å; E129-S133 PolarHBondContact O-N 3.5Å |
| 130 | H | 67.2 | Low | 69 | Low | 125 Ų | 125 | 99.1 Ų | 99.1 | 58% | 0.579 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -70.2 | -26 | 177.5 | -132.7 | 74.9 | 0 | 0 | 0 | 113.3 | K126 R134 | K126-H130 VanDerWaalsContact O-CB 3.3Å; K126-H130 WeakPolarHBondContact O-CB 3.18Å; K126-H130 PolarHBondContact O-N 2.89Å; H130-R134 WeakPolarHBondContact O-CG 3.47Å; H130-R134 PolarHBondContact O-N 2.68Å; H130-R134 PolarHBondContact O-NE 3.16Å |
| 131 | R | 64.5 | Low | 70.2 | Confident | 163 Ų | 163 | 100.9 Ų | 100.9 | 62% | 0.615 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -76.1 | -41.8 | 171.2 | -79.7 | 177.5 | 176.7 | -163.2 | -1.5 | 111.1 | R127 M128 E129 W135 | R127-R131 VanDerWaalsContact O-CB 3.28Å; R127-R131 WeakPolarHBondContact O-CB 3.19Å; R127-R131 WeakPolarHBondContact O-CG 2.7Å; R127-R131 PolarHBondContact O-N 3.03Å; M128-R131 PolarHBondContact O-N 3.33Å; E129-R131 VanDerWaalsContact C-N 3.32Å; E129-R131 PolarHBondContact O-N 3.14Å; R131-W135 PolarHBondContact O-N 2.69Å; R131-W135 VanDerWaalsContact O-N 3.12Å |
| 132 | Q | 66.8 | Low | 71.1 | Confident | 125 Ų | 125 | 104.4 Ų | 104.4 | 58% | 0.584 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.9 | -42.3 | 179.4 | -169.6 | 173 | -3.9 | 0 | 0 | 111.8 | M128 E129 W135 M136 | M128-Q132 WeakPolarHBondContact O-CB 3.12Å; M128-Q132 PolarHBondContact O-N 2.7Å; E129-Q132 PolarHBondContact O-N 3.13Å; Q132-W135 PolarHBondContact O-N 3.32Å; Q132-M136 WeakPolarHBondContact O-CB 3.42Å; Q132-M136 WeakPolarHBondContact O-CG 3.35Å; Q132-M136 PolarHBondContact O-N 3.14Å |
| 133 | S | 77.3 | Confident | 72.3 | Confident | 75 Ų | 75 | 109.1 Ų | 109.1 | 52% | 0.524 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.8 | -44.9 | 176.9 | -180 | 0 | 0 | 0 | 0 | 112.3 | E129 W135 M136 A137 | E129-S133 WeakPolarHBondContact O-CB 3.1Å; E129-S133 PolarHBondContact O-N 3.5Å; S133-W135 PolarHBondContact O-N 2.77Å; S133-M136 PolarHBondContact O-N 3.35Å; S133-A137 WeakPolarHBondContact O-CB 3.3Å; S133-A137 PolarHBondContact O-N 3.35Å |
| 134 | R | 76.2 | Confident | 72.9 | Confident | 166 Ų | 166 | 113.9 Ų | 113.9 | 63% | 0.626 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.9 | -39.1 | 177.2 | -76.6 | -167 | -75 | 173 | -9.7 | 112.9 | H130 A138 | H130-R134 WeakPolarHBondContact O-CG 3.47Å; H130-R134 PolarHBondContact O-N 2.68Å; H130-R134 PolarHBondContact O-NE 3.16Å; R134-A138 WeakPolarHBondContact O-CB 3.23Å; R134-A138 PolarHBondContact O-N 3.46Å |
| 135 | W | 78 | Confident | 73.2 | Confident | 166 Ų | 166 | 117.4 Ų | 117.4 | 63% | 0.629 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.2 | -45.2 | 174.4 | 179 | 77.1 | 0 | 0 | 0 | 111.7 | R131 Q132 S133 A137 A138 V139 | R131-W135 PolarHBondContact O-N 2.69Å; R131-W135 VanDerWaalsContact O-N 3.12Å; Q132-W135 PolarHBondContact O-N 3.32Å; S133-W135 PolarHBondContact O-N 2.77Å; W135-A137 VanDerWaalsContact C-N 3.34Å; W135-A137 PolarHBondContact O-N 2.8Å; W135-A138 PolarHBondContact O-N 3.13Å; W135-V139 HydrophobicContact CD2-CG2 4.01Å; W135-V139 HydrophobicContact CE3-CG2 4.49Å; W135-V139 HydrophobicContact CG-CG2 4.47Å; W135-V139 HydrophobicContact CH2-CG2 4.33Å; W135-V139 HydrophobicContact CZ2-CG2 3.81Å; W135-V139 VanDerWaalsContact O-CG2 3.31Å; W135-V139 WeakPolarHBondContact O-CG2 3.2Å; W135-V139 PolarHBondContact O-N 2.89Å |
| 136 | M | 81.3 | Confident | 73.4 | Confident | 107 Ų | 107 | 117 Ų | 117 | 53% | 0.527 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -61.3 | -41 | 176.9 | -72.9 | -69.3 | -115.3 | 0 | 0 | 112.2 | Q132 S133 V139 N140 | Q132-M136 WeakPolarHBondContact O-CB 3.42Å; Q132-M136 WeakPolarHBondContact O-CG 3.35Å; Q132-M136 PolarHBondContact O-N 3.14Å; S133-M136 PolarHBondContact O-N 3.35Å; M136-V139 PolarHBondContact O-N 3.15Å; M136-N140 WeakPolarHBondContact O-CB 3.25Å; M136-N140 PolarHBondContact O-N 3.47Å |
| 137 | A | 83 | Confident | 73.6 | Confident | 61 Ų | 61 | 121 Ų | 121 | 50% | 0.504 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.6 | -43.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | S133 W135 N140 E141 | S133-A137 WeakPolarHBondContact O-CB 3.3Å; S133-A137 PolarHBondContact O-N 3.35Å; W135-A137 VanDerWaalsContact C-N 3.34Å; W135-A137 PolarHBondContact O-N 2.8Å; A137-N140 PolarHBondContact O-N 3.45Å; A137-E141 PolarHBondContact O-N 2.86Å |
| 138 | A | 81.5 | Confident | 73.7 | Confident | 56 Ų | 56 | 117.2 Ų | 117.2 | 46% | 0.463 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.1 | -41.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | R134 W135 E141 Q142 | R134-A138 WeakPolarHBondContact O-CB 3.23Å; R134-A138 PolarHBondContact O-N 3.46Å; W135-A138 PolarHBondContact O-N 3.13Å; A138-E141 PolarHBondContact O-N 3.33Å; A138-Q142 PolarHBondContact O-N 3.45Å |
| 139 | V | 82.1 | Confident | 73.5 | Confident | 30 Ų | 30 | 117.5 Ų | 117.5 | 18% | 0.182 | 55% | 0.553 | C | S | . | * | H | α-helix | trans | -66.1 | -39.5 | 176.2 | 171 | 0 | 0 | 0 | 0 | 111.3 | W135 M136 Q142 R143 | W135-V139 HydrophobicContact CD2-CG2 4.01Å; W135-V139 HydrophobicContact CE3-CG2 4.49Å; W135-V139 HydrophobicContact CG-CG2 4.47Å; W135-V139 HydrophobicContact CH2-CG2 4.33Å; W135-V139 HydrophobicContact CZ2-CG2 3.81Å; W135-V139 VanDerWaalsContact O-CG2 3.31Å; W135-V139 WeakPolarHBondContact O-CG2 3.2Å; W135-V139 PolarHBondContact O-N 2.89Å; M136-V139 PolarHBondContact O-N 3.15Å; V139-Q142 PolarHBondContact O-N 2.79Å; V139-R143 WeakPolarHBondContact O-CG 3.33Å; V139-R143 PolarHBondContact O-N 3.38Å |
| 140 | N | 82.4 | Confident | 73.1 | Confident | 111 Ų | 111 | 117.7 Ų | 117.7 | 59% | 0.594 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -65.6 | -39.1 | 178.1 | -164.3 | 38.4 | 0 | 0 | 0 | 111.8 | M136 A137 R143 R144 | M136-N140 WeakPolarHBondContact O-CB 3.25Å; M136-N140 PolarHBondContact O-N 3.47Å; A137-N140 PolarHBondContact O-N 3.45Å; N140-R143 PolarHBondContact O-N 3.08Å; N140-R144 PolarHBondContact O-N 2.78Å |
| 141 | E | 79.5 | Confident | 72.6 | Confident | 88 Ų | 88 | 116.6 Ų | 116.6 | 41% | 0.411 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -68.8 | -38 | 175.8 | -169.6 | 59.8 | -160.8 | 0 | 0 | 112.1 | A137 A138 R144 K145 | A137-E141 PolarHBondContact O-N 2.86Å; A138-E141 PolarHBondContact O-N 3.33Å; E141-R144 PolarHBondContact O-N 2.98Å; E141-R144 IonicContact OE1-CZ 3.75Å; E141-R144 IonicContact OE1-NE 3.15Å; E141-R144 PolarHBondContact OE1-NE 3.4Å; E141-R144 IonicContact OE1-NH2 3.58Å; E141-R144 PolarHBondContact OE1-NH2 3.12Å; E141-R144 IonicContact OE2-CZ 3.38Å; E141-R144 IonicContact OE2-NE 3.18Å; E141-R144 PolarHBondContact OE2-NE 2.7Å; E141-R144 VanDerWaalsContact OE2-NE 3.15Å; E141-R144 IonicContact OE2-NH2 2.73Å; E141-K145 PolarHBondContact O-N 3.45Å |
| 142 | Q | 75.7 | Confident | 72.3 | Confident | 137 Ų | 137 | 115 Ų | 115 | 64% | 0.64 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60.4 | -44.1 | 171 | -84.6 | -172.5 | -27 | 0 | 0 | 112.1 | A138 V139 R144 K145 I146 | A138-Q142 PolarHBondContact O-N 3.45Å; V139-Q142 PolarHBondContact O-N 2.79Å; Q142-R144 PolarHBondContact O-N 2.78Å; Q142-K145 PolarHBondContact O-N 2.79Å; Q142-I146 WeakPolarHBondContact O-CG1 3.23Å; Q142-I146 PolarHBondContact O-N 2.88Å |
| 143 | R | 78.8 | Confident | 71.8 | Confident | 152 Ų | 152 | 116.5 Ų | 116.5 | 57% | 0.574 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -60.4 | -45.1 | 175.4 | -76.6 | -177.4 | -175.3 | -171.3 | 1 | 111.2 | V139 N140 K145 I146 Y147 | V139-R143 WeakPolarHBondContact O-CG 3.33Å; V139-R143 PolarHBondContact O-N 3.38Å; N140-R143 PolarHBondContact O-N 3.08Å; R143-K145 VanDerWaalsContact C-N 3.32Å; R143-K145 PolarHBondContact O-N 2.73Å; R143-I146 PolarHBondContact O-N 2.96Å; R143-Y147 HydrophobicContact CB-CE2 4.24Å; R143-Y147 WeakPolarHBondContact O-CD2 3.11Å; R143-Y147 PolarHBondContact O-N 2.77Å |
| 144 | R | 73.2 | Confident | 70.6 | Confident | 153 Ų | 153 | 123.6 Ų | 123.6 | 58% | 0.577 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -57.5 | -44.8 | 178.3 | -165.1 | 172.6 | 74.7 | 118.2 | 4.6 | 111.6 | N140 E141 Q142 I146 Y147 T148 | N140-R144 PolarHBondContact O-N 2.78Å; E141-R144 PolarHBondContact O-N 2.98Å; E141-R144 IonicContact OE1-CZ 3.75Å; E141-R144 IonicContact OE1-NE 3.15Å; E141-R144 PolarHBondContact OE1-NE 3.4Å; E141-R144 IonicContact OE1-NH2 3.58Å; E141-R144 PolarHBondContact OE1-NH2 3.12Å; E141-R144 IonicContact OE2-CZ 3.38Å; E141-R144 IonicContact OE2-NE 3.18Å; E141-R144 PolarHBondContact OE2-NE 2.7Å; E141-R144 VanDerWaalsContact OE2-NE 3.15Å; E141-R144 IonicContact OE2-NH2 2.73Å; Q142-R144 PolarHBondContact O-N 2.78Å; R144-I146 PolarHBondContact O-N 3Å; R144-Y147 PolarHBondContact O-N 3.35Å; R144-T148 PolarHBondContact O-N 3.18Å; R144-T148 VanDerWaalsContact O-N 3.16Å; R144-T148 PolarHBondContact O-OG1 2.73Å |
| 145 | K | 68.7 | Low | 70.4 | Confident | 145 Ų | 145 | 121.5 Ų | 121.5 | 63% | 0.63 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -58.3 | -44.6 | 175.7 | -93.8 | -164.1 | 169.2 | -162.6 | 0 | 113.5 | E141 Q142 R143 Y147 T148 D149 | E141-K145 PolarHBondContact O-N 3.45Å; Q142-K145 PolarHBondContact O-N 2.79Å; R143-K145 VanDerWaalsContact C-N 3.32Å; R143-K145 PolarHBondContact O-N 2.73Å; K145-Y147 VanDerWaalsContact C-N 3.3Å; K145-Y147 PolarHBondContact O-N 3.31Å; K145-T148 PolarHBondContact O-N 3.2Å; K145-D149 PolarHBondContact O-N 3.03Å |
| 146 | I | 66.7 | Low | 70 | Confident | 107 Ų | 107 | 119.1 Ų | 119.1 | 55% | 0.549 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -60.3 | -40 | 178.9 | -66 | 166.1 | 0 | 0 | 0 | 111.4 | Q142 R143 R144 H150 | Q142-I146 WeakPolarHBondContact O-CG1 3.23Å; Q142-I146 PolarHBondContact O-N 2.88Å; R143-I146 PolarHBondContact O-N 2.96Å; R144-I146 PolarHBondContact O-N 3Å; I146-H150 PolarHBondContact O-CD2 3.04Å |
| 147 | Y | 64.5 | Low | 69.3 | Low | 166 Ų | 166 | 119.8 Ų | 119.8 | 65% | 0.651 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72.6 | -28.1 | 179 | -66.9 | -66.2 | 0 | 0 | 0 | 113.3 | R143 R144 K145 T151 | R143-Y147 HydrophobicContact CB-CE2 4.24Å; R143-Y147 WeakPolarHBondContact O-CD2 3.11Å; R143-Y147 PolarHBondContact O-N 2.77Å; R144-Y147 PolarHBondContact O-N 3.35Å; K145-Y147 VanDerWaalsContact C-N 3.3Å; K145-Y147 PolarHBondContact O-N 3.31Å; Y147-T151 WeakPolarHBondContact O-CB 3.01Å; Y147-T151 WeakPolarHBondContact O-CG2 3.44Å; Y147-T151 PolarHBondContact O-N 3.22Å |
| 148 | T | 64.3 | Low | 68.5 | Low | 74 Ų | 74 | 123.2 Ų | 123.2 | 45% | 0.454 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -82.9 | -34.2 | -175.2 | -23.4 | 0 | 0 | 0 | 0 | 112.8 | R144 K145 I152 | R144-T148 PolarHBondContact O-N 3.18Å; R144-T148 VanDerWaalsContact O-N 3.16Å; R144-T148 PolarHBondContact O-OG1 2.73Å; K145-T148 PolarHBondContact O-N 3.2Å; T148-I152 WeakPolarHBondContact O-CD1 3.2Å |
| 149 | D | 61.2 | Low | 67.7 | Low | 120 Ų | 120 | 127.4 Ų | 127.4 | 64% | 0.642 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -79.4 | -18.4 | 179.4 | -83.3 | -16.6 | 0 | 0 | 0 | 113.5 | K145 | K145-D149 PolarHBondContact O-N 3.03Å |
| 150 | H | 61.6 | Low | 66.8 | Low | 145 Ų | 145 | 133.9 Ų | 133.9 | 67% | 0.671 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -110.4 | -0.1 | -179.4 | -62.5 | -62 | 0 | 0 | 0 | 114.7 | I146 | I146-H150 PolarHBondContact O-CD2 3.04Å |
| 151 | T | 56.7 | Low | 65.6 | Low | 101 Ų | 101 | 135.6 Ų | 135.6 | 62% | 0.62 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -94.7 | 4.5 | 174.6 | -175.3 | 0 | 0 | 0 | 0 | 113.9 | Y147 | Y147-T151 WeakPolarHBondContact O-CB 3.01Å; Y147-T151 WeakPolarHBondContact O-CG2 3.44Å; Y147-T151 PolarHBondContact O-N 3.22Å |
| 152 | I | 59.3 | Low | 64.6 | Low | 129 Ų | 129 | 139.2 Ų | 139.2 | 66% | 0.662 | 67% | 0.668 | S | S | * | * | trans | -99.7 | 13.5 | -176.4 | -64.4 | 173 | 0 | 0 | 0 | 112.1 | T148 | T148-I152 WeakPolarHBondContact O-CD1 3.2Š| ||
| 153 | L | 56.4 | Low | 63.6 | Low | 158 Ų | 158 | 139.4 Ų | 139.4 | 83% | 0.827 | 67% | 0.671 | S | S | * | * | trans | -110.4 | 63.7 | 175.2 | -77.1 | 138.3 | 0 | 0 | 0 | 111.8 | ||||
| 154 | N | 52.3 | Low | 62.3 | Low | 223 Ų | 223 | 138.3 Ų | 138.3 | 100% | 1.193 | 68% | 0.68 | S | S | * | * | trans | -157.6 | 0 | 154.4 | -173.2 | 75.4 | 0 | 0 | 0 | 109.4 |
Retrieved 154 of 154 residues in 194.2 ms
(Link to these results)