| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 40.7 | Very low | 50.9 | Low | 241 Ų | 241 | 140.3 Ų | 140.3 | 100% | 1.187 | 78% | 0.778 | S | S | * | * | 0 | 112.5 | 0 | -66.1 | 165 | 125.8 | 0 | 0 | 104.9 | |||||
| 2 | V | 50.1 | Low | 50.9 | Low | 137 Ų | 137 | 133.8 Ų | 133.8 | 83% | 0.83 | 77% | 0.767 | S | S | * | * | cis | -150.3 | 133.7 | 42.6 | -178.9 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 3 | G | 43.9 | Very low | 51.2 | Low | 73 Ų | 73 | 126.7 Ų | 126.7 | 75% | 0.753 | 74% | 0.741 | S | S | * | * | trans | -75.6 | 125.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | S5 | G3-S5 PolarHBondContact O-N 3.28Š| ||
| 4 | S | 57.6 | Low | 51.8 | Low | 106 Ų | 106 | 124.6 Ų | 124.6 | 74% | 0.741 | 72% | 0.724 | S | S | * | * | trans | -72 | 105.8 | 170.6 | -60.7 | 0 | 0 | 0 | 0 | 109.1 | W6 | S4-W6 PolarHBondContact O-N 2.71Š| ||
| 5 | S | 55.4 | Low | 52.7 | Low | 105 Ų | 105 | 124.1 Ų | 124.1 | 73% | 0.734 | 72% | 0.717 | S | S | * | * | trans | -68.3 | 111.2 | 169.4 | -178 | 0 | 0 | 0 | 0 | 108.7 | G3 C7 | G3-S5 PolarHBondContact O-N 3.28Å; S5-C7 PolarHBondContact O-N 2.84Å | ||
| 6 | W | 47.6 | Very low | 53.4 | Low | 228 Ų | 228 | 124.4 Ų | 124.4 | 86% | 0.864 | 71% | 0.71 | S | S | * | * | trans | -77.2 | 97.4 | 168.4 | -68.8 | 83 | 0 | 0 | 0 | 107.9 | S4 L8 | S4-W6 PolarHBondContact O-N 2.71Å; W6-L8 VanDerWaalsContact C-N 3.32Å; W6-L8 PolarHBondContact O-N 2.76Å | ||
| 7 | C | 57.3 | Low | 54.2 | Low | 96 Ų | 96 | 123.4 Ų | 123.4 | 65% | 0.649 | 70% | 0.701 | S | S | * | * | trans | -68.6 | 94.3 | 165.7 | -62.7 | 0 | 0 | 0 | 0 | 108.5 | S5 H9 | S5-C7 PolarHBondContact O-N 2.84Å; C7-H9 PolarHBondContact O-N 3.15Å; C7-H9 PolarHBondContact O-ND1 2.73Å; C7-H9 VanDerWaalsContact O-ND1 3.11Å | ||
| 8 | L | 48.5 | Very low | 54.9 | Low | 155 Ų | 155 | 121.4 Ų | 121.4 | 81% | 0.812 | 69% | 0.687 | S | S | * | * | trans | -53.5 | 121 | 160.8 | -86.6 | 108.4 | 0 | 0 | 0 | 107.7 | W6 P10 | W6-L8 VanDerWaalsContact C-N 3.32Å; W6-L8 PolarHBondContact O-N 2.76Å; L8-P10 VanDerWaalsContact O-CD 3.23Å; L8-P10 WeakPolarHBondContact O-CD 3.12Å | ||
| 9 | H | 50.9 | Low | 55.7 | Low | 180 Ų | 180 | 120.7 Ų | 120.7 | 83% | 0.833 | 68% | 0.677 | S | S | * | * | trans | -85 | 112.4 | 171.7 | -73.4 | 63.1 | 0 | 0 | 0 | 108.7 | C7 | C7-H9 PolarHBondContact O-N 3.15Å; C7-H9 PolarHBondContact O-ND1 2.73Å; C7-H9 VanDerWaalsContact O-ND1 3.11Å | ||
| 10 | P | 52.1 | Low | 56.4 | Low | 71 Ų | 71 | 120.3 Ų | 120.3 | 46% | 0.461 | 67% | 0.671 | S | S | . | * | trans | -121.5 | 66.1 | 176.9 | 36.1 | -15.2 | 0 | 0 | 0 | 108.9 | L8 | L8-P10 VanDerWaalsContact O-CD 3.23Å; L8-P10 WeakPolarHBondContact O-CD 3.12Å | ||
| 11 | H | 55.3 | Low | 57.1 | Low | 151 Ų | 151 | 119.4 Ų | 119.4 | 70% | 0.699 | 67% | 0.665 | S | S | * | * | trans | -130.5 | -1.6 | -174.8 | -84.4 | -62.7 | 0 | 0 | 0 | 116.5 | ||||
| 12 | G | 50.9 | Low | 58.5 | Low | 62 Ų | 62 | 111.5 Ų | 111.5 | 64% | 0.639 | 63% | 0.627 | S | S | * | * | S | Bend | trans | -87.8 | -60 | 171.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | L14 | G12-L14 PolarHBondContact O-N 2.96Š|
| 13 | G | 55.4 | Low | 59.6 | Low | 42 Ų | 42 | 110.4 Ų | 110.4 | 43% | 0.433 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -74.4 | -25.1 | -171.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | E16 I17 | G13-E16 PolarHBondContact O-N 2.92Å; G13-I17 WeakPolarHBondContact O-CD1 3.43Å; G13-I17 VanDerWaalsContact O-CG1 3.23Å; G13-I17 WeakPolarHBondContact O-CG1 3.36Å; G13-I17 PolarHBondContact O-N 3.07Å |
| 14 | L | 60.1 | Low | 60.9 | Low | 97 Ų | 97 | 112.2 Ų | 112.2 | 51% | 0.508 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -69.3 | -38.6 | -177.3 | -122.2 | 157.2 | 0 | 0 | 0 | 112.1 | G12 I17 I18 | G12-L14 PolarHBondContact O-N 2.96Å; L14-I17 PolarHBondContact O-N 3.1Å; L14-I18 HydrophobicContact CD2-CD1 4.12Å; L14-I18 WeakPolarHBondContact O-CD1 3.45Å; L14-I18 WeakPolarHBondContact O-CG1 3.39Å; L14-I18 PolarHBondContact O-N 3.23Å |
| 15 | L | 64.2 | Low | 61.7 | Low | 118 Ų | 118 | 113.7 Ų | 113.7 | 62% | 0.618 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.2 | -40.5 | 176.5 | -84.9 | 159.3 | 0 | 0 | 0 | 111.8 | I18 E19 | L15-I18 PolarHBondContact O-N 2.77Å; L15-E19 PolarHBondContact O-N 2.97Å |
| 16 | E | 64.6 | Low | 63 | Low | 128 Ų | 128 | 112.9 Ų | 112.9 | 60% | 0.598 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.3 | -40.4 | 177.5 | -166.6 | 170.3 | -165.2 | 0 | 0 | 111.5 | G13 I18 E19 M20 | G13-E16 PolarHBondContact O-N 2.92Å; E16-I18 PolarHBondContact O-N 3.44Å; E16-E19 PolarHBondContact O-N 3.29Å; E16-M20 WeakPolarHBondContact O-CB 3.38Å; E16-M20 VanDerWaalsContact O-CG 3.26Å; E16-M20 WeakPolarHBondContact O-CG 3.4Å; E16-M20 PolarHBondContact O-N 3.49Å |
| 17 | I | 67.4 | Low | 64.6 | Low | 108 Ų | 108 | 110.5 Ų | 110.5 | 55% | 0.554 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -62.7 | -42.1 | 173.8 | -67.3 | 165 | 0 | 0 | 0 | 111.1 | G13 L14 M20 N21 | G13-I17 WeakPolarHBondContact O-CD1 3.43Å; G13-I17 VanDerWaalsContact O-CG1 3.23Å; G13-I17 WeakPolarHBondContact O-CG1 3.36Å; G13-I17 PolarHBondContact O-N 3.07Å; L14-I17 PolarHBondContact O-N 3.1Å; I17-M20 PolarHBondContact O-N 3.34Å; I17-N21 WeakPolarHBondContact O-CB 3.32Å; I17-N21 PolarHBondContact O-N 2.86Å |
| 18 | I | 67.2 | Low | 65.9 | Low | 87 Ų | 87 | 111.1 Ų | 111.1 | 45% | 0.446 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.2 | -46.5 | 177.3 | -68.1 | 162.5 | 0 | 0 | 0 | 110.5 | L14 L15 E16 M20 N21 D22 | L14-I18 HydrophobicContact CD2-CD1 4.12Å; L14-I18 WeakPolarHBondContact O-CD1 3.45Å; L14-I18 WeakPolarHBondContact O-CG1 3.39Å; L14-I18 PolarHBondContact O-N 3.23Å; L15-I18 PolarHBondContact O-N 2.77Å; E16-I18 PolarHBondContact O-N 3.44Å; I18-M20 PolarHBondContact O-N 2.76Å; I18-N21 WeakPolarHBondContact O-CB 3.48Å; I18-N21 PolarHBondContact O-N 3.42Å; I18-N21 VanDerWaalsContact O-N 3.14Å; I18-D22 PolarHBondContact O-N 3.4Å |
| 19 | E | 69.2 | Low | 67.6 | Low | 108 Ų | 108 | 109 Ų | 109 | 51% | 0.505 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -63.6 | -40.5 | 178.6 | -168.4 | -171.3 | 155.6 | 0 | 0 | 112.1 | L15 E16 N21 D22 K23 | L15-E19 PolarHBondContact O-N 2.97Å; E16-E19 PolarHBondContact O-N 3.29Å; E19-N21 VanDerWaalsContact C-N 3.32Å; E19-N21 PolarHBondContact O-N 2.99Å; E19-D22 PolarHBondContact O-N 3.35Å; E19-K23 WeakPolarHBondContact O-CG 3.46Å; E19-K23 PolarHBondContact O-N 3.35Å; E19-K23 VanDerWaalsContact O-N 3.11Å; E19-K23 VanDerWaalsContact OE1-CE 3.29Å; E19-K23 WeakPolarHBondContact OE1-CE 3.27Å; E19-K23 IonicContact OE1-NZ 2.87Å; E19-K23 PolarHBondContact OE1-NZ 2.93Å |
| 20 | M | 69.1 | Low | 69.3 | Low | 113 Ų | 113 | 104.9 Ų | 104.9 | 56% | 0.557 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -63.4 | -38.7 | 174 | -71.2 | -178.4 | 82.1 | 0 | 0 | 111.5 | E16 I17 I18 K23 L24 | E16-M20 WeakPolarHBondContact O-CB 3.38Å; E16-M20 VanDerWaalsContact O-CG 3.26Å; E16-M20 WeakPolarHBondContact O-CG 3.4Å; E16-M20 PolarHBondContact O-N 3.49Å; I17-M20 PolarHBondContact O-N 3.34Å; I18-M20 PolarHBondContact O-N 2.76Å; M20-K23 PolarHBondContact O-N 2.88Å; M20-L24 VanDerWaalsContact O-CG 3.3Å; M20-L24 WeakPolarHBondContact O-CG 3.44Å; M20-L24 PolarHBondContact O-N 3.15Å |
| 21 | N | 71.1 | Confident | 71.1 | Confident | 101 Ų | 101 | 105.3 Ų | 105.3 | 54% | 0.54 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -67.5 | -42.3 | 179 | -145.4 | -53.3 | 0 | 0 | 0 | 111.9 | I17 I18 E19 K23 L24 R25 | I17-N21 WeakPolarHBondContact O-CB 3.32Å; I17-N21 PolarHBondContact O-N 2.86Å; I18-N21 WeakPolarHBondContact O-CB 3.48Å; I18-N21 PolarHBondContact O-N 3.42Å; I18-N21 VanDerWaalsContact O-N 3.14Å; E19-N21 VanDerWaalsContact C-N 3.32Å; E19-N21 PolarHBondContact O-N 2.99Å; N21-K23 VanDerWaalsContact C-N 3.32Å; N21-K23 PolarHBondContact O-N 3.17Å; N21-L24 PolarHBondContact O-N 2.95Å; N21-R25 WeakPolarHBondContact O-CB 3.39Å; N21-R25 PolarHBondContact O-N 3.04Å |
| 22 | D | 69.8 | Low | 72.7 | Confident | 75 Ų | 75 | 102 Ų | 102 | 40% | 0.401 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.4 | -38.7 | 174.7 | -78.7 | -30.8 | 0 | 0 | 0 | 112.1 | I18 E19 R25 N26 | I18-D22 PolarHBondContact O-N 3.4Å; E19-D22 PolarHBondContact O-N 3.35Å; D22-R25 PolarHBondContact O-N 2.87Å; D22-R25 IonicContact OD1-CZ 3.58Å; D22-R25 IonicContact OD1-NH1 2.75Å; D22-R25 PolarHBondContact OD1-NH1 2.79Å; D22-R25 IonicContact OD1-NH2 3.72Å; D22-N26 WeakPolarHBondContact O-CB 3.41Å; D22-N26 PolarHBondContact O-N 3.48Å |
| 23 | K | 74.5 | Confident | 74.5 | Confident | 115 Ų | 115 | 101 Ų | 101 | 50% | 0.5 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65 | -39.6 | 173.5 | -74.8 | 171.9 | -176.3 | 167.7 | 0 | 112.3 | E19 M20 N21 R27 | E19-K23 WeakPolarHBondContact O-CG 3.46Å; E19-K23 PolarHBondContact O-N 3.35Å; E19-K23 VanDerWaalsContact O-N 3.11Å; E19-K23 VanDerWaalsContact OE1-CE 3.29Å; E19-K23 WeakPolarHBondContact OE1-CE 3.27Å; E19-K23 IonicContact OE1-NZ 2.87Å; E19-K23 PolarHBondContact OE1-NZ 2.93Å; M20-K23 PolarHBondContact O-N 2.88Å; N21-K23 VanDerWaalsContact C-N 3.32Å; N21-K23 PolarHBondContact O-N 3.17Å; K23-R27 WeakPolarHBondContact O-CG 3.36Å; K23-R27 PolarHBondContact O-N 3.08Å; K23-R27 VanDerWaalsContact O-N 3.09Å |
| 24 | L | 70.8 | Confident | 76.1 | Confident | 111 Ų | 111 | 103.9 Ų | 103.9 | 58% | 0.581 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -69.5 | -41.3 | 177.2 | -71.7 | 173.2 | 0 | 0 | 0 | 111.7 | M20 N21 N26 R27 Q28 | M20-L24 VanDerWaalsContact O-CG 3.3Å; M20-L24 WeakPolarHBondContact O-CG 3.44Å; M20-L24 PolarHBondContact O-N 3.15Å; N21-L24 PolarHBondContact O-N 2.95Å; L24-N26 VanDerWaalsContact C-N 3.34Å; L24-N26 PolarHBondContact O-N 2.75Å; L24-R27 PolarHBondContact O-N 3.44Å; L24-Q28 PolarHBondContact O-N 2.91Å |
| 25 | R | 74.7 | Confident | 77.4 | Confident | 137 Ų | 137 | 103.4 Ų | 103.4 | 52% | 0.517 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59 | -46.4 | 175.3 | -165.1 | -178.7 | 74.5 | -122.6 | -1.6 | 111.1 | N21 D22 R27 Q28 E29 | N21-R25 WeakPolarHBondContact O-CB 3.39Å; N21-R25 PolarHBondContact O-N 3.04Å; D22-R25 PolarHBondContact O-N 2.87Å; D22-R25 IonicContact OD1-CZ 3.58Å; D22-R25 IonicContact OD1-NH1 2.75Å; D22-R25 PolarHBondContact OD1-NH1 2.79Å; D22-R25 IonicContact OD1-NH2 3.72Å; R25-R27 PolarHBondContact O-N 3.01Å; R25-Q28 PolarHBondContact O-N 3.39Å; R25-E29 WeakPolarHBondContact CG-OE1 3.31Å; R25-E29 IonicContact NE-OE1 3.41Å; R25-E29 PolarHBondContact NE-OE1 3.17Å; R25-E29 WeakPolarHBondContact O-CG 3.33Å; R25-E29 PolarHBondContact O-N 3.43Å |
| 26 | N | 81.4 | Confident | 78.4 | Confident | 87 Ų | 87 | 101.9 Ų | 101.9 | 47% | 0.465 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.1 | -44.1 | 175.5 | -173.3 | -14 | 0 | 0 | 0 | 112.1 | D22 L24 Q28 E29 I30 | D22-N26 WeakPolarHBondContact O-CB 3.41Å; D22-N26 PolarHBondContact O-N 3.48Å; L24-N26 VanDerWaalsContact C-N 3.34Å; L24-N26 PolarHBondContact O-N 2.75Å; N26-Q28 VanDerWaalsContact C-N 3.33Å; N26-Q28 PolarHBondContact O-N 3.35Å; N26-E29 PolarHBondContact O-N 2.93Å; N26-I30 VanDerWaalsContact O-CG1 3.31Å; N26-I30 WeakPolarHBondContact O-CG1 3.43Å; N26-I30 PolarHBondContact O-N 3Å; N26-I30 VanDerWaalsContact OD1-CD1 3.27Å; N26-I30 WeakPolarHBondContact OD1-CD1 3.43Å |
| 27 | R | 82 | Confident | 79.4 | Confident | 178 Ų | 178 | 101.4 Ų | 101.4 | 67% | 0.672 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.5 | -42.7 | 175 | -76.5 | 178.2 | -178 | -89.4 | 1 | 112.4 | K23 L24 R25 I30 V31 | K23-R27 WeakPolarHBondContact O-CG 3.36Å; K23-R27 PolarHBondContact O-N 3.08Å; K23-R27 VanDerWaalsContact O-N 3.09Å; L24-R27 PolarHBondContact O-N 3.44Å; R25-R27 PolarHBondContact O-N 3.01Å; R27-I30 PolarHBondContact O-N 3.42Å; R27-V31 VanDerWaalsContact O-CG2 3.31Å; R27-V31 WeakPolarHBondContact O-CG2 3.41Å; R27-V31 PolarHBondContact O-N 3.32Å |
| 28 | Q | 84.8 | Confident | 80.1 | Confident | 109 Ų | 109 | 100.8 Ų | 100.8 | 51% | 0.509 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67 | -40.4 | 179.3 | -168.5 | 63.1 | 48.7 | 0 | 0 | 111.8 | L24 R25 N26 I30 V31 N32 | L24-Q28 PolarHBondContact O-N 2.91Å; R25-Q28 PolarHBondContact O-N 3.39Å; N26-Q28 VanDerWaalsContact C-N 3.33Å; N26-Q28 PolarHBondContact O-N 3.35Å; Q28-I30 VanDerWaalsContact C-N 3.33Å; Q28-I30 PolarHBondContact O-N 3.29Å; Q28-V31 PolarHBondContact O-N 3.03Å; Q28-N32 PolarHBondContact NE2-OD1 2.73Å; Q28-N32 WeakPolarHBondContact O-CB 3.43Å; Q28-N32 PolarHBondContact O-N 3.06Å; Q28-N32 PolarHBondContact O-OD1 3.13Å |
| 29 | E | 85.2 | Confident | 80.7 | Confident | 111 Ų | 111 | 102 Ų | 102 | 52% | 0.519 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.1 | -42.6 | 174.6 | -72.2 | 169.2 | -162.8 | 0 | 0 | 111.4 | R25 N26 G33 | R25-E29 WeakPolarHBondContact CG-OE1 3.31Å; R25-E29 IonicContact NE-OE1 3.41Å; R25-E29 PolarHBondContact NE-OE1 3.17Å; R25-E29 WeakPolarHBondContact O-CG 3.33Å; R25-E29 PolarHBondContact O-N 3.43Å; N26-E29 PolarHBondContact O-N 2.93Å; E29-G33 PolarHBondContact O-N 3.47Å |
| 30 | I | 85.2 | Confident | 81.1 | Confident | 93 Ų | 93 | 103.6 Ų | 103.6 | 48% | 0.477 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.6 | -47.4 | 175.5 | -66.5 | 165.7 | 0 | 0 | 0 | 111.2 | N26 R27 Q28 N32 G33 L34 | N26-I30 VanDerWaalsContact O-CG1 3.31Å; N26-I30 WeakPolarHBondContact O-CG1 3.43Å; N26-I30 PolarHBondContact O-N 3Å; N26-I30 VanDerWaalsContact OD1-CD1 3.27Å; N26-I30 WeakPolarHBondContact OD1-CD1 3.43Å; R27-I30 PolarHBondContact O-N 3.42Å; Q28-I30 VanDerWaalsContact C-N 3.33Å; Q28-I30 PolarHBondContact O-N 3.29Å; I30-N32 VanDerWaalsContact C-N 3.34Å; I30-N32 PolarHBondContact O-N 3.38Å; I30-G33 PolarHBondContact O-N 2.83Å; I30-L34 HydrophobicContact CG2-CD1 4.1Å; I30-L34 HydrophobicContact CG2-CG 4.49Å; I30-L34 WeakPolarHBondContact O-CG 3.34Å; I30-L34 PolarHBondContact O-N 3.37Å |
| 31 | V | 89.5 | Confident | 81.1 | Confident | 80 Ų | 80 | 101.8 Ų | 101.8 | 49% | 0.485 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 179.8 | 169.8 | 0 | 0 | 0 | 0 | 110.7 | R27 Q28 G33 L34 N35 | R27-V31 VanDerWaalsContact O-CG2 3.31Å; R27-V31 WeakPolarHBondContact O-CG2 3.41Å; R27-V31 PolarHBondContact O-N 3.32Å; Q28-V31 PolarHBondContact O-N 3.03Å; V31-G33 PolarHBondContact O-N 3Å; V31-L34 PolarHBondContact O-N 3.22Å; V31-N35 PolarHBondContact O-N 3.46Å |
| 32 | N | 89.2 | Confident | 80.5 | Confident | 82 Ų | 82 | 103.6 Ų | 103.6 | 44% | 0.439 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 177.1 | -69.3 | 1.6 | 0 | 0 | 0 | 111.5 | Q28 I30 L34 N35 I36 | Q28-N32 PolarHBondContact NE2-OD1 2.73Å; Q28-N32 WeakPolarHBondContact O-CB 3.43Å; Q28-N32 PolarHBondContact O-N 3.06Å; Q28-N32 PolarHBondContact O-OD1 3.13Å; I30-N32 VanDerWaalsContact C-N 3.34Å; I30-N32 PolarHBondContact O-N 3.38Å; N32-L34 VanDerWaalsContact C-N 3.34Å; N32-L34 PolarHBondContact O-N 3.36Å; N32-N35 PolarHBondContact O-N 2.8Å; N32-I36 VanDerWaalsContact O-CG1 3.31Å; N32-I36 WeakPolarHBondContact O-CG1 3.44Å; N32-I36 PolarHBondContact O-N 3.04Å |
| 33 | G | 88.9 | Confident | 79.8 | Confident | 40 Ų | 40 | 108.1 Ų | 108.1 | 41% | 0.412 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.4 | -37.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | E29 I30 V31 F37 | E29-G33 PolarHBondContact O-N 3.47Å; I30-G33 PolarHBondContact O-N 2.83Å; V31-G33 PolarHBondContact O-N 3Å; G33-F37 WeakPolarHBondContact O-CB 3.43Å; G33-F37 PolarHBondContact O-N 3.2Å |
| 34 | L | 88.8 | Confident | 78.8 | Confident | 104 Ų | 104 | 111.2 Ų | 111.2 | 55% | 0.545 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -68.4 | -38.7 | 174.4 | -70.9 | 173.3 | 0 | 0 | 0 | 112.2 | I30 V31 N32 F37 L38 | I30-L34 HydrophobicContact CG2-CD1 4.1Å; I30-L34 HydrophobicContact CG2-CG 4.49Å; I30-L34 WeakPolarHBondContact O-CG 3.34Å; I30-L34 PolarHBondContact O-N 3.37Å; V31-L34 PolarHBondContact O-N 3.22Å; N32-L34 VanDerWaalsContact C-N 3.34Å; N32-L34 PolarHBondContact O-N 3.36Å; L34-F37 PolarHBondContact O-N 3.15Å; L34-L38 WeakPolarHBondContact O-CG 3.38Å; L34-L38 PolarHBondContact O-N 3.03Å |
| 35 | N | 87.5 | Confident | 77.8 | Confident | 87 Ų | 87 | 109.4 Ų | 109.4 | 47% | 0.465 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -65.8 | -43.9 | 178 | -145.5 | 67.1 | 0 | 0 | 0 | 111.3 | V31 N32 F37 L38 E39 | V31-N35 PolarHBondContact O-N 3.46Å; N32-N35 PolarHBondContact O-N 2.8Å; N35-F37 VanDerWaalsContact C-N 3.33Å; N35-F37 PolarHBondContact O-N 3.38Å; N35-L38 PolarHBondContact O-N 2.84Å; N35-E39 PolarHBondContact ND2-OE1 3.4Å; N35-E39 WeakPolarHBondContact O-CG 3.4Å; N35-E39 PolarHBondContact O-N 2.88Å |
| 36 | I | 86.8 | Confident | 76.4 | Confident | 85 Ų | 85 | 113.7 Ų | 113.7 | 44% | 0.436 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -59.6 | -45 | 174 | -67.2 | 164.1 | 0 | 0 | 0 | 110.5 | N32 L38 E39 E40 | N32-I36 VanDerWaalsContact O-CG1 3.31Å; N32-I36 WeakPolarHBondContact O-CG1 3.44Å; N32-I36 PolarHBondContact O-N 3.04Å; I36-L38 VanDerWaalsContact C-N 3.3Å; I36-L38 PolarHBondContact O-N 3.26Å; I36-E39 PolarHBondContact O-N 2.96Å; I36-E40 HydrophobicContact CG2-CG 4.14Å; I36-E40 WeakPolarHBondContact CG2-OE1 3.42Å; I36-E40 WeakPolarHBondContact O-CB 3.24Å; I36-E40 VanDerWaalsContact O-CG 3.32Å; I36-E40 WeakPolarHBondContact O-CG 3.38Å; I36-E40 PolarHBondContact O-N 2.92Å |
| 37 | F | 84.2 | Confident | 74.9 | Confident | 119 Ų | 119 | 117.5 Ų | 117.5 | 52% | 0.522 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -60.1 | -40 | 177.3 | 178.9 | -94.7 | 0 | 0 | 0 | 112.1 | G33 L34 N35 N41 | G33-F37 WeakPolarHBondContact O-CB 3.43Å; G33-F37 PolarHBondContact O-N 3.2Å; L34-F37 PolarHBondContact O-N 3.15Å; N35-F37 VanDerWaalsContact C-N 3.33Å; N35-F37 PolarHBondContact O-N 3.38Å; F37-N41 WeakPolarHBondContact O-CB 3.4Å; F37-N41 PolarHBondContact O-N 3.42Å; F37-N41 PolarHBondContact O-ND2 3.07Å |
| 38 | L | 83.1 | Confident | 73.2 | Confident | 94 Ų | 94 | 117.3 Ų | 117.3 | 49% | 0.492 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -67.2 | -46 | 175.6 | -71.3 | 170.5 | 0 | 0 | 0 | 111.5 | L34 N35 I36 E40 N41 E42 | L34-L38 WeakPolarHBondContact O-CG 3.38Å; L34-L38 PolarHBondContact O-N 3.03Å; N35-L38 PolarHBondContact O-N 2.84Å; I36-L38 VanDerWaalsContact C-N 3.3Å; I36-L38 PolarHBondContact O-N 3.26Å; L38-E40 VanDerWaalsContact C-N 3.33Å; L38-E40 PolarHBondContact O-N 2.91Å; L38-N41 CarbonylContact O-C 3.29Å; L38-N41 PolarHBondContact O-N 3.35Å; L38-N41 VanDerWaalsContact O-N 3.15Å; L38-E42 WeakPolarHBondContact O-CB 3.42Å; L38-E42 WeakPolarHBondContact O-CG 3.47Å; L38-E42 PolarHBondContact O-N 3.41Å |
| 39 | E | 79.6 | Confident | 71.5 | Confident | 113 Ų | 113 | 120.8 Ų | 120.8 | 53% | 0.528 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -59.8 | -41.5 | 176.8 | -73.6 | 169.6 | -155.7 | 0 | 0 | 112 | N35 I36 N41 | N35-E39 PolarHBondContact ND2-OE1 3.4Å; N35-E39 WeakPolarHBondContact O-CG 3.4Å; N35-E39 PolarHBondContact O-N 2.88Å; I36-E39 PolarHBondContact O-N 2.96Å; E39-N41 VanDerWaalsContact C-N 3.28Å; E39-N41 PolarHBondContact O-N 3.23Å |
| 40 | E | 77.5 | Confident | 69.7 | Low | 141 Ų | 141 | 123.8 Ų | 123.8 | 66% | 0.659 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -68.6 | -23.3 | 178 | -74.6 | 177.4 | 175.1 | 0 | 0 | 113.4 | I36 L38 | I36-E40 HydrophobicContact CG2-CG 4.14Å; I36-E40 WeakPolarHBondContact CG2-OE1 3.42Å; I36-E40 WeakPolarHBondContact O-CB 3.24Å; I36-E40 VanDerWaalsContact O-CG 3.32Å; I36-E40 WeakPolarHBondContact O-CG 3.38Å; I36-E40 PolarHBondContact O-N 2.92Å; L38-E40 VanDerWaalsContact C-N 3.33Å; L38-E40 PolarHBondContact O-N 2.91Å |
| 41 | N | 68.9 | Low | 67.8 | Low | 75 Ų | 75 | 127.1 Ų | 127.1 | 40% | 0.401 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -108.3 | -11.4 | -177.4 | -70.8 | -98.6 | 0 | 0 | 0 | 113.3 | F37 L38 E39 E43 E44 | F37-N41 WeakPolarHBondContact O-CB 3.4Å; F37-N41 PolarHBondContact O-N 3.42Å; F37-N41 PolarHBondContact O-ND2 3.07Å; L38-N41 CarbonylContact O-C 3.29Å; L38-N41 PolarHBondContact O-N 3.35Å; L38-N41 VanDerWaalsContact O-N 3.15Å; E39-N41 VanDerWaalsContact C-N 3.28Å; E39-N41 PolarHBondContact O-N 3.23Å; N41-E43 PolarHBondContact O-N 3.45Å; N41-E44 PolarHBondContact O-N 3.47Å |
| 42 | E | 59.3 | Low | 65.7 | Low | 140 Ų | 140 | 131.4 Ų | 131.4 | 65% | 0.654 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -68.9 | -21.2 | 176.8 | -94.6 | -178.4 | 175.5 | 0 | 0 | 112.5 | L38 E44 | L38-E42 WeakPolarHBondContact O-CB 3.42Å; L38-E42 WeakPolarHBondContact O-CG 3.47Å; L38-E42 PolarHBondContact O-N 3.41Å; E42-E44 VanDerWaalsContact C-N 3.31Å; E42-E44 PolarHBondContact O-N 3.19Å |
| 43 | E | 54.8 | Low | 63.7 | Low | 170 Ų | 170 | 136.6 Ų | 136.6 | 79% | 0.794 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.2 | -8.6 | 177.1 | -66.1 | -169.1 | 174.4 | 0 | 0 | 114.3 | N41 | N41-E43 PolarHBondContact O-N 3.45Š|
| 44 | E | 52.1 | Low | 61.8 | Low | 179 Ų | 179 | 140.8 Ų | 140.8 | 84% | 0.836 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.1 | 5.8 | 175.4 | -74.9 | -168.5 | 174.1 | 0 | 0 | 114.2 | N41 E42 | N41-E44 PolarHBondContact O-N 3.47Å; E42-E44 VanDerWaalsContact C-N 3.31Å; E42-E44 PolarHBondContact O-N 3.19Å |
| 45 | A | 49.6 | Very low | 59.9 | Low | 74 Ų | 74 | 142.4 Ų | 142.4 | 61% | 0.612 | 71% | 0.706 | S | S | * | * | trans | -103 | 47.5 | -180 | 0 | 0 | 0 | 0 | 0 | 113.5 | L47 | A45-L47 PolarHBondContact O-N 3.17Š| ||
| 46 | Y | 46.4 | Very low | 58.1 | Low | 226 Ų | 226 | 145.4 Ų | 145.4 | 89% | 0.886 | 72% | 0.719 | S | S | * | * | trans | -76.5 | 79.4 | 159.2 | -85.5 | -87.5 | 0 | 0 | 0 | 108.8 | E48 | Y46-E48 VanDerWaalsContact C-N 3.34Å; Y46-E48 PolarHBondContact O-N 2.93Å | ||
| 47 | L | 50.3 | Low | 56.1 | Low | 167 Ų | 167 | 151.5 Ų | 151.5 | 87% | 0.874 | 74% | 0.742 | S | S | * | * | trans | -76.3 | 87.6 | 173.5 | -156.1 | 97 | 0 | 0 | 0 | 108.2 | A45 E49 | A45-L47 PolarHBondContact O-N 3.17Å; L47-E49 PolarHBondContact O-N 3.47Å | ||
| 48 | E | 46.7 | Very low | 54.6 | Low | 175 Ų | 175 | 155.1 Ų | 155.1 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | trans | -53.8 | 123.9 | 173.2 | -168 | 163.8 | -160.4 | 0 | 0 | 110 | Y46 L50 | Y46-E48 VanDerWaalsContact C-N 3.34Å; Y46-E48 PolarHBondContact O-N 2.93Å; E48-L50 PolarHBondContact O-N 3.14Å | ||
| 49 | E | 47.1 | Very low | 53 | Low | 181 Ų | 181 | 160 Ų | 160 | 85% | 0.846 | 78% | 0.781 | S | S | * | * | trans | -50.2 | 104 | 175.3 | -73.1 | 167.9 | 150.8 | 0 | 0 | 110.3 | L47 | L47-E49 PolarHBondContact O-N 3.47Š| ||
| 50 | L | 48.8 | Very low | 51.6 | Low | 174 Ų | 174 | 163.3 Ų | 163.3 | 91% | 0.911 | 80% | 0.797 | S | S | * | * | trans | -113.5 | 59.4 | 168.2 | -144.8 | 101.5 | 0 | 0 | 0 | 108.9 | E48 | E48-L50 PolarHBondContact O-N 3.14Š| ||
| 51 | E | 45 | Very low | 50.1 | Low | 163 Ų | 163 | 165.7 Ų | 165.7 | 76% | 0.762 | 81% | 0.808 | S | S | * | * | trans | -80.1 | 129 | 165.5 | -88.2 | -178.8 | 170.1 | 0 | 0 | 109.5 | ||||
| 52 | E | 44.9 | Very low | 49.2 | Very low | 171 Ų | 171 | 168.6 Ų | 168.6 | 80% | 0.799 | 83% | 0.828 | S | S | * | * | trans | 67.2 | 83.1 | 146.1 | -61.1 | -178.5 | 165.7 | 0 | 0 | 119.2 | ||||
| 53 | E | 47.4 | Very low | 48.7 | Very low | 191 Ų | 191 | 171.1 Ų | 171.1 | 89% | 0.893 | 84% | 0.84 | S | S | * | * | trans | -158 | 71.2 | 143.2 | -161.2 | 99.8 | -134.2 | 0 | 0 | 109.4 | ||||
| 54 | S | 48.2 | Very low | 48.2 | Very low | 128 Ų | 128 | 167 Ų | 167 | 90% | 0.895 | 84% | 0.835 | S | S | * | * | trans | -121.1 | 65.5 | 167.4 | 67 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 55 | D | 48.7 | Very low | 48.4 | Very low | 138 Ų | 138 | 166.9 Ų | 166.9 | 74% | 0.738 | 84% | 0.839 | S | S | * | * | trans | -116 | 143.8 | 166.6 | -161.8 | 6.5 | 0 | 0 | 0 | 108.6 | ||||
| 56 | M | 50.5 | Low | 48.4 | Very low | 149 Ų | 149 | 170.4 Ų | 170.4 | 73% | 0.734 | 85% | 0.848 | S | S | * | * | trans | 72.4 | 87.7 | 156.8 | -163 | 178.7 | 52.2 | 0 | 0 | 116.8 | ||||
| 57 | F | 45.5 | Very low | 49 | Very low | 213 Ų | 213 | 168.3 Ų | 168.3 | 93% | 0.934 | 85% | 0.846 | S | S | * | * | trans | -158.7 | 101.8 | 134 | -104.9 | -74.2 | 0 | 0 | 0 | 109.9 | ||||
| 58 | E | 53 | Low | 48.9 | Very low | 195 Ų | 195 | 168.1 Ų | 168.1 | 91% | 0.911 | 85% | 0.846 | S | S | * | * | trans | -70.1 | 158.7 | 169.7 | -74.2 | -163.3 | 159 | 0 | 0 | 111.9 | ||||
| 59 | E | 48.4 | Very low | 48.9 | Very low | 198 Ų | 198 | 163.1 Ų | 163.1 | 93% | 0.925 | 84% | 0.842 | S | S | * | * | trans | -53.7 | 138.5 | -177 | -66.1 | 169.1 | 140.2 | 0 | 0 | 114.8 | ||||
| 60 | E | 50.3 | Low | 48.9 | Very low | 182 Ų | 182 | 159.9 Ų | 159.9 | 85% | 0.85 | 84% | 0.839 | S | S | * | * | trans | -144.6 | 113.5 | 147.6 | -163.1 | 166.4 | -163.3 | 0 | 0 | 109.9 | ||||
| 61 | E | 46 | Very low | 49.3 | Very low | 190 Ų | 190 | 161 Ų | 161 | 89% | 0.888 | 84% | 0.836 | S | S | * | * | trans | -61.1 | 129.9 | 170 | -79.6 | -179.7 | 135.7 | 0 | 0 | 110.3 | ||||
| 62 | T | 50.1 | Low | 49.5 | Very low | 136 Ų | 136 | 162.3 Ų | 162.3 | 83% | 0.834 | 84% | 0.842 | S | S | * | * | trans | -137.4 | 133.4 | 156.3 | 41.7 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 63 | E | 48.9 | Very low | 50 | Low | 194 Ų | 194 | 157.7 Ų | 157.7 | 91% | 0.907 | 83% | 0.834 | S | S | * | * | trans | -75.2 | 143.5 | -170.5 | -64.2 | 175.3 | 142.5 | 0 | 0 | 114 | ||||
| 64 | A | 44 | Very low | 50.2 | Low | 82 Ų | 82 | 157 Ų | 157 | 68% | 0.678 | 83% | 0.83 | S | S | * | * | trans | 10.6 | 125.4 | 152.7 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 65 | L | 56.5 | Low | 50.6 | Low | 177 Ų | 177 | 157.5 Ų | 157.5 | 93% | 0.927 | 82% | 0.823 | S | S | * | * | trans | -139.5 | 138.8 | 139.3 | -76.7 | 179.7 | 0 | 0 | 0 | 111.2 | ||||
| 66 | N | 49.5 | Very low | 51 | Low | 148 Ų | 148 | 158.6 Ų | 158.6 | 79% | 0.791 | 83% | 0.829 | S | S | * | * | trans | -85.1 | 172 | -166.9 | -59.6 | -42.4 | 0 | 0 | 0 | 114 | ||||
| 67 | E | 58.9 | Low | 51.2 | Low | 183 Ų | 183 | 156.4 Ų | 156.4 | 86% | 0.855 | 82% | 0.823 | S | S | * | * | trans | 101.8 | 98.8 | 140.3 | -150.3 | 161.6 | -169.3 | 0 | 0 | 118.4 | ||||
| 68 | D | 47.8 | Very low | 52 | Low | 162 Ų | 162 | 157.8 Ų | 157.8 | 87% | 0.866 | 82% | 0.822 | S | S | * | * | trans | 48.6 | 112.6 | 131.5 | -141.7 | 4.6 | 0 | 0 | 0 | 119.6 | ||||
| 69 | G | 48.1 | Very low | 52.4 | Low | 71 Ų | 71 | 153 Ų | 153 | 73% | 0.732 | 81% | 0.807 | S | S | * | * | trans | -176.4 | 84.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | K71 | G69-K71 PolarHBondContact O-N 3.38Š| ||
| 70 | S | 45.6 | Very low | 53 | Low | 113 Ų | 113 | 149.3 Ų | 149.3 | 79% | 0.79 | 80% | 0.803 | S | S | * | * | trans | -45.6 | 118.1 | 176 | 68.4 | 0 | 0 | 0 | 0 | 114 | ||||
| 71 | K | 57.7 | Low | 53.7 | Low | 197 Ų | 197 | 148.2 Ų | 148.2 | 86% | 0.857 | 80% | 0.797 | S | S | * | * | trans | -149.3 | 111 | 146.4 | -65.8 | -168.8 | 179.9 | 163.9 | 0 | 108.4 | G69 A73 | G69-K71 PolarHBondContact O-N 3.38Å; K71-A73 PolarHBondContact O-N 3Å | ||
| 72 | E | 48.7 | Very low | 54.7 | Low | 190 Ų | 190 | 149 Ų | 149 | 89% | 0.888 | 80% | 0.798 | S | S | * | * | trans | -67.4 | 81.1 | 177.2 | -166.2 | 166.8 | -165.3 | 0 | 0 | 109.4 | ||||
| 73 | A | 56.5 | Low | 55.5 | Low | 75 Ų | 75 | 148.6 Ų | 148.6 | 62% | 0.62 | 80% | 0.795 | S | S | * | * | trans | -94.6 | 122.6 | 166.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | K71 N75 | K71-A73 PolarHBondContact O-N 3Å; A73-N75 PolarHBondContact O-N 2.98Å | ||
| 74 | H | 52 | Low | 56.5 | Low | 175 Ų | 175 | 144.6 Ų | 144.6 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | trans | -63.5 | 82.1 | 175.8 | -63.5 | -67 | 0 | 0 | 0 | 110.3 | N76 | H74-N76 PolarHBondContact O-N 3.32Å; H74-N76 VanDerWaalsContact O-N 3.15Å | ||
| 75 | N | 55.2 | Low | 57.8 | Low | 139 Ų | 139 | 148.6 Ų | 148.6 | 74% | 0.743 | 80% | 0.798 | S | S | * | * | trans | -76.1 | 100 | 172 | -117.3 | -22.5 | 0 | 0 | 0 | 106.7 | A73 V77 | A73-N75 PolarHBondContact O-N 2.98Å; N75-V77 HydrophobicContact CB-CG2 4.09Å; N75-V77 PolarHBondContact O-N 3.46Å | ||
| 76 | N | 57.6 | Low | 58.5 | Low | 161 Ų | 161 | 149 Ų | 149 | 86% | 0.861 | 79% | 0.787 | S | S | * | * | trans | -66 | 70.2 | 162.4 | -86.5 | -30.1 | 0 | 0 | 0 | 108.1 | H74 R78 | H74-N76 PolarHBondContact O-N 3.32Å; H74-N76 VanDerWaalsContact O-N 3.15Å; N76-R78 PolarHBondContact O-N 3.28Å | ||
| 77 | V | 55.3 | Low | 59.5 | Low | 103 Ų | 103 | 145.6 Ų | 145.6 | 62% | 0.624 | 78% | 0.775 | S | S | * | * | trans | -63 | 106.7 | 167.1 | 179.9 | 0 | 0 | 0 | 0 | 105.1 | N75 T79 | N75-V77 HydrophobicContact CB-CG2 4.09Å; N75-V77 PolarHBondContact O-N 3.46Å; V77-T79 HydrophobicContact CG1-CG2 4.04Å; V77-T79 PolarHBondContact O-N 3.47Å | ||
| 78 | R | 61.2 | Low | 60.1 | Low | 242 Ų | 242 | 142 Ų | 142 | 91% | 0.913 | 76% | 0.76 | S | S | * | * | trans | -67.4 | 75.5 | 173.6 | -162.9 | 175.7 | -174 | 153.1 | -0.4 | 107.1 | N76 S80 | N76-R78 PolarHBondContact O-N 3.28Å; R78-S80 PolarHBondContact O-N 2.98Å | ||
| 79 | T | 62.6 | Low | 61.6 | Low | 96 Ų | 96 | 138.3 Ų | 138.3 | 59% | 0.589 | 75% | 0.752 | S | S | * | * | trans | -61.2 | 114.7 | 172.6 | 56.4 | 0 | 0 | 0 | 0 | 106.3 | V77 H81 | V77-T79 HydrophobicContact CG1-CG2 4.04Å; V77-T79 PolarHBondContact O-N 3.47Å; T79-H81 PolarHBondContact O-N 3.41Å | ||
| 80 | S | 61.3 | Low | 63.3 | Low | 119 Ų | 119 | 139.1 Ų | 139.1 | 83% | 0.832 | 75% | 0.747 | S | S | * | * | trans | -69.7 | 64.5 | 169.6 | 33.7 | 0 | 0 | 0 | 0 | 108.9 | R78 K82 | R78-S80 PolarHBondContact O-N 2.98Å; S80-K82 PolarHBondContact O-N 2.98Å; S80-K82 VanDerWaalsContact O-N 3.08Å | ||
| 81 | H | 63.9 | Low | 65.2 | Low | 159 Ų | 159 | 135 Ų | 135 | 74% | 0.736 | 72% | 0.715 | S | S | * | * | trans | -65.4 | 111 | 170.7 | -120.5 | 62.6 | 0 | 0 | 0 | 106.9 | T79 V83 | T79-H81 PolarHBondContact O-N 3.41Å; H81-V83 PolarHBondContact O-N 3.27Å | ||
| 82 | K | 67.7 | Low | 66.7 | Low | 206 Ų | 206 | 129.4 Ų | 129.4 | 90% | 0.896 | 70% | 0.697 | S | S | * | * | trans | -55.9 | 105.1 | 175.4 | -68.9 | 179.6 | 178.3 | 178.1 | 0 | 108.3 | S80 S84 | S80-K82 PolarHBondContact O-N 2.98Å; S80-K82 VanDerWaalsContact O-N 3.08Å; K82-S84 PolarHBondContact O-N 3.49Å | ||
| 83 | V | 66.5 | Low | 68.6 | Low | 129 Ų | 129 | 126.6 Ų | 126.6 | 78% | 0.782 | 69% | 0.689 | S | S | * | * | trans | -71.1 | 111.4 | 175.5 | -145.4 | 0 | 0 | 0 | 0 | 107.1 | H81 L85 | H81-V83 PolarHBondContact O-N 3.27Å; V83-L85 PolarHBondContact O-N 3.01Å; V83-L85 VanDerWaalsContact O-N 3.14Å | ||
| 84 | S | 69.3 | Low | 70.2 | Confident | 109 Ų | 109 | 128.5 Ų | 128.5 | 76% | 0.762 | 69% | 0.685 | S | S | * | * | trans | -68.5 | 109.8 | 173.9 | -178.3 | 0 | 0 | 0 | 0 | 108.8 | K82 R86 | K82-S84 PolarHBondContact O-N 3.49Å; S84-R86 VanDerWaalsContact C-N 3.26Å; S84-R86 PolarHBondContact O-N 2.9Å | ||
| 85 | L | 70.8 | Confident | 72 | Confident | 167 Ų | 167 | 123.6 Ų | 123.6 | 87% | 0.874 | 66% | 0.662 | S | S | * | * | trans | -73.6 | 82.4 | 171.7 | -64.5 | -180 | 0 | 0 | 0 | 109 | V83 S87 | V83-L85 PolarHBondContact O-N 3.01Å; V83-L85 VanDerWaalsContact O-N 3.14Å; L85-S87 PolarHBondContact O-N 2.84Å | ||
| 86 | R | 72.1 | Confident | 73.6 | Confident | 184 Ų | 184 | 121.1 Ų | 121.1 | 69% | 0.694 | 64% | 0.642 | S | S | * | * | trans | -70.8 | 115.1 | 169.1 | -161.9 | 168.4 | -176.6 | 166.7 | -3.7 | 107.8 | S84 I88 | S84-R86 VanDerWaalsContact C-N 3.26Å; S84-R86 PolarHBondContact O-N 2.9Å; R86-I88 PolarHBondContact O-N 2.92Å | ||
| 87 | S | 70.2 | Confident | 75 | Confident | 78 Ų | 78 | 115.7 Ų | 115.7 | 55% | 0.545 | 61% | 0.611 | S | S | . | * | trans | -62.1 | 122.9 | -177.8 | -171.1 | 0 | 0 | 0 | 0 | 110.7 | L85 A89 S90 | L85-S87 PolarHBondContact O-N 2.84Å; S87-A89 PolarHBondContact O-N 2.87Å; S87-A89 VanDerWaalsContact O-N 3.13Å; S87-S90 PolarHBondContact O-N 3.27Å; S87-S90 PolarHBondContact O-OG 2.82Å | ||
| 88 | I | 72.9 | Confident | 76.6 | Confident | 108 Ų | 108 | 114.5 Ų | 114.5 | 55% | 0.554 | 60% | 0.601 | S | S | * | * | G | 310 helix | trans | -60.3 | -25.6 | 179.2 | -59.7 | 166.6 | 0 | 0 | 0 | 110.9 | R86 S90 M91 R96 | R86-I88 PolarHBondContact O-N 2.92Å; I88-S90 VanDerWaalsContact C-N 3.26Å; I88-S90 PolarHBondContact O-N 2.85Å; I88-M91 WeakPolarHBondContact O-CB 3.35Å; I88-M91 PolarHBondContact O-N 3.01Å; I88-M91 VanDerWaalsContact O-N 3.11Å; I88-R96 PolarHBondContact O-NH2 3.35Å |
| 89 | A | 79 | Confident | 77.8 | Confident | 83 Ų | 83 | 107.3 Ų | 107.3 | 69% | 0.686 | 58% | 0.579 | S | S | * | * | G | 310 helix | trans | -61.1 | -30.8 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | S87 M91 | S87-A89 PolarHBondContact O-N 2.87Å; S87-A89 VanDerWaalsContact O-N 3.13Å; A89-M91 VanDerWaalsContact C-N 3.34Å |
| 90 | S | 83.4 | Confident | 79 | Confident | 89 Ų | 89 | 108.5 Ų | 108.5 | 62% | 0.622 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -86.3 | -4.7 | 179.1 | 61.2 | 0 | 0 | 0 | 0 | 113.9 | S87 I88 | S87-S90 PolarHBondContact O-N 3.27Å; S87-S90 PolarHBondContact O-OG 2.82Å; I88-S90 VanDerWaalsContact C-N 3.26Å; I88-S90 PolarHBondContact O-N 2.85Å |
| 91 | M | 85.8 | Confident | 80.3 | Confident | 26 Ų | 26 | 105.2 Ų | 105.2 | 13% | 0.128 | 55% | 0.545 | C | S | . | . | trans | -81.9 | 134.1 | -178.4 | -60.4 | -171.3 | 67 | 0 | 0 | 111.4 | I88 A89 E95 R96 M99 | I88-M91 WeakPolarHBondContact O-CB 3.35Å; I88-M91 PolarHBondContact O-N 3.01Å; I88-M91 VanDerWaalsContact O-N 3.11Å; A89-M91 VanDerWaalsContact C-N 3.34Å; M91-E95 WeakPolarHBondContact CA-OE2 3.42Å; M91-E95 HydrophobicContact CB-CB 4.42Å; M91-E95 HydrophobicContact CE-CB 3.49Å; M91-E95 VanDerWaalsContact CE-CB 3.49Å; M91-R96 HydrophobicContact CB-CG 3.93Å; M91-R96 PolarHBondContact O-NE 3.28Å; M91-R96 VanDerWaalsContact O-NE 3.08Å; M91-R96 PolarHBondContact O-NH2 3.13Å; M91-M99 HydrophobicContact CE-CE 3.29Å; M91-M99 HydrophobicContact CE-CG 4.13Å; M91-M99 HydrophobicContact CE-SD 3.6Å; M91-M99 VanDerWaalsContact CE-SD 3.6Å; M91-M99 HydrophobicContact SD-CE 3.35Å; M91-M99 WeakPolarHBondContact SD-CE 3.43Å; M91-M99 HydrophobicContact SD-SD 4Å | ||
| 92 | T | 89.2 | Confident | 81.5 | Confident | 79 Ų | 79 | 106.8 Ų | 106.8 | 49% | 0.485 | 55% | 0.55 | S | S | . | * | trans | -65.6 | 157.6 | 169.7 | 61.9 | 0 | 0 | 0 | 0 | 111.1 | E94 E95 R96 | T92-E94 PolarHBondContact O-N 3.32Å; T92-E95 PolarHBondContact N-OE2 2.75Å; T92-E95 PolarHBondContact O-N 3.31Å; T92-E95 VanDerWaalsContact OG1-CG 3.24Å; T92-E95 WeakPolarHBondContact OG1-CG 3.31Å; T92-E95 PolarHBondContact OG1-N 3.27Å; T92-E95 PolarHBondContact OG1-OE2 3.4Å; T92-R96 WeakPolarHBondContact O-CG 3.48Å; T92-R96 PolarHBondContact O-N 3.06Å | ||
| 93 | D | 88.3 | Confident | 82.5 | Confident | 132 Ų | 132 | 104.9 Ų | 104.9 | 71% | 0.706 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -59.4 | -34.1 | 178.4 | -71.6 | -29.8 | 0 | 0 | 0 | 112.5 | R96 F97 | D93-R96 PolarHBondContact O-N 3.5Å; D93-F97 WeakPolarHBondContact O-CB 3.49Å; D93-F97 PolarHBondContact O-N 3.3Å |
| 94 | E | 89.6 | Confident | 83.5 | Confident | 114 Ų | 114 | 104.9 Ų | 104.9 | 53% | 0.533 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.7 | -44.6 | 176.6 | -175.1 | 54.9 | -139.5 | 0 | 0 | 111.7 | T92 R96 F97 N98 | T92-E94 PolarHBondContact O-N 3.32Å; E94-R96 VanDerWaalsContact C-N 3.33Å; E94-R96 PolarHBondContact O-N 3.47Å; E94-F97 WeakPolarHBondContact O-CB 3.31Å; E94-F97 PolarHBondContact O-N 2.71Å; E94-N98 PolarHBondContact O-N 3.22Å; E94-N98 PolarHBondContact O-ND2 2.97Å; E94-N98 PolarHBondContact OE1-ND2 3.33Å |
| 95 | E | 89.5 | Confident | 84 | Confident | 73 Ų | 73 | 102.1 Ų | 102.1 | 34% | 0.341 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.1 | -40.6 | 176.1 | -68.3 | 167 | 130.8 | 0 | 0 | 111.5 | M91 T92 F97 N98 M99 | M91-E95 WeakPolarHBondContact CA-OE2 3.42Å; M91-E95 HydrophobicContact CB-CB 4.42Å; M91-E95 HydrophobicContact CE-CB 3.49Å; M91-E95 VanDerWaalsContact CE-CB 3.49Å; T92-E95 PolarHBondContact N-OE2 2.75Å; T92-E95 PolarHBondContact O-N 3.31Å; T92-E95 VanDerWaalsContact OG1-CG 3.24Å; T92-E95 WeakPolarHBondContact OG1-CG 3.31Å; T92-E95 PolarHBondContact OG1-N 3.27Å; T92-E95 PolarHBondContact OG1-OE2 3.4Å; E95-F97 VanDerWaalsContact C-N 3.31Å; E95-F97 PolarHBondContact O-N 3.4Å; E95-N98 PolarHBondContact O-N 3.47Å; E95-M99 WeakPolarHBondContact O-CG 3.27Å; E95-M99 PolarHBondContact O-N 2.98Å |
| 96 | R | 89.2 | Confident | 83.8 | Confident | 87 Ų | 87 | 96.2 Ų | 96.2 | 33% | 0.328 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.4 | -37.5 | 175.3 | -65.2 | 178.9 | -163.9 | -161.8 | 5.7 | 111.8 | I88 M91 T92 D93 E94 R100 | I88-R96 PolarHBondContact O-NH2 3.35Å; M91-R96 HydrophobicContact CB-CG 3.93Å; M91-R96 PolarHBondContact O-NE 3.28Å; M91-R96 VanDerWaalsContact O-NE 3.08Å; M91-R96 PolarHBondContact O-NH2 3.13Å; T92-R96 WeakPolarHBondContact O-CG 3.48Å; T92-R96 PolarHBondContact O-N 3.06Å; D93-R96 PolarHBondContact O-N 3.5Å; E94-R96 VanDerWaalsContact C-N 3.33Å; E94-R96 PolarHBondContact O-N 3.47Å; R96-R100 PolarHBondContact O-N 3.22Å; R96-R100 VanDerWaalsContact O-N 3.17Å |
| 97 | F | 87.3 | Confident | 83.6 | Confident | 47 Ų | 47 | 90.5 Ų | 90.5 | 21% | 0.206 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -61.9 | -52.6 | 173.8 | -176.8 | -112 | 0 | 0 | 0 | 110.5 | D93 E94 E95 M99 R100 I101 F111 | D93-F97 WeakPolarHBondContact O-CB 3.49Å; D93-F97 PolarHBondContact O-N 3.3Å; E94-F97 WeakPolarHBondContact O-CB 3.31Å; E94-F97 PolarHBondContact O-N 2.71Å; E95-F97 VanDerWaalsContact C-N 3.31Å; E95-F97 PolarHBondContact O-N 3.4Å; F97-M99 VanDerWaalsContact C-N 3.31Å; F97-M99 PolarHBondContact O-N 3.25Å; F97-R100 WeakPolarHBondContact O-CA 3.09Å; F97-R100 WeakPolarHBondContact O-CB 3.46Å; F97-R100 PolarHBondContact O-N 3.46Å; F97-I101 HydrophobicContact CD1-CD1 3.83Å; F97-I101 HydrophobicContact CD1-CG1 4.34Å; F97-I101 HydrophobicContact CE1-CD1 3.44Å; F97-I101 VanDerWaalsContact CE1-CD1 3.44Å; F97-I101 HydrophobicContact CE1-CG1 4.08Å; F97-I101 HydrophobicContact CZ-CD1 3.95Å; F97-I101 HydrophobicContact CZ-CG1 4.18Å; F97-I101 WeakPolarHBondContact O-CG1 3.44Å; F97-I101 PolarHBondContact O-N 3.11Å; F97-F111 HydrophobicContact CD2-CE2 4.46Å; F97-F111 AromaticContact CE2-CD2 3.84Å; F97-F111 HydrophobicContact CE2-CD2 3.84Å; F97-F111 AromaticContact CE2-CE2 3.59Å; F97-F111 HydrophobicContact CE2-CE2 3.59Å; F97-F111 HydrophobicContact CE2-CZ 4.32Å; F97-F111 HydrophobicContact CZ-CD2 4.37Å; F97-F111 HydrophobicContact CZ-CE2 4.31Å |
| 98 | N | 88 | Confident | 83.3 | Confident | 77 Ų | 77 | 90.4 Ų | 90.4 | 41% | 0.412 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.2 | -37.8 | 179 | -73 | -49.2 | 0 | 0 | 0 | 113.4 | E94 E95 R100 I101 K102 | E94-N98 PolarHBondContact O-N 3.22Å; E94-N98 PolarHBondContact O-ND2 2.97Å; E94-N98 PolarHBondContact OE1-ND2 3.33Å; E95-N98 PolarHBondContact O-N 3.47Å; N98-R100 VanDerWaalsContact C-N 3.35Å; N98-R100 PolarHBondContact O-N 2.96Å; N98-I101 PolarHBondContact O-N 3.2Å; N98-K102 WeakPolarHBondContact O-CB 3.29Å; N98-K102 PolarHBondContact O-N 2.83Å |
| 99 | M | 86.9 | Confident | 82.8 | Confident | 92 Ų | 92 | 93.5 Ų | 93.5 | 45% | 0.453 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.2 | -39 | 172.4 | -74.1 | -161.7 | -55.7 | 0 | 0 | 112.9 | M91 E95 F97 K102 K103 | M91-M99 HydrophobicContact CE-CE 3.29Å; M91-M99 HydrophobicContact CE-CG 4.13Å; M91-M99 HydrophobicContact CE-SD 3.6Å; M91-M99 VanDerWaalsContact CE-SD 3.6Å; M91-M99 HydrophobicContact SD-CE 3.35Å; M91-M99 WeakPolarHBondContact SD-CE 3.43Å; M91-M99 HydrophobicContact SD-SD 4Å; E95-M99 WeakPolarHBondContact O-CG 3.27Å; E95-M99 PolarHBondContact O-N 2.98Å; F97-M99 VanDerWaalsContact C-N 3.31Å; F97-M99 PolarHBondContact O-N 3.25Å; M99-K102 PolarHBondContact O-N 3.27Å; M99-K103 VanDerWaalsContact O-CB 3.27Å; M99-K103 WeakPolarHBondContact O-CB 3.41Å; M99-K103 PolarHBondContact O-N 3.46Å |
| 100 | R | 88.6 | Confident | 81.9 | Confident | 120 Ų | 120 | 94.6 Ų | 94.6 | 45% | 0.453 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.6 | -41.8 | 175.3 | -77.2 | -176 | -72.9 | -165 | -1.6 | 111.6 | R96 F97 N98 K102 K103 F104 | R96-R100 PolarHBondContact O-N 3.22Å; R96-R100 VanDerWaalsContact O-N 3.17Å; F97-R100 WeakPolarHBondContact O-CA 3.09Å; F97-R100 WeakPolarHBondContact O-CB 3.46Å; F97-R100 PolarHBondContact O-N 3.46Å; N98-R100 VanDerWaalsContact C-N 3.35Å; N98-R100 PolarHBondContact O-N 2.96Å; R100-K102 VanDerWaalsContact C-N 3.33Å; R100-K102 PolarHBondContact O-N 3.25Å; R100-K103 PolarHBondContact O-N 3.37Å; R100-F104 HydrophobicContact CB-CD2 4.45Å; R100-F104 WeakPolarHBondContact O-CB 3.32Å; R100-F104 PolarHBondContact O-N 3.08Å |
| 101 | I | 88.1 | Confident | 80.6 | Confident | 50 Ų | 50 | 95 Ų | 95 | 26% | 0.256 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.4 | -48.1 | 173.3 | -53.2 | 177.8 | 0 | 0 | 0 | 109.7 | F97 N98 K103 G105 I106 | F97-I101 HydrophobicContact CD1-CD1 3.83Å; F97-I101 HydrophobicContact CD1-CG1 4.34Å; F97-I101 HydrophobicContact CE1-CD1 3.44Å; F97-I101 VanDerWaalsContact CE1-CD1 3.44Å; F97-I101 HydrophobicContact CE1-CG1 4.08Å; F97-I101 HydrophobicContact CZ-CD1 3.95Å; F97-I101 HydrophobicContact CZ-CG1 4.18Å; F97-I101 WeakPolarHBondContact O-CG1 3.44Å; F97-I101 PolarHBondContact O-N 3.11Å; N98-I101 PolarHBondContact O-N 3.2Å; I101-K103 PolarHBondContact O-N 3.02Å; I101-G105 WeakPolarHBondContact O-CA 3.42Å; I101-G105 PolarHBondContact O-N 2.85Å; I101-I106 WeakPolarHBondContact CG1-O 3.44Å |
| 102 | K | 89.2 | Confident | 79.3 | Confident | 193 Ų | 193 | 104.8 Ų | 104.8 | 84% | 0.839 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -64 | -39.2 | -179.4 | -173.1 | 177 | 179.2 | -179.7 | 0 | 112.7 | N98 M99 R100 | N98-K102 WeakPolarHBondContact O-CB 3.29Å; N98-K102 PolarHBondContact O-N 2.83Å; M99-K102 PolarHBondContact O-N 3.27Å; R100-K102 VanDerWaalsContact C-N 3.33Å; R100-K102 PolarHBondContact O-N 3.25Å |
| 103 | K | 88.9 | Confident | 77.8 | Confident | 165 Ų | 165 | 109.6 Ų | 109.6 | 72% | 0.717 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -77.9 | -39.2 | -176.6 | -177.5 | 170 | 178.5 | 175.1 | 0 | 113 | M99 R100 I101 | M99-K103 VanDerWaalsContact O-CB 3.27Å; M99-K103 WeakPolarHBondContact O-CB 3.41Å; M99-K103 PolarHBondContact O-N 3.46Å; R100-K103 PolarHBondContact O-N 3.37Å; I101-K103 PolarHBondContact O-N 3.02Å |
| 104 | F | 87.2 | Confident | 75.9 | Confident | 130 Ų | 130 | 106.2 Ų | 106.2 | 57% | 0.57 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -115.4 | -2.9 | -170.9 | -62.1 | -72.5 | 0 | 0 | 0 | 113.8 | R100 I106 | R100-F104 HydrophobicContact CB-CD2 4.45Å; R100-F104 WeakPolarHBondContact O-CB 3.32Å; R100-F104 PolarHBondContact O-N 3.08Å; F104-I106 HydrophobicContact CB-CD1 3.58Å; F104-I106 HydrophobicContact CB-CG1 3.61Å; F104-I106 HydrophobicContact CD2-CD1 4.46Å; F104-I106 HydrophobicContact CG-CD1 4.25Å; F104-I106 PolarHBondContact O-N 3.28Å |
| 105 | G | 79.9 | Confident | 74.4 | Confident | 50 Ų | 50 | 105.2 Ų | 105.2 | 52% | 0.515 | 51% | 0.505 | S | S | . | . | trans | 69.8 | 7.8 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | I101 T107 | I101-G105 WeakPolarHBondContact O-CA 3.42Å; I101-G105 PolarHBondContact O-N 2.85Å; G105-T107 PolarHBondContact O-N 2.87Å; G105-T107 VanDerWaalsContact O-N 3.1Å | ||
| 106 | I | 67.7 | Low | 72.8 | Confident | 43 Ų | 43 | 105.3 Ų | 105.3 | 22% | 0.221 | 51% | 0.51 | C | S | . | . | trans | -73.5 | 110.4 | -169.6 | -51.4 | 163.3 | 0 | 0 | 0 | 109.4 | I101 F104 E110 F111 | I101-I106 WeakPolarHBondContact CG1-O 3.44Å; F104-I106 HydrophobicContact CB-CD1 3.58Å; F104-I106 HydrophobicContact CB-CG1 3.61Å; F104-I106 HydrophobicContact CD2-CD1 4.46Å; F104-I106 HydrophobicContact CG-CD1 4.25Å; F104-I106 PolarHBondContact O-N 3.28Å; I106-E110 HydrophobicContact CG2-CB 4.01Å; I106-F111 HydrophobicContact CB-CD2 4.46Å; I106-F111 HydrophobicContact CB-CE2 3.65Å; I106-F111 HydrophobicContact CB-CZ 3.98Å; I106-F111 HydrophobicContact CD1-CE1 4.46Å; I106-F111 HydrophobicContact CD1-CE2 4.37Å; I106-F111 HydrophobicContact CD1-CZ 3.8Å; I106-F111 HydrophobicContact CG2-CD2 3.47Å; I106-F111 VanDerWaalsContact CG2-CD2 3.47Å; I106-F111 HydrophobicContact CG2-CE1 4.35Å; I106-F111 HydrophobicContact CG2-CE2 3.1Å; I106-F111 HydrophobicContact CG2-CG 4.26Å; I106-F111 HydrophobicContact CG2-CZ 3.6Å | ||
| 107 | T | 67.3 | Low | 71.1 | Confident | 65 Ų | 65 | 102.8 Ų | 102.8 | 40% | 0.399 | 51% | 0.508 | S | S | . | . | trans | -77.3 | 148.1 | 172.3 | 66.5 | 0 | 0 | 0 | 0 | 110.2 | G105 K109 E110 | G105-T107 PolarHBondContact O-N 2.87Å; G105-T107 VanDerWaalsContact O-N 3.1Å; T107-K109 PolarHBondContact O-N 3.07Å; T107-E110 PolarHBondContact O-N 2.68Å; T107-E110 PolarHBondContact OG1-OE1 3.09Å; T107-E110 VanDerWaalsContact OG1-OE1 3.07Å | ||
| 108 | S | 64 | Low | 69.9 | Low | 75 Ų | 75 | 105.8 Ų | 105.8 | 52% | 0.524 | 54% | 0.535 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -16.9 | -178.4 | 61.3 | 0 | 0 | 0 | 0 | 114.7 | ||
| 109 | K | 61.8 | Low | 68.6 | Low | 173 Ų | 173 | 106.7 Ų | 106.7 | 75% | 0.752 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.8 | -22.3 | 176.7 | -67.1 | -178.5 | 179.6 | 176 | 0 | 113.4 | T107 | T107-K109 PolarHBondContact O-N 3.07Š|
| 110 | E | 59.2 | Low | 67.7 | Low | 106 Ų | 106 | 109.3 Ų | 109.3 | 50% | 0.495 | 56% | 0.555 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.5 | -29.6 | -178.6 | -72.5 | 155.9 | -143.2 | 0 | 0 | 112.6 | I106 T107 R112 K113 | I106-E110 HydrophobicContact CG2-CB 4.01Å; T107-E110 PolarHBondContact O-N 2.68Å; T107-E110 PolarHBondContact OG1-OE1 3.09Å; T107-E110 VanDerWaalsContact OG1-OE1 3.07Å; E110-R112 PolarHBondContact O-N 3.37Å; E110-R112 VanDerWaalsContact O-N 3.15Å; E110-K113 PolarHBondContact O-N 2.96Å; E110-K113 VanDerWaalsContact O-N 3.17Å |
| 111 | F | 56.4 | Low | 66.2 | Low | 97 Ų | 97 | 106.8 Ų | 106.8 | 43% | 0.425 | 57% | 0.566 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -63.1 | -23.5 | 179.9 | -80.6 | -78.2 | 0 | 0 | 0 | 114.4 | F97 I106 | F97-F111 HydrophobicContact CD2-CE2 4.46Å; F97-F111 AromaticContact CE2-CD2 3.84Å; F97-F111 HydrophobicContact CE2-CD2 3.84Å; F97-F111 AromaticContact CE2-CE2 3.59Å; F97-F111 HydrophobicContact CE2-CE2 3.59Å; F97-F111 HydrophobicContact CE2-CZ 4.32Å; F97-F111 HydrophobicContact CZ-CD2 4.37Å; F97-F111 HydrophobicContact CZ-CE2 4.31Å; I106-F111 HydrophobicContact CB-CD2 4.46Å; I106-F111 HydrophobicContact CB-CE2 3.65Å; I106-F111 HydrophobicContact CB-CZ 3.98Å; I106-F111 HydrophobicContact CD1-CE1 4.46Å; I106-F111 HydrophobicContact CD1-CE2 4.37Å; I106-F111 HydrophobicContact CD1-CZ 3.8Å; I106-F111 HydrophobicContact CG2-CD2 3.47Å; I106-F111 VanDerWaalsContact CG2-CD2 3.47Å; I106-F111 HydrophobicContact CG2-CE1 4.35Å; I106-F111 HydrophobicContact CG2-CE2 3.1Å; I106-F111 HydrophobicContact CG2-CG 4.26Å; I106-F111 HydrophobicContact CG2-CZ 3.6Å |
| 112 | R | 58.8 | Low | 65.1 | Low | 233 Ų | 233 | 109.9 Ų | 109.9 | 88% | 0.879 | 58% | 0.583 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91 | -10.3 | 179.4 | -59.5 | -147.5 | -146.1 | -167.8 | 8.4 | 114.3 | E110 S114 | E110-R112 PolarHBondContact O-N 3.37Å; E110-R112 VanDerWaalsContact O-N 3.15Å; R112-S114 PolarHBondContact O-N 2.95Å |
| 113 | K | 57 | Low | 63.8 | Low | 179 Ų | 179 | 106 Ų | 106 | 78% | 0.778 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -100.4 | 79.5 | 173.7 | -66.3 | -172 | -179.9 | -177.1 | 0 | 107.1 | E110 | E110-K113 PolarHBondContact O-N 2.96Å; E110-K113 VanDerWaalsContact O-N 3.17Å |
| 114 | S | 48.8 | Very low | 62.5 | Low | 62 Ų | 62 | 105.1 Ų | 105.1 | 43% | 0.434 | 58% | 0.58 | S | S | . | * | trans | -53.8 | 135.7 | -171.1 | 78.6 | 0 | 0 | 0 | 0 | 110.8 | R112 V116 A117 | R112-S114 PolarHBondContact O-N 2.95Å; S114-V116 PolarHBondContact O-N 3.46Å; S114-V116 WeakPolarHBondContact OG-CB 3.49Å; S114-A117 PolarHBondContact O-N 3.14Å | ||
| 115 | P | 58 | Low | 61.1 | Low | 92 Ų | 92 | 103.8 Ų | 103.8 | 60% | 0.597 | 59% | 0.587 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55 | -13.5 | 168.5 | -23.8 | 32.4 | 0 | 0 | 0 | 112.8 | A117 S118 C119 | P115-A117 VanDerWaalsContact C-N 3.29Å; P115-A117 PolarHBondContact O-N 3.49Å; P115-S118 CarbonylContact O-C 3.57Å; P115-S118 PolarHBondContact O-N 3.02Å; P115-C119 PolarHBondContact O-N 3.38Å; P115-C119 PolarHBondContact O-SG 3.11Å; P115-C119 VanDerWaalsContact O-SG 3.38Å |
| 116 | V | 57 | Low | 60 | Low | 75 Ų | 75 | 107.9 Ų | 107.9 | 46% | 0.455 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -60.4 | -35.7 | -176.5 | -172.6 | 0 | 0 | 0 | 0 | 111.8 | S114 S118 F120 | S114-V116 PolarHBondContact O-N 3.46Å; S114-V116 WeakPolarHBondContact OG-CB 3.49Å; V116-S118 VanDerWaalsContact C-N 3.32Å; V116-S118 PolarHBondContact O-N 3.42Å; V116-F120 HydrophobicContact CB-CD2 4.39Å; V116-F120 HydrophobicContact CG1-CD2 3.67Å; V116-F120 HydrophobicContact CG1-CE2 4.18Å; V116-F120 WeakPolarHBondContact O-CB 3.3Å; V116-F120 WeakPolarHBondContact O-CD2 3.4Å; V116-F120 PolarHBondContact O-N 3.5Å; V116-F120 VanDerWaalsContact O-N 3.13Å |
| 117 | A | 54 | Low | 59.5 | Low | 35 Ų | 35 | 109.1 Ų | 109.1 | 29% | 0.289 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -68.2 | -33.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | S114 P115 G121 L124 | S114-A117 PolarHBondContact O-N 3.14Å; P115-A117 VanDerWaalsContact C-N 3.29Å; P115-A117 PolarHBondContact O-N 3.49Å; A117-G121 PolarHBondContact O-N 3.31Å; A117-L124 HydrophobicContact CB-CD2 4.23Å; A117-L124 HydrophobicContact CB-CG 4.47Å |
| 118 | S | 60.4 | Low | 58.9 | Low | 110 Ų | 110 | 113.6 Ų | 113.6 | 77% | 0.769 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -80.9 | -35.8 | 179.6 | -168.3 | 0 | 0 | 0 | 0 | 112.9 | P115 V116 | P115-S118 CarbonylContact O-C 3.57Å; P115-S118 PolarHBondContact O-N 3.02Å; V116-S118 VanDerWaalsContact C-N 3.32Å; V116-S118 PolarHBondContact O-N 3.42Å |
| 119 | C | 62.4 | Low | 58.8 | Low | 95 Ų | 95 | 117.7 Ų | 117.7 | 64% | 0.642 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -82.5 | -23.8 | -177.7 | -63.8 | 0 | 0 | 0 | 0 | 113.2 | P115 | P115-C119 PolarHBondContact O-N 3.38Å; P115-C119 PolarHBondContact O-SG 3.11Å; P115-C119 VanDerWaalsContact O-SG 3.38Å |
| 120 | F | 68 | Low | 58.6 | Low | 147 Ų | 147 | 116.6 Ų | 116.6 | 65% | 0.645 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -113.8 | 4.4 | -175.4 | -66.3 | -85.4 | 0 | 0 | 0 | 114.4 | V116 L122 | V116-F120 HydrophobicContact CB-CD2 4.39Å; V116-F120 HydrophobicContact CG1-CD2 3.67Å; V116-F120 HydrophobicContact CG1-CE2 4.18Å; V116-F120 WeakPolarHBondContact O-CB 3.3Å; V116-F120 WeakPolarHBondContact O-CD2 3.4Å; V116-F120 PolarHBondContact O-N 3.5Å; V116-F120 VanDerWaalsContact O-N 3.13Å; F120-L122 HydrophobicContact CB-CD1 4.23Å; F120-L122 HydrophobicContact CB-CG 4.23Å; F120-L122 PolarHBondContact O-N 3.18Å |
| 121 | G | 56.3 | Low | 58.8 | Low | 67 Ų | 67 | 114.7 Ų | 114.7 | 69% | 0.691 | 66% | 0.655 | S | S | * | * | trans | 58.9 | 19.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | A117 P123 | A117-G121 PolarHBondContact O-N 3.31Å; G121-P123 WeakPolarHBondContact O-CD 3.2Å | ||
| 122 | L | 64.5 | Low | 59.8 | Low | 115 Ų | 115 | 113.5 Ų | 113.5 | 60% | 0.602 | 65% | 0.653 | S | S | * | * | trans | -82.4 | 119.5 | -179.3 | -70.2 | 172.5 | 0 | 0 | 0 | 108.5 | F120 L124 | F120-L122 HydrophobicContact CB-CD1 4.23Å; F120-L122 HydrophobicContact CB-CG 4.23Å; F120-L122 PolarHBondContact O-N 3.18Å; L122-L124 PolarHBondContact O-N 3.5Å | ||
| 123 | P | 62 | Low | 61 | Low | 113 Ų | 113 | 108 Ų | 108 | 73% | 0.734 | 64% | 0.639 | S | S | * | * | trans | -58.3 | 136.2 | 173.7 | 24 | -31.3 | 0 | 0 | 0 | 108.5 | G121 S125 | G121-P123 WeakPolarHBondContact O-CD 3.2Å; P123-S125 VanDerWaalsContact C-N 3.26Å; P123-S125 PolarHBondContact O-N 2.94Å | ||
| 124 | L | 60.9 | Low | 62.2 | Low | 146 Ų | 146 | 102.9 Ų | 102.9 | 76% | 0.764 | 62% | 0.618 | S | S | * | * | trans | -56.6 | 95.4 | 168.4 | -70.3 | 162.1 | 0 | 0 | 0 | 107.1 | A117 L122 T126 | A117-L124 HydrophobicContact CB-CD2 4.23Å; A117-L124 HydrophobicContact CB-CG 4.47Å; L122-L124 PolarHBondContact O-N 3.5Å; L124-T126 PolarHBondContact O-N 2.97Å | ||
| 125 | S | 58.8 | Low | 64 | Low | 102 Ų | 102 | 106.6 Ų | 106.6 | 71% | 0.713 | 63% | 0.626 | S | S | * | * | trans | -69.4 | 84.7 | 179.9 | 163.1 | 0 | 0 | 0 | 0 | 108.7 | P123 G127 | P123-S125 VanDerWaalsContact C-N 3.26Å; P123-S125 PolarHBondContact O-N 2.94Å; S125-G127 PolarHBondContact O-N 2.91Å | ||
| 126 | T | 56.2 | Low | 65.4 | Low | 135 Ų | 135 | 106.6 Ų | 106.6 | 83% | 0.828 | 62% | 0.617 | S | S | * | * | trans | -68.8 | 112.9 | 160.3 | 50.8 | 0 | 0 | 0 | 0 | 108 | L124 | L124-T126 PolarHBondContact O-N 2.97Š| ||
| 127 | G | 56.8 | Low | 66.9 | Low | 70 Ų | 70 | 107.9 Ų | 107.9 | 72% | 0.722 | 61% | 0.613 | S | S | * | * | S | Bend | trans | 111 | 24.6 | 154.1 | 0 | 0 | 0 | 0 | 0 | 120.2 | S125 | S125-G127 PolarHBondContact O-N 2.91Š|
| 128 | K | 56.1 | Low | 68.5 | Low | 158 Ų | 158 | 113 Ų | 113 | 69% | 0.687 | 63% | 0.625 | S | S | * | * | trans | -126.6 | 58 | 164.9 | -87.2 | -175.2 | 176.3 | 173.5 | 0 | 112.6 | N130 | K128-N130 VanDerWaalsContact C-N 3.3Å; K128-N130 PolarHBondContact O-N 2.81Å | ||
| 129 | E | 60.9 | Low | 69.9 | Low | 162 Ų | 162 | 114.9 Ų | 114.9 | 76% | 0.757 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -62.7 | -35.8 | 178 | -64.2 | -178.2 | 168.9 | 0 | 0 | 112.2 | A131 D132 M133 | E129-A131 PolarHBondContact O-N 3.46Å; E129-D132 PolarHBondContact O-N 3.31Å; E129-M133 WeakPolarHBondContact O-CG 3.36Å; E129-M133 PolarHBondContact O-N 2.7Å |
| 130 | N | 59.2 | Low | 71.3 | Confident | 149 Ų | 149 | 114.3 Ų | 114.3 | 80% | 0.797 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -70.9 | -33.1 | -176.1 | -67.1 | -41.2 | 0 | 0 | 0 | 114.2 | K128 D132 | K128-N130 VanDerWaalsContact C-N 3.3Å; K128-N130 PolarHBondContact O-N 2.81Å; N130-D132 VanDerWaalsContact C-N 3.33Å |
| 131 | A | 62.5 | Low | 72.3 | Confident | 66 Ų | 66 | 112.3 Ų | 112.3 | 55% | 0.545 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -73.8 | -27.7 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | E129 | E129-A131 PolarHBondContact O-N 3.46Å |
| 132 | D | 76.9 | Confident | 74 | Confident | 72 Ų | 72 | 117.8 Ų | 117.8 | 39% | 0.385 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -73.3 | -34.1 | 178.2 | -169.4 | 28.3 | 0 | 0 | 0 | 111.5 | E129 N130 K135 K136 | E129-D132 PolarHBondContact O-N 3.31Å; N130-D132 VanDerWaalsContact C-N 3.33Å; D132-K135 PolarHBondContact O-N 3.44Å; D132-K136 WeakPolarHBondContact O-CB 3.35Å; D132-K136 WeakPolarHBondContact O-CG 3.34Å; D132-K136 PolarHBondContact O-N 3.04Å; D132-K136 WeakPolarHBondContact OD2-CE 3.45Å; D132-K136 IonicContact OD2-NZ 2.71Å; D132-K136 PolarHBondContact OD2-NZ 3.48Å |
| 133 | M | 83.7 | Confident | 75.2 | Confident | 117 Ų | 117 | 119.6 Ų | 119.6 | 58% | 0.576 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -67.2 | -42.4 | 179.7 | -67.2 | -56.9 | -71.7 | 0 | 0 | 113.5 | E129 K135 K136 R137 | E129-M133 WeakPolarHBondContact O-CG 3.36Å; E129-M133 PolarHBondContact O-N 2.7Å; M133-K135 VanDerWaalsContact C-N 3.32Å; M133-K135 PolarHBondContact O-N 2.91Å; M133-K136 PolarHBondContact O-N 3Å; M133-K136 HydrophobicContact SD-CD 4.17Å; M133-R137 WeakPolarHBondContact O-CB 3.26Å; M133-R137 PolarHBondContact O-N 3.43Å |
| 134 | E | 83.8 | Confident | 76.1 | Confident | 73 Ų | 73 | 117.2 Ų | 117.2 | 34% | 0.341 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -65.5 | -37.3 | 176 | 175.9 | 59.8 | -166.7 | 0 | 0 | 111.6 | R137 R138 | E134-R137 VanDerWaalsContact CD-NH2 3.34Å; E134-R137 PolarHBondContact O-N 3.15Å; E134-R137 IonicContact OE1-CZ 3.89Å; E134-R137 IonicContact OE1-NE 2.81Å; E134-R137 IonicContact OE1-NH2 3.31Å; E134-R137 PolarHBondContact OE1-NH2 3.01Å; E134-R137 IonicContact OE2-CZ 2.68Å; E134-R137 IonicContact OE2-NE 2.7Å; E134-R137 PolarHBondContact OE2-NE 2.87Å; E134-R137 IonicContact OE2-NH2 3.63Å; E134-R137 PolarHBondContact OE2-NH2 3.37Å; E134-R138 WeakPolarHBondContact O-CG 3.05Å; E134-R138 PolarHBondContact O-N 2.85Å; E134-R138 IonicContact OE1-CZ 3.21Å; E134-R138 IonicContact OE1-NE 3.49Å; E134-R138 PolarHBondContact OE1-NE 3.06Å; E134-R138 IonicContact OE1-NH2 3.77Å; E134-R138 PolarHBondContact OE1-NH2 3.45Å |
| 135 | K | 86.4 | Confident | 76.8 | Confident | 139 Ų | 139 | 115.8 Ų | 115.8 | 60% | 0.604 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -66.7 | -40.4 | 174.8 | -170.2 | 176.5 | -177.7 | 178.2 | 0 | 111.6 | D132 M133 R139 | D132-K135 PolarHBondContact O-N 3.44Å; M133-K135 VanDerWaalsContact C-N 3.32Å; M133-K135 PolarHBondContact O-N 2.91Å; K135-R139 WeakPolarHBondContact O-CB 3.42Å; K135-R139 PolarHBondContact O-N 3.26Å |
| 136 | K | 86.5 | Confident | 77.2 | Confident | 93 Ų | 93 | 118.4 Ų | 118.4 | 40% | 0.404 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -62.2 | -48.7 | 172.8 | -77.6 | 173.2 | -174.5 | 160.6 | 0 | 110.9 | D132 M133 R138 R139 L140 | D132-K136 WeakPolarHBondContact O-CB 3.35Å; D132-K136 WeakPolarHBondContact O-CG 3.34Å; D132-K136 PolarHBondContact O-N 3.04Å; D132-K136 WeakPolarHBondContact OD2-CE 3.45Å; D132-K136 IonicContact OD2-NZ 2.71Å; D132-K136 PolarHBondContact OD2-NZ 3.48Å; M133-K136 PolarHBondContact O-N 3Å; M133-K136 HydrophobicContact SD-CD 4.17Å; K136-R138 PolarHBondContact O-N 3.47Å; K136-R139 WeakPolarHBondContact O-CA 3.46Å; K136-R139 WeakPolarHBondContact O-CB 3.48Å; K136-R139 PolarHBondContact O-N 3.25Å; K136-L140 WeakPolarHBondContact O-CB 3.44Å; K136-L140 WeakPolarHBondContact O-CD1 3.4Å; K136-L140 PolarHBondContact O-N 2.92Å |
| 137 | R | 88.2 | Confident | 78.2 | Confident | 101 Ų | 101 | 117.6 Ų | 117.6 | 38% | 0.381 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -54.8 | -51.5 | 176.6 | -170.8 | -168.2 | 66.2 | 72.1 | 6 | 112.2 | M133 E134 R139 L140 E141 | M133-R137 WeakPolarHBondContact O-CB 3.26Å; M133-R137 PolarHBondContact O-N 3.43Å; E134-R137 VanDerWaalsContact CD-NH2 3.34Å; E134-R137 PolarHBondContact O-N 3.15Å; E134-R137 IonicContact OE1-CZ 3.89Å; E134-R137 IonicContact OE1-NE 2.81Å; E134-R137 IonicContact OE1-NH2 3.31Å; E134-R137 PolarHBondContact OE1-NH2 3.01Å; E134-R137 IonicContact OE2-CZ 2.68Å; E134-R137 IonicContact OE2-NE 2.7Å; E134-R137 PolarHBondContact OE2-NE 2.87Å; E134-R137 IonicContact OE2-NH2 3.63Å; E134-R137 PolarHBondContact OE2-NH2 3.37Å; R137-R139 PolarHBondContact O-N 3.16Å; R137-L140 WeakPolarHBondContact O-CB 3.44Å; R137-L140 PolarHBondContact O-N 3.19Å; R137-L140 VanDerWaalsContact O-N 3.15Å; R137-E141 IonicContact CZ-OE1 3.75Å; R137-E141 IonicContact CZ-OE2 3.47Å; R137-E141 IonicContact NH1-OE1 2.63Å; R137-E141 PolarHBondContact NH1-OE1 3.35Å; R137-E141 IonicContact NH1-OE2 2.8Å; R137-E141 PolarHBondContact NH1-OE2 3.11Å; R137-E141 PolarHBondContact O-N 3.21Å |
| 138 | R | 88.4 | Confident | 79.4 | Confident | 143 Ų | 143 | 120.1 Ų | 120.1 | 54% | 0.54 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -63.7 | -26.2 | 176.4 | -70.2 | -176.7 | -168.6 | -166.6 | 0.5 | 114 | E134 K136 R142 | E134-R138 WeakPolarHBondContact O-CG 3.05Å; E134-R138 PolarHBondContact O-N 2.85Å; E134-R138 IonicContact OE1-CZ 3.21Å; E134-R138 IonicContact OE1-NE 3.49Å; E134-R138 PolarHBondContact OE1-NE 3.06Å; E134-R138 IonicContact OE1-NH2 3.77Å; E134-R138 PolarHBondContact OE1-NH2 3.45Å; K136-R138 PolarHBondContact O-N 3.47Å; R138-R142 WeakPolarHBondContact O-CG 3.22Å; R138-R142 PolarHBondContact O-N 3.46Å; R138-R142 PolarHBondContact O-NE 3.21Å |
| 139 | R | 90.1 | Very high | 80.7 | Confident | 150 Ų | 150 | 118 Ų | 118 | 57% | 0.566 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -74.6 | -46.3 | 173.7 | 178.5 | 178.3 | -96.1 | 163.2 | -9.8 | 109.6 | K135 K136 R137 E141 R142 F143 | K135-R139 WeakPolarHBondContact O-CB 3.42Å; K135-R139 PolarHBondContact O-N 3.26Å; K136-R139 WeakPolarHBondContact O-CA 3.46Å; K136-R139 WeakPolarHBondContact O-CB 3.48Å; K136-R139 PolarHBondContact O-N 3.25Å; R137-R139 PolarHBondContact O-N 3.16Å; R139-E141 PolarHBondContact O-N 2.8Å; R139-R142 WeakPolarHBondContact O-CB 3.49Å; R139-R142 PolarHBondContact O-N 2.63Å; R139-R142 VanDerWaalsContact O-N 3.16Å; R139-F143 HydrophobicContact CG-CD2 3.97Å; R139-F143 HydrophobicContact CG-CE2 3.89Å; R139-F143 VanDerWaalsContact O-CD2 3.22Å; R139-F143 WeakPolarHBondContact O-CD2 3.26Å; R139-F143 PolarHBondContact O-N 3.29Å |
| 140 | L | 90.9 | Very high | 81.8 | Confident | 82 Ų | 82 | 115.4 Ų | 115.4 | 43% | 0.429 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -54.6 | -49.7 | 175.3 | -104.2 | 77.7 | 0 | 0 | 0 | 111.5 | K136 R137 R142 F143 G144 L145 | K136-L140 WeakPolarHBondContact O-CB 3.44Å; K136-L140 WeakPolarHBondContact O-CD1 3.4Å; K136-L140 PolarHBondContact O-N 2.92Å; R137-L140 WeakPolarHBondContact O-CB 3.44Å; R137-L140 PolarHBondContact O-N 3.19Å; R137-L140 VanDerWaalsContact O-N 3.15Å; L140-R142 VanDerWaalsContact C-N 3.33Å; L140-R142 PolarHBondContact O-N 3.2Å; L140-F143 CarbonylContact O-C 3.59Å; L140-F143 PolarHBondContact O-N 3.09Å; L140-F143 VanDerWaalsContact O-N 3.09Å; L140-G144 PolarHBondContact O-N 2.96Å; L140-L145 CarbonylContact C-O 3.6Å; L140-L145 VanDerWaalsContact C-O 3.29Å; L140-L145 WeakPolarHBondContact CA-O 3.37Å; L140-L145 WeakPolarHBondContact CB-O 2.93Å; L140-L145 VanDerWaalsContact CD2-O 3.26Å; L140-L145 WeakPolarHBondContact CD2-O 3.23Å; L140-L145 HydrophobicContact CG-CB 4.31Å; L140-L145 WeakPolarHBondContact CG-O 3.23Å; L140-L145 CarbonylContact O-C 3.53Å; L140-L145 PolarHBondContact O-N 3.29Å |
| 141 | E | 89.8 | Confident | 83.2 | Confident | 105 Ų | 105 | 113.3 Ų | 113.3 | 49% | 0.491 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -59.2 | -38.3 | 175.2 | -74.3 | 179.3 | 165.1 | 0 | 0 | 113.5 | R137 R139 F143 G144 | R137-E141 IonicContact CZ-OE1 3.75Å; R137-E141 IonicContact CZ-OE2 3.47Å; R137-E141 IonicContact NH1-OE1 2.63Å; R137-E141 PolarHBondContact NH1-OE1 3.35Å; R137-E141 IonicContact NH1-OE2 2.8Å; R137-E141 PolarHBondContact NH1-OE2 3.11Å; R137-E141 PolarHBondContact O-N 3.21Å; R139-E141 PolarHBondContact O-N 2.8Å; E141-F143 VanDerWaalsContact C-N 3.26Å; E141-F143 PolarHBondContact O-N 3.32Å; E141-G144 PolarHBondContact O-N 3.22Å |
| 142 | R | 91.1 | Very high | 84.6 | Confident | 182 Ų | 182 | 116.5 Ų | 116.5 | 69% | 0.687 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.1 | -28.6 | 177.3 | -90.1 | -179.9 | -73.8 | -170.1 | -2 | 113.6 | R138 R139 L140 | R138-R142 WeakPolarHBondContact O-CG 3.22Å; R138-R142 PolarHBondContact O-N 3.46Å; R138-R142 PolarHBondContact O-NE 3.21Å; R139-R142 WeakPolarHBondContact O-CB 3.49Å; R139-R142 PolarHBondContact O-N 2.63Å; R139-R142 VanDerWaalsContact O-N 3.16Å; L140-R142 VanDerWaalsContact C-N 3.33Å; L140-R142 PolarHBondContact O-N 3.2Å |
| 143 | F | 90 | Very high | 85.2 | Confident | 153 Ų | 153 | 119.6 Ų | 119.6 | 67% | 0.671 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | 6.2 | 178.2 | -71.5 | -73.7 | 0 | 0 | 0 | 112.7 | R139 L140 E141 L145 | R139-F143 HydrophobicContact CG-CD2 3.97Å; R139-F143 HydrophobicContact CG-CE2 3.89Å; R139-F143 VanDerWaalsContact O-CD2 3.22Å; R139-F143 WeakPolarHBondContact O-CD2 3.26Å; R139-F143 PolarHBondContact O-N 3.29Å; L140-F143 CarbonylContact O-C 3.59Å; L140-F143 PolarHBondContact O-N 3.09Å; L140-F143 VanDerWaalsContact O-N 3.09Å; E141-F143 VanDerWaalsContact C-N 3.26Å; E141-F143 PolarHBondContact O-N 3.32Å; F143-L145 HydrophobicContact CB-CD1 4.15Å; F143-L145 HydrophobicContact CB-CG 4.25Å; F143-L145 PolarHBondContact O-N 3.17Å |
| 144 | G | 82 | Confident | 85.3 | Confident | 63 Ų | 63 | 119.8 Ų | 119.8 | 65% | 0.649 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.9 | 18.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | L140 E141 | L140-G144 PolarHBondContact O-N 2.96Å; E141-G144 PolarHBondContact O-N 3.22Å |
| 145 | L | 75.4 | Confident | 85.4 | Confident | 117 Ų | 117 | 123.8 Ų | 123.8 | 61% | 0.613 | 59% | 0.594 | S | S | * | * | trans | -102.6 | 72.8 | 177.6 | -62.7 | 173.1 | 0 | 0 | 0 | 107.2 | L140 F143 | L140-L145 CarbonylContact C-O 3.6Å; L140-L145 VanDerWaalsContact C-O 3.29Å; L140-L145 WeakPolarHBondContact CA-O 3.37Å; L140-L145 WeakPolarHBondContact CB-O 2.93Å; L140-L145 VanDerWaalsContact CD2-O 3.26Å; L140-L145 WeakPolarHBondContact CD2-O 3.23Å; L140-L145 HydrophobicContact CG-CB 4.31Å; L140-L145 WeakPolarHBondContact CG-O 3.23Å; L140-L145 CarbonylContact O-C 3.53Å; L140-L145 PolarHBondContact O-N 3.29Å; F143-L145 HydrophobicContact CB-CD1 4.15Å; F143-L145 HydrophobicContact CB-CG 4.25Å; F143-L145 PolarHBondContact O-N 3.17Å | ||
| 146 | S | 66.2 | Low | 85.3 | Confident | 157 Ų | 157 | 122.4 Ų | 122.4 | 100% | 1.098 | 59% | 0.594 | S | S | * | * | trans | -100.2 | 0 | 174 | 64.3 | 0 | 0 | 0 | 0 | 111.1 |
Retrieved 146 of 146 residues in 125.7 ms
(Link to these results)