| 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 | 48.1 | Very low | 46.5 | Very low | 245 Ų | 245 | 143.9 Ų | 143.9 | 100% | 1.207 | 83% | 0.831 | S | S | * | * | 0 | 95.3 | 0 | -85.2 | 155.5 | 145.3 | 0 | 0 | 110.1 | |||||
| 2 | K | 40.9 | Very low | 46.7 | Very low | 209 Ų | 209 | 141.6 Ų | 141.6 | 91% | 0.909 | 82% | 0.824 | S | S | * | * | trans | 179.8 | 123.8 | 132.6 | -108.7 | 176.7 | 172.3 | 176.1 | 0 | 108.4 | ||||
| 3 | D | 42.7 | Very low | 46.5 | Very low | 150 Ų | 150 | 142.8 Ų | 142.8 | 80% | 0.802 | 84% | 0.835 | S | S | * | * | trans | -77 | 163.5 | -163.6 | -61.5 | -66.5 | 0 | 0 | 0 | 115.4 | ||||
| 4 | P | 54.8 | Low | 45.9 | Very low | 113 Ų | 113 | 137.2 Ų | 137.2 | 73% | 0.734 | 82% | 0.823 | S | S | * | * | trans | -87.5 | 144.2 | -176.2 | 34.8 | -30.1 | 0 | 0 | 0 | 111.7 | ||||
| 5 | T | 48.1 | Very low | 46 | Very low | 142 Ų | 142 | 138.5 Ų | 138.5 | 87% | 0.871 | 83% | 0.832 | S | S | * | * | trans | -110.3 | 108.1 | 170.5 | -50 | 0 | 0 | 0 | 0 | 109.1 | G7 | T5-G7 PolarHBondContact O-N 2.89Š| ||
| 6 | I | 54.3 | Low | 45.5 | Very low | 152 Ų | 152 | 133.6 Ų | 133.6 | 78% | 0.779 | 82% | 0.819 | S | S | * | * | trans | -70.3 | 118.3 | 171.5 | -65.9 | 168.9 | 0 | 0 | 0 | 107.9 | ||||
| 7 | G | 40.9 | Very low | 45.9 | Very low | 67 Ų | 67 | 136.5 Ų | 136.5 | 69% | 0.691 | 82% | 0.821 | S | S | * | * | trans | -117.6 | 95.7 | 173.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | T5 | T5-G7 PolarHBondContact O-N 2.89Š| ||
| 8 | T | 45.6 | Very low | 46.1 | Very low | 130 Ų | 130 | 135.4 Ų | 135.4 | 80% | 0.798 | 82% | 0.815 | S | S | * | * | trans | -70.3 | 127.4 | 170.4 | -56.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 9 | T | 43.5 | Very low | 46.3 | Very low | 118 Ų | 118 | 134.2 Ų | 134.2 | 72% | 0.724 | 81% | 0.807 | S | S | * | * | trans | -121.7 | 137.3 | 167.4 | 49.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 10 | P | 52.8 | Low | 46.4 | Very low | 127 Ų | 127 | 134.8 Ų | 134.8 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | trans | -89.6 | 134.1 | 177.4 | 33.9 | -29.2 | 0 | 0 | 0 | 110.3 | ||||
| 11 | T | 39.9 | Very low | 46.4 | Very low | 130 Ų | 130 | 132.7 Ų | 132.7 | 80% | 0.798 | 80% | 0.797 | S | S | * | * | trans | -107.8 | 135.5 | 173.8 | -57.8 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 12 | P | 48.9 | Very low | 46.5 | Very low | 116 Ų | 116 | 125.9 Ų | 125.9 | 75% | 0.753 | 77% | 0.774 | S | S | * | * | trans | -81.1 | 148.3 | -168.8 | 32.2 | -35.5 | 0 | 0 | 0 | 113.8 | G14 | P12-G14 PolarHBondContact O-N 3.37Š| ||
| 13 | T | 44.6 | Very low | 47.1 | Very low | 157 Ų | 157 | 123.4 Ų | 123.4 | 96% | 0.963 | 77% | 0.765 | S | S | * | * | trans | -58.4 | 115.4 | 168.1 | -42.1 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 14 | G | 37.4 | Very low | 47.3 | Very low | 65 Ų | 65 | 125.6 Ų | 125.6 | 67% | 0.67 | 77% | 0.768 | S | S | * | * | trans | -136.1 | 117.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | P12 G16 | P12-G14 PolarHBondContact O-N 3.37Å; G14-G16 PolarHBondContact O-N 3.2Å | ||
| 15 | T | 47.7 | Very low | 47 | Very low | 156 Ų | 156 | 122.7 Ų | 122.7 | 96% | 0.957 | 76% | 0.759 | S | S | * | * | trans | -43.6 | 116 | 176.2 | 47.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 16 | G | 37.5 | Very low | 47.1 | Very low | 60 Ų | 60 | 121.1 Ų | 121.1 | 62% | 0.619 | 75% | 0.754 | S | S | * | * | trans | -163.9 | 92.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | G14 V18 | G14-G16 PolarHBondContact O-N 3.2Å; G16-V18 PolarHBondContact O-N 3.29Å | ||
| 17 | E | 52.4 | Low | 47.1 | Very low | 184 Ų | 184 | 123.4 Ų | 123.4 | 86% | 0.86 | 76% | 0.761 | S | S | * | * | trans | -64.3 | 82.3 | 170.8 | -168.6 | -174.7 | -175 | 0 | 0 | 108.2 | V19 | E17-V19 HydrophobicContact CG-CG2 4.1Å; E17-V19 PolarHBondContact O-N 2.83Å | ||
| 18 | V | 49.1 | Very low | 48.4 | Very low | 116 Ų | 116 | 127.5 Ų | 127.5 | 70% | 0.703 | 76% | 0.762 | S | S | * | * | trans | -83.9 | 97.5 | 161 | -170.7 | 0 | 0 | 0 | 0 | 104.1 | G16 L20 | G16-V18 PolarHBondContact O-N 3.29Å; V18-L20 PolarHBondContact O-N 3.42Å | ||
| 19 | V | 50.5 | Low | 50 | Low | 112 Ų | 112 | 125.6 Ų | 125.6 | 68% | 0.679 | 75% | 0.747 | S | S | * | * | trans | -57.3 | 85.3 | 163.9 | 178.5 | 0 | 0 | 0 | 0 | 106.4 | E17 S21 | E17-V19 HydrophobicContact CG-CG2 4.1Å; E17-V19 PolarHBondContact O-N 2.83Å; V19-S21 PolarHBondContact O-N 3.05Å | ||
| 20 | L | 48.9 | Very low | 51.9 | Low | 147 Ų | 147 | 125.5 Ų | 125.5 | 77% | 0.77 | 75% | 0.749 | S | S | * | * | trans | -64.3 | 92.2 | 163.1 | -90.2 | 142.1 | 0 | 0 | 0 | 104.4 | V18 S22 | V18-L20 PolarHBondContact O-N 3.42Å; L20-S22 PolarHBondContact O-N 3.45Å | ||
| 21 | S | 46.8 | Very low | 53.4 | Low | 91 Ų | 91 | 125.7 Ų | 125.7 | 64% | 0.636 | 74% | 0.737 | S | S | * | * | trans | -62.2 | 60.9 | 163.4 | -177.7 | 0 | 0 | 0 | 0 | 109.3 | V19 | V19-S21 PolarHBondContact O-N 3.05Š| ||
| 22 | S | 49.4 | Very low | 55.5 | Low | 101 Ų | 101 | 121.3 Ų | 121.3 | 71% | 0.706 | 71% | 0.714 | S | S | * | * | trans | -90.5 | 29.9 | 160.1 | -156.4 | 0 | 0 | 0 | 0 | 109.3 | L20 F24 | L20-S22 PolarHBondContact O-N 3.45Å; S22-F24 PolarHBondContact O-N 3.35Å; S22-F24 VanDerWaalsContact O-N 3.15Å | ||
| 23 | Q | 52.7 | Low | 57 | Low | 157 Ų | 157 | 123.6 Ų | 123.6 | 73% | 0.734 | 72% | 0.715 | S | S | * | * | trans | -85.2 | 53.2 | 172 | -171.9 | 155.2 | 6.7 | 0 | 0 | 110.1 | ||||
| 24 | F | 47.4 | Very low | 58.7 | Low | 196 Ų | 196 | 123.4 Ų | 123.4 | 86% | 0.86 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -147.7 | 100.6 | 159.1 | -73.7 | -73.2 | 0 | 0 | 0 | 106.1 | S22 | S22-F24 PolarHBondContact O-N 3.35Å; S22-F24 VanDerWaalsContact O-N 3.15Å |
| 25 | G | 49.5 | Very low | 60.8 | Low | 52 Ų | 52 | 125.1 Ų | 125.1 | 54% | 0.536 | 69% | 0.689 | S | S | . | * | trans | 136.1 | 2.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | E27 E28 | G25-E27 PolarHBondContact O-N 2.93Å; G25-E28 PolarHBondContact O-N 2.98Å | ||
| 26 | S | 49.3 | Very low | 62.5 | Low | 110 Ų | 110 | 125.9 Ų | 125.9 | 77% | 0.769 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | 41.2 | 178.7 | 66.9 | 0 | 0 | 0 | 0 | 114.3 | ||
| 27 | E | 54.7 | Low | 64.7 | Low | 199 Ų | 199 | 128.6 Ų | 128.6 | 93% | 0.93 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -145.8 | 3.1 | 167.2 | -75.9 | -166.8 | 151.6 | 0 | 0 | 113.6 | G25 | G25-E27 PolarHBondContact O-N 2.93Š|
| 28 | E | 67.3 | Low | 66 | Low | 154 Ų | 154 | 126.9 Ų | 126.9 | 72% | 0.72 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -96.1 | 138.3 | 169.6 | -123.8 | 131.9 | -153.8 | 0 | 0 | 108.8 | G25 | G25-E28 PolarHBondContact O-N 2.98Š|
| 29 | D | 79.4 | Confident | 67.6 | Low | 89 Ų | 89 | 125.7 Ų | 125.7 | 48% | 0.476 | 65% | 0.654 | S | S | . | * | trans | -42.1 | 124.1 | 179.4 | -179 | 0.8 | 0 | 0 | 0 | 110 | F31 A32 | D29-F31 PolarHBondContact O-N 3.4Å; D29-F31 WeakPolarHBondContact OD1-CD2 3.3Å; D29-F31 PolarHBondContact OD1-N 3.06Å; D29-F31 VanDerWaalsContact OD1-N 3.1Å; D29-A32 HydrophobicContact CB-CB 4.3Å; D29-A32 WeakPolarHBondContact O-CB 3.45Å; D29-A32 PolarHBondContact O-N 3.34Å | ||
| 30 | P | 83.2 | Confident | 69.4 | Low | 117 Ų | 117 | 124.4 Ų | 124.4 | 76% | 0.76 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.4 | -15.2 | 177.6 | -25.8 | 33.9 | 0 | 0 | 0 | 113.9 | ||
| 31 | F | 84.8 | Confident | 71.2 | Confident | 130 Ų | 130 | 125.1 Ų | 125.1 | 57% | 0.57 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.4 | 5.1 | 175.6 | -55.3 | -73.5 | 0 | 0 | 0 | 114.4 | D29 E33 Y34 M35 | D29-F31 PolarHBondContact O-N 3.4Å; D29-F31 WeakPolarHBondContact OD1-CD2 3.3Å; D29-F31 PolarHBondContact OD1-N 3.06Å; D29-F31 VanDerWaalsContact OD1-N 3.1Å; F31-E33 PolarHBondContact O-N 3.05Å; F31-Y34 HydrophobicContact CD1-CD2 4.18Å; F31-Y34 WeakPolarHBondContact O-CA 3.46Å; F31-Y34 WeakPolarHBondContact O-CB 3.28Å; F31-Y34 PolarHBondContact O-N 3.48Å; F31-M35 PolarHBondContact O-N 3.48Å |
| 32 | A | 84.6 | Confident | 73.2 | Confident | 39 Ų | 39 | 124.5 Ų | 124.5 | 32% | 0.322 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -55.1 | -37.5 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | D29 M35 W36 | D29-A32 HydrophobicContact CB-CB 4.3Å; D29-A32 WeakPolarHBondContact O-CB 3.45Å; D29-A32 PolarHBondContact O-N 3.34Å; A32-M35 PolarHBondContact O-N 3.47Å; A32-W36 WeakPolarHBondContact O-CB 3.4Å; A32-W36 PolarHBondContact O-N 2.99Å |
| 33 | E | 80.3 | Confident | 75.3 | Confident | 164 Ų | 164 | 125.2 Ų | 125.2 | 77% | 0.766 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -68 | -34.5 | 175.7 | -171 | 169.8 | -176.4 | 0 | 0 | 112.5 | F31 M37 | F31-E33 PolarHBondContact O-N 3.05Å; E33-M37 WeakPolarHBondContact O-CB 3.2Å; E33-M37 PolarHBondContact O-N 2.99Å |
| 34 | Y | 79.5 | Confident | 77.2 | Confident | 153 Ų | 153 | 121.8 Ų | 121.8 | 60% | 0.6 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -73.7 | -37.3 | 174.9 | -68.6 | -74.5 | 0 | 0 | 0 | 112.3 | F31 W36 M37 E38 | F31-Y34 HydrophobicContact CD1-CD2 4.18Å; F31-Y34 WeakPolarHBondContact O-CA 3.46Å; F31-Y34 WeakPolarHBondContact O-CB 3.28Å; F31-Y34 PolarHBondContact O-N 3.48Å; Y34-W36 VanDerWaalsContact C-N 3.35Å; Y34-M37 HydrophobicContact CD1-CE 3.96Å; Y34-M37 PolarHBondContact O-N 3.06Å; Y34-E38 PolarHBondContact O-N 3.25Å |
| 35 | M | 82.3 | Confident | 79.4 | Confident | 100 Ų | 100 | 118.8 Ų | 118.8 | 49% | 0.493 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -66.6 | -38.7 | 172.6 | -66.4 | -65.3 | -64.9 | 0 | 0 | 111 | F31 A32 E38 N39 | F31-M35 PolarHBondContact O-N 3.48Å; A32-M35 PolarHBondContact O-N 3.47Å; M35-E38 PolarHBondContact O-N 3.09Å; M35-N39 PolarHBondContact O-N 3.26Å; M35-N39 PolarHBondContact O-OD1 3.15Å |
| 36 | W | 82.4 | Confident | 81.6 | Confident | 172 Ų | 172 | 121.8 Ų | 121.8 | 65% | 0.652 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -59.8 | -49.1 | 172.2 | -175.3 | -59.9 | 0 | 0 | 0 | 110.7 | A32 Y34 E38 N39 E40 | A32-W36 WeakPolarHBondContact O-CB 3.4Å; A32-W36 PolarHBondContact O-N 2.99Å; Y34-W36 VanDerWaalsContact C-N 3.35Å; W36-E38 PolarHBondContact O-N 3.1Å; W36-N39 CarbonylContact O-C 3.54Å; W36-N39 WeakPolarHBondContact O-CA 3.25Å; W36-N39 PolarHBondContact O-N 3.29Å; W36-E40 WeakPolarHBondContact O-CA 3.22Å; W36-E40 WeakPolarHBondContact O-CB 3.44Å; W36-E40 PolarHBondContact O-N 3.01Å |
| 37 | M | 83.6 | Confident | 83.8 | Confident | 117 Ų | 117 | 119.3 Ų | 119.3 | 58% | 0.576 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -60.8 | -31 | -179 | -171.6 | -178.7 | 59.6 | 0 | 0 | 112.9 | E33 Y34 | E33-M37 WeakPolarHBondContact O-CB 3.2Å; E33-M37 PolarHBondContact O-N 2.99Å; Y34-M37 HydrophobicContact CD1-CE 3.96Å; Y34-M37 PolarHBondContact O-N 3.06Å |
| 38 | E | 79.9 | Confident | 85.7 | Confident | 148 Ų | 148 | 116.8 Ų | 116.8 | 69% | 0.692 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -69.3 | -35.6 | 172.1 | -175.7 | 174.4 | -156.6 | 0 | 0 | 112.3 | Y34 M35 W36 | Y34-E38 PolarHBondContact O-N 3.25Å; M35-E38 PolarHBondContact O-N 3.09Å; W36-E38 PolarHBondContact O-N 3.1Å |
| 39 | N | 82.3 | Confident | 87 | Confident | 91 Ų | 91 | 114.7 Ų | 114.7 | 49% | 0.487 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -95 | -7.1 | -178.6 | -75.3 | 97.7 | 0 | 0 | 0 | 114.6 | M35 W36 E41 E42 F43 | M35-N39 PolarHBondContact O-N 3.26Å; M35-N39 PolarHBondContact O-OD1 3.15Å; W36-N39 CarbonylContact O-C 3.54Å; W36-N39 WeakPolarHBondContact O-CA 3.25Å; W36-N39 PolarHBondContact O-N 3.29Å; N39-E41 PolarHBondContact O-N 2.91Å; N39-E42 WeakPolarHBondContact O-CB 3.33Å; N39-E42 PolarHBondContact O-N 2.74Å; N39-F43 PolarHBondContact O-N 3.31Å |
| 40 | E | 89.4 | Confident | 87.7 | Confident | 86 Ų | 86 | 116 Ų | 116 | 40% | 0.402 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.8 | -43.2 | -173 | -175 | -179.8 | -165.9 | 0 | 0 | 111.7 | W36 E42 F43 N44 | W36-E40 WeakPolarHBondContact O-CA 3.22Å; W36-E40 WeakPolarHBondContact O-CB 3.44Å; W36-E40 PolarHBondContact O-N 3.01Å; E40-E42 VanDerWaalsContact C-N 3.31Å; E40-E42 PolarHBondContact O-N 2.96Å; E40-F43 PolarHBondContact O-N 3.14Å; E40-N44 WeakPolarHBondContact O-CB 3.37Å; E40-N44 VanDerWaalsContact O-CG 3.22Å; E40-N44 PolarHBondContact O-N 3.27Å; E40-N44 PolarHBondContact O-ND2 3.04Å |
| 41 | E | 86.4 | Confident | 88.3 | Confident | 162 Ų | 162 | 115.8 Ų | 115.8 | 76% | 0.757 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -65.4 | -34.4 | 178.9 | -65 | -175.2 | 176.5 | 0 | 0 | 112.2 | N39 R45 | N39-E41 PolarHBondContact O-N 2.91Å; E41-R45 PolarHBondContact O-N 3.23Å; E41-R45 VanDerWaalsContact O-N 3.12Å |
| 42 | E | 88.9 | Confident | 88.9 | Confident | 78 Ų | 78 | 117.3 Ų | 117.3 | 36% | 0.364 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -69.5 | -45 | 176.3 | -175.8 | 63.5 | -147.9 | 0 | 0 | 111.2 | N39 E40 R45 Q46 | N39-E42 WeakPolarHBondContact O-CB 3.33Å; N39-E42 PolarHBondContact O-N 2.74Å; E40-E42 VanDerWaalsContact C-N 3.31Å; E40-E42 PolarHBondContact O-N 2.96Å; E42-R45 PolarHBondContact O-N 3.03Å; E42-R45 IonicContact OE1-CZ 3.43Å; E42-R45 IonicContact OE1-NE 3.91Å; E42-R45 IonicContact OE1-NH2 2.67Å; E42-R45 PolarHBondContact OE1-NH2 2.95Å; E42-R45 IonicContact OE2-CZ 3.07Å; E42-R45 IonicContact OE2-NH1 3.12Å; E42-R45 PolarHBondContact OE2-NH1 3.3Å; E42-R45 VanDerWaalsContact OE2-NH1 3.12Å; E42-R45 IonicContact OE2-NH2 2.6Å; E42-R45 PolarHBondContact OE2-NH2 3.26Å; E42-Q46 WeakPolarHBondContact O-CB 3.37Å; E42-Q46 PolarHBondContact O-N 3.1Å |
| 43 | F | 92.9 | Very high | 89.4 | Confident | 115 Ų | 115 | 120.2 Ų | 120.2 | 50% | 0.504 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -60.3 | -46.9 | 176.9 | 178 | -95.8 | 0 | 0 | 0 | 111.1 | N39 E40 R45 Q46 V47 | N39-F43 PolarHBondContact O-N 3.31Å; E40-F43 PolarHBondContact O-N 3.14Å; F43-R45 VanDerWaalsContact C-N 3.32Å; F43-R45 PolarHBondContact O-N 3.25Å; F43-Q46 PolarHBondContact O-N 3.17Å; F43-V47 HydrophobicContact CD1-CG2 4.16Å; F43-V47 HydrophobicContact CE1-CG2 3.71Å; F43-V47 HydrophobicContact CE2-CG2 4.09Å; F43-V47 HydrophobicContact CZ-CG2 3.67Å; F43-V47 WeakPolarHBondContact O-CG2 3.31Å; F43-V47 PolarHBondContact O-N 3.35Å |
| 44 | N | 92.9 | Very high | 90.1 | Very high | 85 Ų | 85 | 117.6 Ų | 117.6 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -60.2 | -42.4 | 178.4 | -71.3 | -20.6 | 0 | 0 | 0 | 111.9 | E40 V47 E48 | E40-N44 WeakPolarHBondContact O-CB 3.37Å; E40-N44 VanDerWaalsContact O-CG 3.22Å; E40-N44 PolarHBondContact O-N 3.27Å; E40-N44 PolarHBondContact O-ND2 3.04Å; N44-V47 PolarHBondContact O-N 3.14Å; N44-E48 WeakPolarHBondContact O-CB 3.39Å; N44-E48 PolarHBondContact O-N 3.46Å |
| 45 | R | 94.9 | Very high | 90.9 | Very high | 133 Ų | 133 | 116 Ų | 116 | 50% | 0.502 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.9 | -43.6 | 176.2 | -175.1 | 175.8 | 74 | -135.9 | 9.8 | 111.9 | E41 E42 F43 E48 E49 | E41-R45 PolarHBondContact O-N 3.23Å; E41-R45 VanDerWaalsContact O-N 3.12Å; E42-R45 PolarHBondContact O-N 3.03Å; E42-R45 IonicContact OE1-CZ 3.43Å; E42-R45 IonicContact OE1-NE 3.91Å; E42-R45 IonicContact OE1-NH2 2.67Å; E42-R45 PolarHBondContact OE1-NH2 2.95Å; E42-R45 IonicContact OE2-CZ 3.07Å; E42-R45 IonicContact OE2-NH1 3.12Å; E42-R45 PolarHBondContact OE2-NH1 3.3Å; E42-R45 VanDerWaalsContact OE2-NH1 3.12Å; E42-R45 IonicContact OE2-NH2 2.6Å; E42-R45 PolarHBondContact OE2-NH2 3.26Å; F43-R45 VanDerWaalsContact C-N 3.32Å; F43-R45 PolarHBondContact O-N 3.25Å; R45-E48 PolarHBondContact O-N 3.25Å; R45-E49 WeakPolarHBondContact O-CB 3.38Å; R45-E49 PolarHBondContact O-N 3.47Å |
| 46 | Q | 94.7 | Very high | 91.6 | Very high | 116 Ų | 116 | 116 Ų | 116 | 54% | 0.542 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.2 | -41.4 | -179 | -167.5 | 168.3 | 80.6 | 0 | 0 | 111.6 | E42 F43 E49 E50 | E42-Q46 WeakPolarHBondContact O-CB 3.37Å; E42-Q46 PolarHBondContact O-N 3.1Å; F43-Q46 PolarHBondContact O-N 3.17Å; Q46-E49 PolarHBondContact O-N 3.25Å; Q46-E50 WeakPolarHBondContact O-CB 3.4Å; Q46-E50 PolarHBondContact O-N 2.81Å |
| 47 | V | 95.8 | Very high | 92.2 | Very high | 58 Ų | 58 | 112.4 Ų | 112.4 | 35% | 0.352 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.2 | -41.2 | 174 | 171.9 | 0 | 0 | 0 | 0 | 111.4 | F43 N44 E50 L51 | F43-V47 HydrophobicContact CD1-CG2 4.16Å; F43-V47 HydrophobicContact CE1-CG2 3.71Å; F43-V47 HydrophobicContact CE2-CG2 4.09Å; F43-V47 HydrophobicContact CZ-CG2 3.67Å; F43-V47 WeakPolarHBondContact O-CG2 3.31Å; F43-V47 PolarHBondContact O-N 3.35Å; N44-V47 PolarHBondContact O-N 3.14Å; V47-E50 PolarHBondContact O-N 3.19Å; V47-L51 PolarHBondContact O-N 2.94Å |
| 48 | E | 94.1 | Very high | 92.8 | Very high | 145 Ų | 145 | 113.7 Ų | 113.7 | 68% | 0.678 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.6 | -40.3 | 176.9 | -173.9 | 174.6 | -152.8 | 0 | 0 | 112 | N44 R45 L51 W52 | N44-E48 WeakPolarHBondContact O-CB 3.39Å; N44-E48 PolarHBondContact O-N 3.46Å; R45-E48 PolarHBondContact O-N 3.25Å; E48-L51 PolarHBondContact O-N 3.12Å; E48-W52 PolarHBondContact O-N 3.11Å; E48-W52 VanDerWaalsContact O-N 3.08Å |
| 49 | E | 94.4 | Very high | 93.6 | Very high | 111 Ų | 111 | 114.4 Ų | 114.4 | 52% | 0.519 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.9 | -45.9 | 175.4 | -174.4 | 172.1 | -162.1 | 0 | 0 | 111.6 | R45 Q46 L51 W52 E53 | R45-E49 WeakPolarHBondContact O-CB 3.38Å; R45-E49 PolarHBondContact O-N 3.47Å; Q46-E49 PolarHBondContact O-N 3.25Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 2.77Å; E49-W52 WeakPolarHBondContact O-CB 3.33Å; E49-W52 PolarHBondContact O-N 3.36Å; E49-W52 VanDerWaalsContact O-N 3.15Å; E49-E53 WeakPolarHBondContact O-CG 3.49Å; E49-E53 PolarHBondContact O-N 3.32Å |
| 50 | E | 94.3 | Very high | 94.2 | Very high | 115 Ų | 115 | 112.8 Ų | 112.8 | 54% | 0.537 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.4 | -44.5 | 176.3 | -172.9 | 172.3 | -162 | 0 | 0 | 111.4 | Q46 V47 W52 E53 E54 | Q46-E50 WeakPolarHBondContact O-CB 3.4Å; Q46-E50 PolarHBondContact O-N 2.81Å; V47-E50 PolarHBondContact O-N 3.19Å; E50-W52 VanDerWaalsContact C-N 3.27Å; E50-W52 PolarHBondContact O-N 3.17Å; E50-E53 PolarHBondContact O-N 2.77Å; E50-E54 WeakPolarHBondContact O-CG 3.45Å; E50-E54 PolarHBondContact O-N 3.37Å |
| 51 | L | 95.9 | Very high | 94.4 | Very high | 114 Ų | 114 | 114.8 Ų | 114.8 | 60% | 0.597 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.1 | -36.7 | 177.4 | -142.1 | 105.9 | 0 | 0 | 0 | 112.3 | V47 E48 E49 E55 | V47-L51 PolarHBondContact O-N 2.94Å; E48-L51 PolarHBondContact O-N 3.12Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 2.77Å; L51-E55 PolarHBondContact O-N 3.17Å; L51-E55 VanDerWaalsContact O-N 3.09Å |
| 52 | W | 97.2 | Very high | 94.7 | Very high | 161 Ų | 161 | 111.8 Ų | 111.8 | 61% | 0.61 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -69.7 | -40.1 | 177.6 | -171.2 | 88.3 | 0 | 0 | 0 | 112 | E48 E49 E50 E54 E55 F56 | E48-W52 PolarHBondContact O-N 3.11Å; E48-W52 VanDerWaalsContact O-N 3.08Å; E49-W52 WeakPolarHBondContact O-CB 3.33Å; E49-W52 PolarHBondContact O-N 3.36Å; E49-W52 VanDerWaalsContact O-N 3.15Å; E50-W52 VanDerWaalsContact C-N 3.27Å; E50-W52 PolarHBondContact O-N 3.17Å; W52-E54 VanDerWaalsContact C-N 3.35Å; W52-E55 PolarHBondContact O-N 3.48Å; W52-F56 HydrophobicContact CH2-CD2 4.41Å; W52-F56 HydrophobicContact CZ3-CB 4.37Å; W52-F56 WeakPolarHBondContact O-CB 3.41Å; W52-F56 PolarHBondContact O-N 2.84Å |
| 53 | E | 95.8 | Very high | 94.8 | Very high | 100 Ų | 100 | 113.6 Ų | 113.6 | 47% | 0.467 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.7 | -41.4 | 173.8 | -71.6 | -173.3 | 176.7 | 0 | 0 | 111.9 | E49 E50 F56 M57 | E49-E53 WeakPolarHBondContact O-CG 3.49Å; E49-E53 PolarHBondContact O-N 3.32Å; E50-E53 PolarHBondContact O-N 2.77Å; E53-F56 PolarHBondContact O-N 3.15Å; E53-M57 WeakPolarHBondContact O-CG 3.24Å; E53-M57 PolarHBondContact O-N 3.26Å |
| 54 | E | 95.2 | Very high | 94.5 | Very high | 109 Ų | 109 | 113.9 Ų | 113.9 | 51% | 0.509 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -60.4 | -49.3 | 175.1 | -72.8 | -173.4 | 164.7 | 0 | 0 | 111.8 | E50 W52 F56 M57 E58 | E50-E54 WeakPolarHBondContact O-CG 3.45Å; E50-E54 PolarHBondContact O-N 3.37Å; W52-E54 VanDerWaalsContact C-N 3.35Å; E54-F56 VanDerWaalsContact C-N 3.28Å; E54-F56 PolarHBondContact O-N 2.61Å; E54-M57 PolarHBondContact O-N 2.8Å; E54-E58 PolarHBondContact O-N 2.95Å |
| 55 | E | 94.7 | Very high | 94.2 | Very high | 119 Ų | 119 | 114.3 Ų | 114.3 | 56% | 0.556 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -60.7 | -40 | 176.9 | -172.7 | -173.4 | -179.9 | 0 | 0 | 111.4 | L51 W52 R59 | L51-E55 PolarHBondContact O-N 3.17Å; L51-E55 VanDerWaalsContact O-N 3.09Å; W52-E55 PolarHBondContact O-N 3.48Å; E55-R59 PolarHBondContact O-N 2.93Å; E55-R59 VanDerWaalsContact O-N 3.12Å |
| 56 | F | 97.4 | Very high | 93.9 | Very high | 102 Ų | 102 | 111 Ų | 111 | 45% | 0.447 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.4 | -47.6 | 177.1 | 175.9 | -97.8 | 0 | 0 | 0 | 111.7 | W52 E53 E54 R59 C60 | W52-F56 HydrophobicContact CH2-CD2 4.41Å; W52-F56 HydrophobicContact CZ3-CB 4.37Å; W52-F56 WeakPolarHBondContact O-CB 3.41Å; W52-F56 PolarHBondContact O-N 2.84Å; E53-F56 PolarHBondContact O-N 3.15Å; E54-F56 VanDerWaalsContact C-N 3.28Å; E54-F56 PolarHBondContact O-N 2.61Å; F56-R59 PolarHBondContact O-N 3.15Å; F56-C60 VanDerWaalsContact CZ-SG 3.58Å; F56-C60 PolarHBondContact O-N 2.86Å; F56-C60 PolarHBondContact O-SG 3.16Å; F56-C60 VanDerWaalsContact O-SG 3.42Å |
| 57 | M | 96.4 | Very high | 93.3 | Very high | 96 Ų | 96 | 109.5 Ų | 109.5 | 47% | 0.473 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 178.4 | -76.8 | -169.8 | -74.7 | 0 | 0 | 112.1 | E53 E54 R59 C60 F61 | E53-M57 WeakPolarHBondContact O-CG 3.24Å; E53-M57 PolarHBondContact O-N 3.26Å; E54-M57 PolarHBondContact O-N 2.8Å; M57-R59 VanDerWaalsContact C-N 3.29Å; M57-R59 PolarHBondContact O-N 3.44Å; M57-C60 WeakPolarHBondContact O-CB 3.4Å; M57-C60 PolarHBondContact O-N 3.14Å; M57-C60 VanDerWaalsContact O-N 3.15Å; M57-F61 HydrophobicContact CB-CE2 4.42Å; M57-F61 WeakPolarHBondContact O-CD2 2.97Å; M57-F61 PolarHBondContact O-N 3.43Å |
| 58 | E | 96 | Very high | 92.2 | Very high | 143 Ų | 143 | 112.4 Ų | 112.4 | 67% | 0.668 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -59.7 | -42.2 | 178.3 | -170.3 | 168.9 | -150.3 | 0 | 0 | 111.2 | E54 F61 Q62 | E54-E58 PolarHBondContact O-N 2.95Å; E58-F61 PolarHBondContact O-N 3.43Å; E58-Q62 PolarHBondContact O-N 3.37Å |
| 59 | R | 95.3 | Very high | 91.4 | Very high | 163 Ų | 163 | 112.4 Ų | 112.4 | 62% | 0.615 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.7 | -37.4 | 175.5 | -171.6 | 155.8 | 60.5 | 174.2 | -4.2 | 113.2 | E55 F56 M57 Q62 Q63 | E55-R59 PolarHBondContact O-N 2.93Å; E55-R59 VanDerWaalsContact O-N 3.12Å; F56-R59 PolarHBondContact O-N 3.15Å; M57-R59 VanDerWaalsContact C-N 3.29Å; M57-R59 PolarHBondContact O-N 3.44Å; R59-Q62 PolarHBondContact O-N 3.14Å; R59-Q63 PolarHBondContact O-N 2.86Å |
| 60 | C | 95.1 | Very high | 90.2 | Very high | 57 Ų | 57 | 114.7 Ų | 114.7 | 39% | 0.385 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.5 | -43.6 | 174 | -75 | 0 | 0 | 0 | 0 | 112.2 | F56 M57 M64 | F56-C60 VanDerWaalsContact CZ-SG 3.58Å; F56-C60 PolarHBondContact O-N 2.86Å; F56-C60 PolarHBondContact O-SG 3.16Å; F56-C60 VanDerWaalsContact O-SG 3.42Å; M57-C60 WeakPolarHBondContact O-CB 3.4Å; M57-C60 PolarHBondContact O-N 3.14Å; M57-C60 VanDerWaalsContact O-N 3.15Å; C60-M64 PolarHBondContact O-N 2.78Å; C60-M64 VanDerWaalsContact O-N 3.14Å |
| 61 | F | 93.9 | Very high | 88.8 | Confident | 128 Ų | 128 | 118.4 Ų | 118.4 | 56% | 0.561 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.6 | -42.8 | 176.2 | -72.7 | -60 | 0 | 0 | 0 | 111.8 | M57 E58 Q63 M64 L65 | M57-F61 HydrophobicContact CB-CE2 4.42Å; M57-F61 WeakPolarHBondContact O-CD2 2.97Å; M57-F61 PolarHBondContact O-N 3.43Å; E58-F61 PolarHBondContact O-N 3.43Å; F61-Q63 VanDerWaalsContact C-N 3.34Å; F61-Q63 PolarHBondContact O-N 3.24Å; F61-M64 WeakPolarHBondContact O-CB 3.43Å; F61-M64 PolarHBondContact O-N 2.91Å; F61-M64 VanDerWaalsContact O-N 3.15Å; F61-L65 WeakPolarHBondContact O-CG 3.43Å; F61-L65 PolarHBondContact O-N 3.47Å |
| 62 | Q | 93.8 | Very high | 87 | Confident | 100 Ų | 100 | 120.3 Ų | 120.3 | 47% | 0.467 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -59.7 | -45.7 | 178.1 | -166.3 | 65.7 | 55.3 | 0 | 0 | 111.4 | E58 R59 M64 L65 D66 | E58-Q62 PolarHBondContact O-N 3.37Å; R59-Q62 PolarHBondContact O-N 3.14Å; Q62-M64 VanDerWaalsContact C-N 3.3Å; Q62-M64 PolarHBondContact O-N 3.09Å; Q62-L65 PolarHBondContact O-N 2.86Å; Q62-D66 PolarHBondContact NE2-OD1 3.12Å; Q62-D66 WeakPolarHBondContact O-CB 3.12Å; Q62-D66 PolarHBondContact O-N 2.97Å |
| 63 | Q | 90.6 | Very high | 85.1 | Confident | 115 Ų | 115 | 123.4 Ų | 123.4 | 54% | 0.537 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -60.2 | -40.9 | 176 | -179.6 | 177.1 | -24 | 0 | 0 | 112 | R59 F61 D66 E67 | R59-Q63 PolarHBondContact O-N 2.86Å; F61-Q63 VanDerWaalsContact C-N 3.34Å; F61-Q63 PolarHBondContact O-N 3.24Å; Q63-D66 PolarHBondContact O-N 3.26Å; Q63-E67 HydrophobicContact CG-CG 4.46Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.23Å; Q63-E67 PolarHBondContact NE2-OE1 2.99Å; Q63-E67 WeakPolarHBondContact O-CB 3.49Å; Q63-E67 VanDerWaalsContact O-CG 3.25Å; Q63-E67 WeakPolarHBondContact O-CG 3.42Å; Q63-E67 PolarHBondContact O-N 3.33Å |
| 64 | M | 86.4 | Confident | 83 | Confident | 121 Ų | 121 | 126.3 Ų | 126.3 | 60% | 0.596 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -64.6 | -40.5 | 177.7 | -171.3 | -174.1 | -54.6 | 0 | 0 | 112.3 | C60 F61 Q62 E67 E68 | C60-M64 PolarHBondContact O-N 2.78Å; C60-M64 VanDerWaalsContact O-N 3.14Å; F61-M64 WeakPolarHBondContact O-CB 3.43Å; F61-M64 PolarHBondContact O-N 2.91Å; F61-M64 VanDerWaalsContact O-N 3.15Å; Q62-M64 VanDerWaalsContact C-N 3.3Å; Q62-M64 PolarHBondContact O-N 3.09Å; M64-E67 PolarHBondContact O-N 3.17Å; M64-E68 PolarHBondContact O-N 3.35Å |
| 65 | L | 87.1 | Confident | 81.1 | Confident | 94 Ų | 94 | 126.1 Ų | 126.1 | 49% | 0.492 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -67.2 | -44.2 | 175.8 | -71.2 | 173.6 | 0 | 0 | 0 | 111.5 | F61 Q62 E67 E68 E69 | F61-L65 WeakPolarHBondContact O-CG 3.43Å; F61-L65 PolarHBondContact O-N 3.47Å; Q62-L65 PolarHBondContact O-N 2.86Å; L65-E67 VanDerWaalsContact C-N 3.28Å; L65-E67 PolarHBondContact O-N 3.14Å; L65-E68 PolarHBondContact O-N 3Å; L65-E68 VanDerWaalsContact O-N 3.16Å; L65-E69 PolarHBondContact O-N 3.37Å |
| 66 | D | 87.8 | Confident | 79.2 | Confident | 65 Ų | 65 | 122.6 Ų | 122.6 | 35% | 0.348 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.3 | -36 | 177.3 | -67.4 | 1.1 | 0 | 0 | 0 | 111 | Q62 Q63 Q70 | Q62-D66 PolarHBondContact NE2-OD1 3.12Å; Q62-D66 WeakPolarHBondContact O-CB 3.12Å; Q62-D66 PolarHBondContact O-N 2.97Å; Q63-D66 PolarHBondContact O-N 3.26Å; D66-Q70 VanDerWaalsContact O-CG 3.23Å; D66-Q70 WeakPolarHBondContact O-CG 3.47Å; D66-Q70 PolarHBondContact O-N 3Å; D66-Q70 VanDerWaalsContact O-N 3.17Å; D66-Q70 PolarHBondContact O-NE2 3.38Å; D66-Q70 VanDerWaalsContact O-NE2 3.14Å |
| 67 | E | 82.5 | Confident | 77.2 | Confident | 84 Ų | 84 | 122.5 Ų | 122.5 | 39% | 0.393 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -62.9 | -52.3 | 169.8 | -77.2 | 176 | -155.5 | 0 | 0 | 109.9 | Q63 M64 L65 E69 Q70 W71 | Q63-E67 HydrophobicContact CG-CG 4.46Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.23Å; Q63-E67 PolarHBondContact NE2-OE1 2.99Å; Q63-E67 WeakPolarHBondContact O-CB 3.49Å; Q63-E67 VanDerWaalsContact O-CG 3.25Å; Q63-E67 WeakPolarHBondContact O-CG 3.42Å; Q63-E67 PolarHBondContact O-N 3.33Å; M64-E67 PolarHBondContact O-N 3.17Å; L65-E67 VanDerWaalsContact C-N 3.28Å; L65-E67 PolarHBondContact O-N 3.14Å; E67-E69 VanDerWaalsContact C-N 3.34Å; E67-E69 PolarHBondContact O-N 2.96Å; E67-Q70 CarbonylContact O-C 3.08Å; E67-Q70 WeakPolarHBondContact O-CB 3.45Å; E67-Q70 PolarHBondContact O-N 3.01Å; E67-Q70 VanDerWaalsContact O-N 3.09Å; E67-W71 PolarHBondContact O-N 3.42Å |
| 68 | E | 72.8 | Confident | 75.3 | Confident | 118 Ų | 118 | 127.7 Ų | 127.7 | 55% | 0.551 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -58.2 | -40 | 179.1 | -174.8 | 178.3 | -155.2 | 0 | 0 | 113.3 | M64 L65 Q70 W71 E72 | M64-E68 PolarHBondContact O-N 3.35Å; L65-E68 PolarHBondContact O-N 3Å; L65-E68 VanDerWaalsContact O-N 3.16Å; E68-Q70 VanDerWaalsContact C-N 3.33Å; E68-Q70 PolarHBondContact O-N 3.15Å; E68-W71 CarbonylContact O-C 3.6Å; E68-W71 WeakPolarHBondContact O-CA 3.45Å; E68-W71 PolarHBondContact O-N 2.91Å; E68-W71 VanDerWaalsContact O-N 3.17Å; E68-E72 PolarHBondContact O-N 3.41Å; E68-E72 VanDerWaalsContact O-N 3.15Å |
| 69 | E | 76.8 | Confident | 73.4 | Confident | 145 Ų | 145 | 125.4 Ų | 125.4 | 68% | 0.678 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -62.9 | -40.1 | 175.3 | -174.1 | 176.5 | -158.4 | 0 | 0 | 111.3 | L65 E67 W71 E72 | L65-E69 PolarHBondContact O-N 3.37Å; E67-E69 VanDerWaalsContact C-N 3.34Å; E67-E69 PolarHBondContact O-N 2.96Å; E69-W71 VanDerWaalsContact C-N 3.35Å; E69-E72 WeakPolarHBondContact O-CB 3.43Å; E69-E72 PolarHBondContact O-N 3.34Å; E69-E72 VanDerWaalsContact O-N 3.14Å |
| 70 | Q | 68.9 | Low | 71.5 | Confident | 159 Ų | 159 | 120.3 Ų | 120.3 | 74% | 0.743 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -70.6 | -32 | 173.5 | -70.2 | 169 | 49.2 | 0 | 0 | 112.6 | D66 E67 E68 E72 | D66-Q70 VanDerWaalsContact O-CG 3.23Å; D66-Q70 WeakPolarHBondContact O-CG 3.47Å; D66-Q70 PolarHBondContact O-N 3Å; D66-Q70 VanDerWaalsContact O-N 3.17Å; D66-Q70 PolarHBondContact O-NE2 3.38Å; D66-Q70 VanDerWaalsContact O-NE2 3.14Å; E67-Q70 CarbonylContact O-C 3.08Å; E67-Q70 WeakPolarHBondContact O-CB 3.45Å; E67-Q70 PolarHBondContact O-N 3.01Å; E67-Q70 VanDerWaalsContact O-N 3.09Å; E68-Q70 VanDerWaalsContact C-N 3.33Å; E68-Q70 PolarHBondContact O-N 3.15Å; Q70-E72 PolarHBondContact O-N 2.85Å |
| 71 | W | 64.8 | Low | 69.8 | Low | 194 Ų | 194 | 119.8 Ų | 119.8 | 74% | 0.735 | 56% | 0.561 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | 29.4 | 168.3 | -59.6 | 110.6 | 0 | 0 | 0 | 111.7 | E67 E68 E69 W73 | E67-W71 PolarHBondContact O-N 3.42Å; E68-W71 CarbonylContact O-C 3.6Å; E68-W71 WeakPolarHBondContact O-CA 3.45Å; E68-W71 PolarHBondContact O-N 2.91Å; E68-W71 VanDerWaalsContact O-N 3.17Å; E69-W71 VanDerWaalsContact C-N 3.35Å; W71-W73 PolarHBondContact O-N 2.86Å |
| 72 | E | 58.3 | Low | 68.2 | Low | 154 Ų | 154 | 120.7 Ų | 120.7 | 72% | 0.72 | 58% | 0.58 | S | S | * | * | trans | -30.6 | 113.9 | 161 | -117.5 | -173.4 | -172.2 | 0 | 0 | 107.6 | E68 E69 Q70 F74 | E68-E72 PolarHBondContact O-N 3.41Å; E68-E72 VanDerWaalsContact O-N 3.15Å; E69-E72 WeakPolarHBondContact O-CB 3.43Å; E69-E72 PolarHBondContact O-N 3.34Å; E69-E72 VanDerWaalsContact O-N 3.14Å; Q70-E72 PolarHBondContact O-N 2.85Å; E72-F74 PolarHBondContact O-N 3.03Å | ||
| 73 | W | 58.5 | Low | 66.6 | Low | 225 Ų | 225 | 117.4 Ų | 117.4 | 85% | 0.852 | 57% | 0.573 | S | S | * | * | trans | -57.2 | 81.8 | -176.4 | -82.3 | 72 | 0 | 0 | 0 | 110.1 | W71 I75 | W71-W73 PolarHBondContact O-N 2.86Å; W73-I75 PolarHBondContact O-N 3.47Å | ||
| 74 | F | 50.4 | Low | 65.2 | Low | 162 Ų | 162 | 113.4 Ų | 113.4 | 71% | 0.711 | 56% | 0.563 | S | S | * | * | trans | -72.9 | 88.3 | 175.7 | -161 | -92.1 | 0 | 0 | 0 | 105.1 | E72 P76 | E72-F74 PolarHBondContact O-N 3.03Å; F74-P76 VanDerWaalsContact C-N 3.34Å; F74-P76 HydrophobicContact CD1-CB 4.16Å; F74-P76 HydrophobicContact CD1-CG 4.22Å; F74-P76 HydrophobicContact CE1-CB 4.24Å; F74-P76 WeakPolarHBondContact O-CD 3.41Å | ||
| 75 | I | 56 | Low | 64 | Low | 105 Ų | 105 | 112.9 Ų | 112.9 | 54% | 0.538 | 57% | 0.566 | S | S | . | * | trans | -61.9 | 105.3 | 157.6 | -57.4 | -179.8 | 0 | 0 | 0 | 103.6 | W73 S77 D79 L80 | W73-I75 PolarHBondContact O-N 3.47Å; I75-S77 PolarHBondContact O-N 3.34Å; I75-D79 HydrophobicContact CG2-CB 4.35Å; I75-L80 HydrophobicContact CG2-CD1 4.18Å; I75-L80 HydrophobicContact CG2-CG 4.2Å | ||
| 76 | P | 54.6 | Low | 62.8 | Low | 45 Ų | 45 | 113.4 Ų | 113.4 | 29% | 0.292 | 57% | 0.573 | S | S | . | * | trans | -59.6 | 141.3 | 178.8 | -16.4 | 32.7 | 0 | 0 | 0 | 106.9 | F74 R78 D79 | F74-P76 VanDerWaalsContact C-N 3.34Å; F74-P76 HydrophobicContact CD1-CB 4.16Å; F74-P76 HydrophobicContact CD1-CG 4.22Å; F74-P76 HydrophobicContact CE1-CB 4.24Å; F74-P76 WeakPolarHBondContact O-CD 3.41Å; P76-R78 HydrophobicContact CB-CB 4.28Å; P76-R78 PolarHBondContact O-N 3.23Å; P76-D79 WeakPolarHBondContact CD-OD2 3.25Å; P76-D79 PolarHBondContact O-N 3.43Å | ||
| 77 | S | 55.5 | Low | 61.6 | Low | 100 Ų | 100 | 114.7 Ų | 114.7 | 70% | 0.699 | 58% | 0.577 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.9 | -13.3 | 176.5 | -44.4 | 0 | 0 | 0 | 0 | 113.6 | I75 | I75-S77 PolarHBondContact O-N 3.34Š|
| 78 | R | 56.4 | Low | 60.8 | Low | 204 Ų | 204 | 113.4 Ų | 113.4 | 77% | 0.77 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -31.5 | 171.9 | -168.3 | -174.8 | 71.4 | 179.7 | -1.8 | 114.1 | P76 | P76-R78 HydrophobicContact CB-CB 4.28Å; P76-R78 PolarHBondContact O-N 3.23Å |
| 79 | D | 55.5 | Low | 60.5 | Low | 95 Ų | 95 | 113 Ų | 113 | 51% | 0.508 | 57% | 0.571 | S | S | . | * | S | Bend | trans | -100 | 0.8 | -172.8 | -56.8 | -23.1 | 0 | 0 | 0 | 112.1 | I75 P76 | I75-D79 HydrophobicContact CG2-CB 4.35Å; P76-D79 WeakPolarHBondContact CD-OD2 3.25Å; P76-D79 PolarHBondContact O-N 3.43Å |
| 80 | L | 56.7 | Low | 60 | Low | 57 Ų | 57 | 111.3 Ų | 111.3 | 30% | 0.298 | 57% | 0.567 | S | S | . | * | S | Bend | trans | -83.7 | 135.7 | 168.5 | -82.7 | 138.4 | 0 | 0 | 0 | 110.2 | I75 L88 | I75-L80 HydrophobicContact CG2-CD1 4.18Å; I75-L80 HydrophobicContact CG2-CG 4.2Å; L80-L88 HydrophobicContact CD2-CD1 3.53Å |
| 81 | P | 57.4 | Low | 59.8 | Low | 45 Ų | 45 | 108.5 Ų | 108.5 | 29% | 0.292 | 55% | 0.553 | S | S | . | * | trans | -58.8 | 147.4 | 174.2 | 23.3 | -31 | 0 | 0 | 0 | 110.2 | G83 G84 L88 | P81-G83 PolarHBondContact O-N 2.98Å; P81-G84 PolarHBondContact O-N 3.45Å; P81-G84 VanDerWaalsContact O-N 3.12Å; P81-L88 HydrophobicContact CG-CD2 4.2Å; P81-L88 HydrophobicContact CG-CG 4.14Å | ||
| 82 | P | 60.9 | Low | 59.9 | Low | 147 Ų | 147 | 103.4 Ų | 103.4 | 96% | 0.955 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | -1.1 | -172.7 | 21.1 | -31.3 | 0 | 0 | 0 | 115.4 | ||
| 83 | G | 61.2 | Low | 60.4 | Low | 31 Ų | 31 | 99.4 Ų | 99.4 | 32% | 0.32 | 53% | 0.529 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90 | -1.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | P81 T86 | P81-G83 PolarHBondContact O-N 2.98Å; G83-T86 PolarHBondContact O-OG1 2.72Å |
| 84 | G | 61 | Low | 60.6 | Low | 32 Ų | 32 | 95.5 Ų | 95.5 | 33% | 0.33 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | 68.6 | -176.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | P81 T86 Q87 | P81-G84 PolarHBondContact O-N 3.45Å; P81-G84 VanDerWaalsContact O-N 3.12Å; G84-T86 PolarHBondContact O-N 3.33Å; G84-T86 VanDerWaalsContact O-N 3.11Å; G84-Q87 PolarHBondContact O-N 3.15Å |
| 85 | V | 61.3 | Low | 61.3 | Low | 110 Ų | 110 | 94.2 Ų | 94.2 | 67% | 0.667 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.8 | -26.9 | -173 | -165.5 | 0 | 0 | 0 | 0 | 112.7 | L88 Q89 | V85-L88 PolarHBondContact O-N 3.09Å; V85-Q89 PolarHBondContact O-N 2.95Å |
| 86 | T | 61.3 | Low | 61.7 | Low | 104 Ų | 104 | 94 Ų | 94 | 64% | 0.638 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -66.5 | -41.5 | 178.7 | 46.9 | 0 | 0 | 0 | 0 | 113 | G83 G84 L88 Q89 D90 | G83-T86 PolarHBondContact O-OG1 2.72Å; G84-T86 PolarHBondContact O-N 3.33Å; G84-T86 VanDerWaalsContact O-N 3.11Å; T86-L88 VanDerWaalsContact C-N 3.3Å; T86-L88 PolarHBondContact O-N 2.97Å; T86-Q89 WeakPolarHBondContact O-CB 3.33Å; T86-Q89 PolarHBondContact O-N 2.96Å; T86-D90 PolarHBondContact O-N 2.79Å; T86-D90 VanDerWaalsContact O-N 3.14Å |
| 87 | Q | 62.8 | Low | 61.6 | Low | 93 Ų | 93 | 98.8 Ų | 98.8 | 44% | 0.435 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -71.2 | -27.9 | 177.4 | -175.2 | 172.3 | 79.9 | 0 | 0 | 112.3 | G84 Q91 | G84-Q87 PolarHBondContact O-N 3.15Å; Q87-Q91 WeakPolarHBondContact O-CG 3.39Å; Q87-Q91 PolarHBondContact O-N 2.94Å; Q87-Q91 PolarHBondContact O-NE2 3.35Å |
| 88 | L | 65.7 | Low | 61.7 | Low | 56 Ų | 56 | 98.2 Ų | 98.2 | 29% | 0.293 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -71.8 | -40.1 | 170.4 | -77.8 | 174.3 | 0 | 0 | 0 | 111.5 | L80 P81 V85 T86 D90 Q91 I92 | L80-L88 HydrophobicContact CD2-CD1 3.53Å; P81-L88 HydrophobicContact CG-CD2 4.2Å; P81-L88 HydrophobicContact CG-CG 4.14Å; V85-L88 PolarHBondContact O-N 3.09Å; T86-L88 VanDerWaalsContact C-N 3.3Å; T86-L88 PolarHBondContact O-N 2.97Å; L88-D90 VanDerWaalsContact C-N 3.27Å; L88-D90 PolarHBondContact O-N 2.88Å; L88-Q91 PolarHBondContact O-N 3.48Å; L88-Q91 VanDerWaalsContact O-N 3.17Å; L88-I92 WeakPolarHBondContact O-CB 3.5Å; L88-I92 VanDerWaalsContact O-CG1 3.24Å; L88-I92 WeakPolarHBondContact O-CG1 3.35Å; L88-I92 PolarHBondContact O-N 3.39Å |
| 89 | Q | 65.7 | Low | 61.7 | Low | 110 Ų | 110 | 94.4 Ų | 94.4 | 51% | 0.514 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -58.8 | -39.7 | 176 | -166.6 | 67.7 | 58.1 | 0 | 0 | 111.8 | V85 T86 S93 | V85-Q89 PolarHBondContact O-N 2.95Å; T86-Q89 WeakPolarHBondContact O-CB 3.33Å; T86-Q89 PolarHBondContact O-N 2.96Å; Q89-S93 WeakPolarHBondContact O-CB 3.44Å; Q89-S93 PolarHBondContact O-N 3.2Å; Q89-S93 PolarHBondContact O-OG 3.08Å |
| 90 | D | 66.5 | Low | 61.7 | Low | 110 Ų | 110 | 97.1 Ų | 97.1 | 59% | 0.588 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67 | -40.9 | 176.2 | -70 | -23.1 | 0 | 0 | 0 | 112.1 | T86 L88 L94 | T86-D90 PolarHBondContact O-N 2.79Å; T86-D90 VanDerWaalsContact O-N 3.14Å; L88-D90 VanDerWaalsContact C-N 3.27Å; L88-D90 PolarHBondContact O-N 2.88Å; D90-L94 PolarHBondContact O-N 2.97Å |
| 91 | Q | 64.2 | Low | 61.7 | Low | 100 Ų | 100 | 99.2 Ų | 99.2 | 47% | 0.467 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -69 | -38.9 | 176 | -73.5 | 177.5 | 97.9 | 0 | 0 | 112.6 | Q87 L88 L94 L95 | Q87-Q91 WeakPolarHBondContact O-CG 3.39Å; Q87-Q91 PolarHBondContact O-N 2.94Å; Q87-Q91 PolarHBondContact O-NE2 3.35Å; L88-Q91 PolarHBondContact O-N 3.48Å; L88-Q91 VanDerWaalsContact O-N 3.17Å; Q91-L94 PolarHBondContact O-N 3.29Å; Q91-L95 WeakPolarHBondContact O-CG 3.42Å; Q91-L95 PolarHBondContact O-N 3.15Å |
| 92 | I | 68.4 | Low | 61.6 | Low | 87 Ų | 87 | 107.2 Ų | 107.2 | 45% | 0.446 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -67.5 | -40.5 | 176.5 | -69.4 | 165.3 | 0 | 0 | 0 | 110.1 | L88 L94 L95 V96 | L88-I92 WeakPolarHBondContact O-CB 3.5Å; L88-I92 VanDerWaalsContact O-CG1 3.24Å; L88-I92 WeakPolarHBondContact O-CG1 3.35Å; L88-I92 PolarHBondContact O-N 3.39Å; I92-L94 PolarHBondContact O-N 3.46Å; I92-L95 CarbonylContact O-C 3.39Å; I92-L95 WeakPolarHBondContact O-CA 3.49Å; I92-L95 PolarHBondContact O-N 3.03Å; I92-V96 PolarHBondContact O-N 3.32Å; I92-V96 VanDerWaalsContact O-N 3.1Å |
| 93 | S | 67.9 | Low | 61.3 | Low | 70 Ų | 70 | 105.7 Ų | 105.7 | 49% | 0.49 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -62.1 | -28.7 | 176.3 | -59.6 | 0 | 0 | 0 | 0 | 112.6 | Q89 | Q89-S93 WeakPolarHBondContact O-CB 3.44Å; Q89-S93 PolarHBondContact O-N 3.2Å; Q89-S93 PolarHBondContact O-OG 3.08Å |
| 94 | L | 63.7 | Low | 60.9 | Low | 143 Ų | 143 | 110.7 Ų | 110.7 | 75% | 0.749 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -76.4 | -21.4 | 172.5 | -75.9 | 166.3 | 0 | 0 | 0 | 113.7 | D90 Q91 I92 | D90-L94 PolarHBondContact O-N 2.97Å; Q91-L94 PolarHBondContact O-N 3.29Å; I92-L94 PolarHBondContact O-N 3.46Å |
| 95 | L | 63.6 | Low | 60.6 | Low | 135 Ų | 135 | 114 Ų | 114 | 71% | 0.707 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -92.9 | -10.4 | 179.1 | -69.7 | 164.4 | 0 | 0 | 0 | 113 | Q91 I92 L97 | Q91-L95 WeakPolarHBondContact O-CG 3.42Å; Q91-L95 PolarHBondContact O-N 3.15Å; I92-L95 CarbonylContact O-C 3.39Å; I92-L95 WeakPolarHBondContact O-CA 3.49Å; I92-L95 PolarHBondContact O-N 3.03Å; L95-L97 PolarHBondContact O-N 2.97Å |
| 96 | V | 65.9 | Low | 60.6 | Low | 100 Ų | 100 | 111.7 Ų | 111.7 | 61% | 0.606 | 60% | 0.601 | S | S | * | * | trans | -66.3 | 105.2 | 173.1 | 171.7 | 0 | 0 | 0 | 0 | 108.3 | I92 D98 | I92-V96 PolarHBondContact O-N 3.32Å; I92-V96 VanDerWaalsContact O-N 3.1Å; V96-D98 PolarHBondContact O-N 3.39Å; V96-D98 VanDerWaalsContact O-N 3.14Å | ||
| 97 | L | 52.2 | Low | 60.6 | Low | 145 Ų | 145 | 111 Ų | 111 | 76% | 0.759 | 59% | 0.594 | S | S | * | * | trans | -73.4 | 99.3 | 169.6 | -61.6 | 174.8 | 0 | 0 | 0 | 107.7 | L95 P99 | L95-L97 PolarHBondContact O-N 2.97Å; L97-P99 VanDerWaalsContact O-CD 3.31Å; L97-P99 WeakPolarHBondContact O-CD 3.16Å | ||
| 98 | D | 56.4 | Low | 60.7 | Low | 89 Ų | 89 | 112 Ų | 112 | 48% | 0.476 | 60% | 0.602 | S | S | . | * | trans | -71.7 | 113.1 | 172.5 | -161.5 | 7.6 | 0 | 0 | 0 | 108.5 | V96 D100 I101 | V96-D98 PolarHBondContact O-N 3.39Å; V96-D98 VanDerWaalsContact O-N 3.14Å; D98-D100 PolarHBondContact O-N 2.91Å; D98-D100 VanDerWaalsContact O-N 3.09Å; D98-I101 HydrophobicContact CB-CB 4.46Å; D98-I101 HydrophobicContact CB-CD1 3.7Å; D98-I101 HydrophobicContact CB-CG1 3.88Å; D98-I101 PolarHBondContact O-N 2.67Å; D98-I101 WeakPolarHBondContact OD2-CD1 3.36Å | ||
| 99 | P | 56.4 | Low | 60.8 | Low | 124 Ų | 124 | 114.5 Ų | 114.5 | 81% | 0.805 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -11 | -171.7 | 27.4 | -35.1 | 0 | 0 | 0 | 113.9 | L97 | L97-P99 VanDerWaalsContact O-CD 3.31Å; L97-P99 WeakPolarHBondContact O-CD 3.16Å |
| 100 | D | 55.8 | Low | 61 | Low | 152 Ų | 152 | 113.8 Ų | 113.8 | 81% | 0.813 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.6 | -3.6 | -180 | -93.9 | -24.3 | 0 | 0 | 0 | 114.2 | D98 | D98-D100 PolarHBondContact O-N 2.91Å; D98-D100 VanDerWaalsContact O-N 3.09Å |
| 101 | I | 57.4 | Low | 61 | Low | 101 Ų | 101 | 113.4 Ų | 113.4 | 52% | 0.518 | 62% | 0.616 | S | S | . | * | S | Bend | trans | -89 | 119.3 | 178.6 | -62.2 | 179.7 | 0 | 0 | 0 | 110 | D98 | D98-I101 HydrophobicContact CB-CB 4.46Å; D98-I101 HydrophobicContact CB-CD1 3.7Å; D98-I101 HydrophobicContact CB-CG1 3.88Å; D98-I101 PolarHBondContact O-N 2.67Å; D98-I101 WeakPolarHBondContact OD2-CD1 3.36Å |
| 102 | R | 55.1 | Low | 61.3 | Low | 213 Ų | 213 | 114 Ų | 114 | 80% | 0.804 | 63% | 0.626 | S | S | * | * | trans | -51.8 | 134.2 | -179.9 | -56.2 | 174 | 72.3 | -145.4 | -0.5 | 110.7 | D104 | R102-D104 PolarHBondContact O-N 3.33Š| ||
| 103 | P | 54.3 | Low | 61.7 | Low | 115 Ų | 115 | 119 Ų | 119 | 75% | 0.747 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | 37 | -162.8 | 35.3 | -40.2 | 0 | 0 | 0 | 114.8 | ||
| 104 | D | 53.4 | Low | 62 | Low | 135 Ų | 135 | 118.3 Ų | 118.3 | 72% | 0.722 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.1 | -10.8 | -164.5 | -154.2 | 21.8 | 0 | 0 | 0 | 115.6 | R102 | R102-D104 PolarHBondContact O-N 3.33Š|
| 105 | T | 55.4 | Low | 62.8 | Low | 103 Ų | 103 | 117.4 Ų | 117.4 | 63% | 0.632 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -133.8 | -42 | -177.6 | 57.1 | 0 | 0 | 0 | 0 | 115.5 | E109 | T105-E109 PolarHBondContact O-N 2.71Š|
| 106 | S | 60.4 | Low | 63.6 | Low | 60 Ų | 60 | 116.1 Ų | 116.1 | 42% | 0.42 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -72.2 | -41.5 | -173.3 | -50 | 0 | 0 | 0 | 0 | 112.2 | L108 E109 V110 | S106-L108 VanDerWaalsContact C-N 3.33Å; S106-L108 PolarHBondContact O-N 2.88Å; S106-E109 PolarHBondContact O-N 3.18Å; S106-V110 WeakPolarHBondContact O-CG2 3.42Å; S106-V110 PolarHBondContact O-N 2.9Å |
| 107 | D | 62.3 | Low | 64.3 | Low | 90 Ų | 90 | 115.9 Ų | 115.9 | 48% | 0.481 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -67.6 | -35.1 | -178.6 | -65.6 | -7 | 0 | 0 | 0 | 112 | V110 V111 | D107-V110 PolarHBondContact O-N 2.9Å; D107-V111 VanDerWaalsContact O-CG2 3.28Å; D107-V111 WeakPolarHBondContact O-CG2 3.44Å; D107-V111 PolarHBondContact O-N 3.1Å |
| 108 | L | 64.4 | Low | 65.6 | Low | 115 Ų | 115 | 113.7 Ų | 113.7 | 60% | 0.602 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -69 | -37.5 | 177.7 | -168.6 | 68.9 | 0 | 0 | 0 | 111.4 | S106 V111 V112 | S106-L108 VanDerWaalsContact C-N 3.33Å; S106-L108 PolarHBondContact O-N 2.88Å; L108-V111 PolarHBondContact O-N 2.83Å; L108-V112 HydrophobicContact CG-CG2 4.4Å; L108-V112 WeakPolarHBondContact O-CB 3.43Å; L108-V112 WeakPolarHBondContact O-CG2 3.44Å; L108-V112 PolarHBondContact O-N 3Å |
| 109 | E | 66.6 | Low | 66.7 | Low | 107 Ų | 107 | 115.3 Ų | 115.3 | 50% | 0.5 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -64.8 | -41.7 | 176.7 | -166.2 | -171.2 | 161 | 0 | 0 | 111.4 | T105 S106 V112 R113 | T105-E109 PolarHBondContact O-N 2.71Å; S106-E109 PolarHBondContact O-N 3.18Å; E109-V112 PolarHBondContact O-N 3.43Å; E109-R113 HydrophobicContact CG-CG 4.45Å; E109-R113 WeakPolarHBondContact O-CB 3.34Å; E109-R113 VanDerWaalsContact O-CG 3.3Å; E109-R113 WeakPolarHBondContact O-CG 3.46Å; E109-R113 PolarHBondContact O-N 3.4Å; E109-R113 IonicContact OE1-CZ 3.83Å; E109-R113 IonicContact OE1-NH1 2.83Å; E109-R113 PolarHBondContact OE1-NH1 2.96Å |
| 110 | V | 71.4 | Confident | 68 | Low | 95 Ų | 95 | 110.5 Ų | 110.5 | 58% | 0.576 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -62.7 | -43.5 | 176.4 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | S106 D107 R113 S114 | S106-V110 WeakPolarHBondContact O-CG2 3.42Å; S106-V110 PolarHBondContact O-N 2.9Å; D107-V110 PolarHBondContact O-N 2.9Å; V110-R113 PolarHBondContact O-N 3.26Å; V110-S114 PolarHBondContact O-N 2.73Å |
| 111 | V | 66.5 | Low | 69.1 | Low | 102 Ų | 102 | 112.5 Ų | 112.5 | 62% | 0.618 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -65.9 | -40.4 | 177.3 | 172.4 | 0 | 0 | 0 | 0 | 111.7 | D107 L108 S114 | D107-V111 VanDerWaalsContact O-CG2 3.28Å; D107-V111 WeakPolarHBondContact O-CG2 3.44Å; D107-V111 PolarHBondContact O-N 3.1Å; L108-V111 PolarHBondContact O-N 2.83Å; V111-S114 VanDerWaalsContact O-CB 3.25Å; V111-S114 WeakPolarHBondContact O-CB 3.39Å; V111-S114 PolarHBondContact O-N 2.97Å |
| 112 | V | 70.2 | Confident | 70.2 | Confident | 113 Ų | 113 | 115 Ų | 115 | 69% | 0.685 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -71.4 | -30.8 | -179.4 | 170.5 | 0 | 0 | 0 | 0 | 112.4 | L108 E109 | L108-V112 HydrophobicContact CG-CG2 4.4Å; L108-V112 WeakPolarHBondContact O-CB 3.43Å; L108-V112 WeakPolarHBondContact O-CG2 3.44Å; L108-V112 PolarHBondContact O-N 3Å; E109-V112 PolarHBondContact O-N 3.43Å |
| 113 | R | 75.6 | Confident | 71.1 | Confident | 193 Ų | 193 | 110.5 Ų | 110.5 | 73% | 0.728 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -88.6 | -5.5 | 176.8 | -62.2 | 177.8 | 89.4 | 169.6 | 1.9 | 113 | E109 V110 S115 | E109-R113 HydrophobicContact CG-CG 4.45Å; E109-R113 WeakPolarHBondContact O-CB 3.34Å; E109-R113 VanDerWaalsContact O-CG 3.3Å; E109-R113 WeakPolarHBondContact O-CG 3.46Å; E109-R113 PolarHBondContact O-N 3.4Å; E109-R113 IonicContact OE1-CZ 3.83Å; E109-R113 IonicContact OE1-NH1 2.83Å; E109-R113 PolarHBondContact OE1-NH1 2.96Å; V110-R113 PolarHBondContact O-N 3.26Å; R113-S115 PolarHBondContact O-N 3.32Å |
| 114 | S | 75 | Confident | 72.1 | Confident | 54 Ų | 54 | 108 Ų | 108 | 38% | 0.378 | 58% | 0.583 | S | S | . | * | trans | -63.7 | 130.4 | 176.4 | -175.1 | 0 | 0 | 0 | 0 | 111 | V110 V111 L116 | V110-S114 PolarHBondContact O-N 2.73Å; V111-S114 VanDerWaalsContact O-CB 3.25Å; V111-S114 WeakPolarHBondContact O-CB 3.39Å; V111-S114 PolarHBondContact O-N 2.97Å; S114-L116 PolarHBondContact O-N 3.43Å; S114-L116 WeakPolarHBondContact OG-CB 3.5Å; S114-L116 WeakPolarHBondContact OG-CG 3.46Å; S114-L116 PolarHBondContact OG-N 3.36Å | ||
| 115 | S | 81.4 | Confident | 73.2 | Confident | 124 Ų | 124 | 107.9 Ų | 107.9 | 87% | 0.867 | 59% | 0.589 | S | S | * | * | trans | -84.4 | 4.9 | 171.9 | 63.4 | 0 | 0 | 0 | 0 | 112.9 | R113 | R113-S115 PolarHBondContact O-N 3.32Š| ||
| 116 | L | 79.6 | Confident | 73.8 | Confident | 108 Ų | 108 | 106 Ų | 106 | 57% | 0.565 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -73.9 | 143.5 | -179.5 | -60.2 | 178.4 | 0 | 0 | 0 | 110.4 | S114 P118 | S114-L116 PolarHBondContact O-N 3.43Å; S114-L116 WeakPolarHBondContact OG-CB 3.5Å; S114-L116 WeakPolarHBondContact OG-CG 3.46Å; S114-L116 PolarHBondContact OG-N 3.36Å; L116-P118 WeakPolarHBondContact O-CD 3.47Å |
| 117 | N | 80.3 | Confident | 74 | Confident | 96 Ų | 96 | 110.5 Ų | 110.5 | 51% | 0.513 | 61% | 0.608 | S | S | . | * | trans | -74.9 | 112.1 | 176.2 | 176.5 | 10.9 | 0 | 0 | 0 | 109.6 | N119 A120 | N117-N119 PolarHBondContact O-N 3.38Å; N117-N119 WeakPolarHBondContact OD1-CB 3.42Å; N117-N119 PolarHBondContact OD1-N 3.19Å; N117-A120 WeakPolarHBondContact O-CB 3.4Å; N117-A120 PolarHBondContact O-N 3.24Å | ||
| 118 | P | 80.3 | Confident | 74.1 | Confident | 99 Ų | 99 | 115 Ų | 115 | 64% | 0.643 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.7 | -16.4 | -179 | 27.3 | -35.2 | 0 | 0 | 0 | 112.8 | L116 | L116-P118 WeakPolarHBondContact O-CD 3.47Š|
| 119 | N | 78.9 | Confident | 74 | Confident | 123 Ų | 123 | 117.5 Ų | 117.5 | 66% | 0.658 | 63% | 0.633 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | 12.6 | 177.3 | -55.3 | -65.3 | 0 | 0 | 0 | 113.3 | N117 | N117-N119 PolarHBondContact O-N 3.38Å; N117-N119 WeakPolarHBondContact OD1-CB 3.42Å; N117-N119 PolarHBondContact OD1-N 3.19Å |
| 120 | A | 83.9 | Confident | 73.6 | Confident | 23 Ų | 23 | 120.5 Ų | 120.5 | 19% | 0.19 | 65% | 0.646 | C | S | . | * | S | Bend | trans | -61.7 | 149.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | N117 E122 F123 T124 | N117-A120 WeakPolarHBondContact O-CB 3.4Å; N117-A120 PolarHBondContact O-N 3.24Å; A120-E122 HydrophobicContact CB-CG 3.88Å; A120-E122 PolarHBondContact O-N 3.19Å; A120-E122 VanDerWaalsContact O-N 3.1Å; A120-F123 HydrophobicContact CB-CD2 3.94Å; A120-F123 HydrophobicContact CB-CE2 4.38Å; A120-F123 PolarHBondContact O-N 3.12Å; A120-T124 PolarHBondContact O-N 2.6Å; A120-T124 VanDerWaalsContact O-N 3.15Å; A120-T124 PolarHBondContact O-OG1 3.41Å |
| 121 | K | 78.7 | Confident | 73 | Confident | 193 Ų | 193 | 123 Ų | 123 | 84% | 0.839 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -20.6 | -176 | -77.5 | -176.5 | 174.4 | -180 | 0 | 114 | T124 | K121-T124 WeakPolarHBondContact CA-OG1 3.45Å; K121-T124 VanDerWaalsContact O-O 3.11Å |
| 122 | E | 79.8 | Confident | 72.5 | Confident | 155 Ų | 155 | 129.3 Ų | 129.3 | 72% | 0.724 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.8 | -27.8 | 174.8 | 59.9 | -163 | -154.5 | 0 | 0 | 113.4 | A120 | A120-E122 HydrophobicContact CB-CG 3.88Å; A120-E122 PolarHBondContact O-N 3.19Å; A120-E122 VanDerWaalsContact O-N 3.1Å |
| 123 | F | 75.6 | Confident | 72.6 | Confident | 118 Ų | 118 | 130.1 Ų | 130.1 | 52% | 0.518 | 69% | 0.685 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.9 | -11.6 | 177.9 | -58.3 | -63.4 | 0 | 0 | 0 | 113.3 | A120 | A120-F123 HydrophobicContact CB-CD2 3.94Å; A120-F123 HydrophobicContact CB-CE2 4.38Å; A120-F123 PolarHBondContact O-N 3.12Å |
| 124 | T | 75.6 | Confident | 72.5 | Confident | 63 Ų | 63 | 126.8 Ų | 126.8 | 39% | 0.387 | 68% | 0.683 | S | S | . | * | S | Bend | trans | -94 | 117 | 172.1 | 50.6 | 0 | 0 | 0 | 0 | 108.9 | A120 K121 G126 | A120-T124 PolarHBondContact O-N 2.6Å; A120-T124 VanDerWaalsContact O-N 3.15Å; A120-T124 PolarHBondContact O-OG1 3.41Å; K121-T124 WeakPolarHBondContact CA-OG1 3.45Å; K121-T124 VanDerWaalsContact O-O 3.11Å; T124-G126 PolarHBondContact O-N 3.12Å |
| 125 | P | 76.1 | Confident | 72.3 | Confident | 131 Ų | 131 | 130.8 Ų | 130.8 | 85% | 0.851 | 70% | 0.7 | S | S | * | * | trans | -54.7 | 112.5 | -177.8 | -26.9 | 34.5 | 0 | 0 | 0 | 111.6 | ||||
| 126 | G | 66.7 | Low | 71.8 | Confident | 65 Ų | 65 | 131.2 Ų | 131.2 | 67% | 0.67 | 69% | 0.69 | S | S | * | * | trans | -78.3 | 126.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | T124 Q128 | T124-G126 PolarHBondContact O-N 3.12Å; G126-Q128 PolarHBondContact O-N 3.29Å | ||
| 127 | I | 65.9 | Low | 71.3 | Confident | 153 Ų | 153 | 132.7 Ų | 132.7 | 79% | 0.785 | 70% | 0.698 | S | S | * | * | trans | -79.2 | 87.6 | 172.1 | -45.8 | 152.5 | 0 | 0 | 0 | 107.3 | K129 | I127-K129 HydrophobicContact CG2-CG 4.3Å; I127-K129 PolarHBondContact O-N 3.19Å | ||
| 128 | Q | 63.1 | Low | 70.7 | Confident | 184 Ų | 184 | 135.1 Ų | 135.1 | 86% | 0.86 | 71% | 0.71 | S | S | * | * | trans | -71.5 | 99.4 | 171.8 | -69.8 | -175.2 | 13.6 | 0 | 0 | 108.8 | G126 H130 | G126-Q128 PolarHBondContact O-N 3.29Å; Q128-H130 PolarHBondContact O-N 2.82Å | ||
| 129 | K | 63.3 | Low | 70 | Confident | 169 Ų | 169 | 137.7 Ų | 137.7 | 74% | 0.735 | 72% | 0.715 | S | S | * | * | trans | -77.9 | 101.6 | 169.3 | -65.6 | -173 | -178.6 | -177.9 | 0 | 108.1 | I127 N131 | I127-K129 HydrophobicContact CG2-CG 4.3Å; I127-K129 PolarHBondContact O-N 3.19Å; K129-N131 PolarHBondContact O-N 3.3Å | ||
| 130 | H | 57.8 | Low | 69.4 | Low | 169 Ų | 169 | 138.8 Ų | 138.8 | 78% | 0.782 | 72% | 0.72 | S | S | * | * | trans | -72.6 | 106.3 | 167.8 | -142.5 | -88.2 | 0 | 0 | 0 | 107.4 | Q128 L132 | Q128-H130 PolarHBondContact O-N 2.82Å; H130-L132 PolarHBondContact O-N 3.46Å | ||
| 131 | N | 59.1 | Low | 68.2 | Low | 149 Ų | 149 | 148.5 Ų | 148.5 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | trans | -78.8 | 117 | 170.9 | -72.5 | -39 | 0 | 0 | 0 | 107.6 | K129 | K129-N131 PolarHBondContact O-N 3.3Š| ||
| 132 | L | 56.3 | Low | 67.2 | Low | 233 Ų | 233 | 144.5 Ų | 144.5 | 100% | 1.22 | 76% | 0.757 | S | S | * | * | trans | -83.5 | 0 | 167.3 | -79.3 | 157.4 | 0 | 0 | 0 | 110.1 | H130 | H130-L132 PolarHBondContact O-N 3.46Š|
Retrieved 132 of 132 residues in 27.5 ms
(Link to these results)