| 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 | S | 53 | Low | 63.3 | Low | 166 Ų | 166 | 146.4 Ų | 146.4 | 100% | 1.161 | 79% | 0.786 | S | S | * | * | 0 | 119.3 | 0 | -60.2 | 0 | 0 | 0 | 0 | 109.3 | |||||
| 2 | F | 54.6 | Low | 62.9 | Low | 214 Ų | 214 | 144.7 Ų | 144.7 | 94% | 0.939 | 78% | 0.776 | S | S | * | * | trans | -80.7 | 126.8 | 178 | -72 | -92.5 | 0 | 0 | 0 | 108.9 | S4 | F2-S4 PolarHBondContact O-N 3.14Å; F2-S4 VanDerWaalsContact O-N 3.14Å | ||
| 3 | Y | 68.6 | Low | 62 | Low | 237 Ų | 237 | 144.2 Ų | 144.2 | 93% | 0.929 | 76% | 0.763 | S | S | * | * | trans | -67.7 | 106.6 | 171.5 | -82.8 | -94.2 | 0 | 0 | 0 | 108.5 | F5 | Y3-F5 PolarHBondContact O-N 3.39Š| ||
| 4 | S | 67 | Low | 61.8 | Low | 103 Ų | 103 | 143.4 Ų | 143.4 | 72% | 0.72 | 77% | 0.766 | S | S | * | * | trans | -77.2 | 112 | 170.8 | 55.6 | 0 | 0 | 0 | 0 | 108.8 | F2 V6 | F2-S4 PolarHBondContact O-N 3.14Å; F2-S4 VanDerWaalsContact O-N 3.14Å; S4-V6 PolarHBondContact O-N 3.28Å | ||
| 5 | F | 69.1 | Low | 61.2 | Low | 195 Ų | 195 | 141.3 Ų | 141.3 | 86% | 0.855 | 76% | 0.761 | S | S | * | * | trans | -72.4 | 110 | 169.7 | -161.6 | -95.8 | 0 | 0 | 0 | 107.8 | Y3 P7 | Y3-F5 PolarHBondContact O-N 3.39Å; F5-P7 VanDerWaalsContact O-CD 3.25Å; F5-P7 WeakPolarHBondContact O-CD 3.25Å | ||
| 6 | V | 72.3 | Confident | 60.4 | Low | 113 Ų | 113 | 139.5 Ų | 139.5 | 69% | 0.685 | 75% | 0.751 | S | S | * | * | trans | -87.6 | 108.1 | 172.5 | -179.5 | 0 | 0 | 0 | 0 | 106.6 | S4 V8 | S4-V6 PolarHBondContact O-N 3.28Å; V6-V8 PolarHBondContact O-N 3.2Å | ||
| 7 | P | 61.9 | Low | 60.1 | Low | 104 Ų | 104 | 142.5 Ų | 142.5 | 68% | 0.675 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 117.8 | 174.7 | 26.9 | -31.3 | 0 | 0 | 0 | 108.6 | F5 A9 | F5-P7 VanDerWaalsContact O-CD 3.25Å; F5-P7 WeakPolarHBondContact O-CD 3.25Å; P7-A9 PolarHBondContact O-N 3.46Å |
| 8 | V | 64.9 | Low | 59.4 | Low | 102 Ų | 102 | 143.3 Ų | 143.3 | 62% | 0.618 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 122.5 | 167.7 | 179.3 | 0 | 0 | 0 | 0 | 106.4 | V6 | V6-V8 PolarHBondContact O-N 3.2Š|
| 9 | A | 63.6 | Low | 58.9 | Low | 59 Ų | 59 | 141.6 Ų | 141.6 | 49% | 0.488 | 75% | 0.751 | S | S | . | * | P | Polyproline II helix | trans | -66.3 | 136.5 | -179.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | P7 E11 D12 | P7-A9 PolarHBondContact O-N 3.46Å; A9-E11 PolarHBondContact O-N 3.24Å; A9-D12 PolarHBondContact O-N 3.33Å |
| 10 | D | 60.5 | Low | 58.7 | Low | 137 Ų | 137 | 139.4 Ų | 139.4 | 73% | 0.733 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -61.4 | -7.6 | 179.5 | -67.8 | -43.3 | 0 | 0 | 0 | 113.6 | D12 F13 | D10-D12 PolarHBondContact O-N 3.45Å; D10-F13 PolarHBondContact O-N 3.38Å |
| 11 | E | 60.3 | Low | 58.1 | Low | 180 Ų | 180 | 137.6 Ų | 137.6 | 84% | 0.841 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -67.8 | -19.1 | 176.2 | -61.8 | -96.8 | 156.3 | 0 | 0 | 113.1 | A9 F13 | A9-E11 PolarHBondContact O-N 3.24Å; E11-F13 VanDerWaalsContact C-N 3.28Å; E11-F13 PolarHBondContact O-N 2.94Å |
| 12 | D | 58.4 | Low | 58 | Low | 126 Ų | 126 | 136 Ų | 136 | 67% | 0.674 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -79.6 | -9.6 | 179.2 | -75.4 | -21.8 | 0 | 0 | 0 | 113.4 | A9 D10 V14 | A9-D12 PolarHBondContact O-N 3.33Å; D10-D12 PolarHBondContact O-N 3.45Å; D12-V14 PolarHBondContact O-N 3.43Å |
| 13 | F | 51.8 | Low | 58 | Low | 138 Ų | 138 | 129.1 Ų | 129.1 | 61% | 0.605 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -84 | 107.9 | 172.1 | -64.5 | -80.2 | 0 | 0 | 0 | 108.6 | D10 E11 V15 | D10-F13 PolarHBondContact O-N 3.38Å; E11-F13 VanDerWaalsContact C-N 3.28Å; E11-F13 PolarHBondContact O-N 2.94Å; F13-V15 HydrophobicContact CB-CG2 3.96Å; F13-V15 PolarHBondContact O-N 2.71Å |
| 14 | V | 58.5 | Low | 57.2 | Low | 133 Ų | 133 | 126 Ų | 126 | 81% | 0.806 | 71% | 0.705 | S | S | * | * | trans | -63.4 | 80.6 | 160.7 | -177.3 | 0 | 0 | 0 | 0 | 107.7 | D12 | D12-V14 PolarHBondContact O-N 3.43Š| ||
| 15 | V | 54.1 | Low | 56.7 | Low | 113 Ų | 113 | 127.1 Ų | 127.1 | 69% | 0.685 | 70% | 0.702 | S | S | * | * | trans | -73.3 | 142.6 | 166.1 | -174.9 | 0 | 0 | 0 | 0 | 106.4 | F13 | F13-V15 HydrophobicContact CB-CG2 3.96Å; F13-V15 PolarHBondContact O-N 2.71Å | ||
| 16 | D | 47.1 | Very low | 56.1 | Low | 112 Ų | 112 | 122.7 Ų | 122.7 | 60% | 0.599 | 69% | 0.687 | S | S | * | * | trans | 78.8 | 59.7 | 179.9 | -68.8 | 1.8 | 0 | 0 | 0 | 117 | K18 | D16-K18 HydrophobicContact CB-CG 4.22Å; D16-K18 PolarHBondContact O-N 3.03Å; D16-K18 VanDerWaalsContact OD2-CE 3.32Å; D16-K18 WeakPolarHBondContact OD2-CE 3.32Å | ||
| 17 | K | 55.1 | Low | 55.5 | Low | 191 Ų | 191 | 126.4 Ų | 126.4 | 83% | 0.83 | 69% | 0.694 | S | S | * | * | trans | -72.4 | 80.3 | 133.8 | -73 | -160.6 | -179.7 | -174.1 | 0 | 108 | C19 | K17-C19 PolarHBondContact O-N 3.44Š| ||
| 18 | K | 47.8 | Very low | 55.3 | Low | 156 Ų | 156 | 128.3 Ų | 128.3 | 68% | 0.678 | 70% | 0.699 | S | S | * | * | trans | -55.3 | 114 | 162.2 | -72.7 | -178.6 | -178.4 | 177.9 | 0 | 106.5 | D16 S20 | D16-K18 HydrophobicContact CB-CG 4.22Å; D16-K18 PolarHBondContact O-N 3.03Å; D16-K18 VanDerWaalsContact OD2-CE 3.32Å; D16-K18 WeakPolarHBondContact OD2-CE 3.32Å; K18-S20 PolarHBondContact O-N 3.04Å; K18-S20 PolarHBondContact O-OG 2.78Å | ||
| 19 | C | 50.7 | Low | 55.2 | Low | 112 Ų | 112 | 128 Ų | 128 | 76% | 0.757 | 70% | 0.697 | S | S | * | * | trans | -70.5 | 57.8 | 169.7 | -65.2 | 0 | 0 | 0 | 0 | 109.4 | K17 S21 | K17-C19 PolarHBondContact O-N 3.44Å; C19-S21 PolarHBondContact O-N 3.38Å | ||
| 20 | S | 54.1 | Low | 54.7 | Low | 97 Ų | 97 | 135 Ų | 135 | 68% | 0.678 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | 115.2 | 167.9 | 45.2 | 0 | 0 | 0 | 0 | 107.1 | K18 | K18-S20 PolarHBondContact O-N 3.04Å; K18-S20 PolarHBondContact O-OG 2.78Å |
| 21 | S | 47.1 | Very low | 54.4 | Low | 101 Ų | 101 | 131 Ų | 131 | 71% | 0.706 | 69% | 0.694 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 87.3 | 44.7 | 175.6 | 97.1 | 0 | 0 | 0 | 0 | 118.1 | C19 A23 | C19-S21 PolarHBondContact O-N 3.38Å; S21-A23 PolarHBondContact O-N 2.82Å |
| 22 | I | 50.9 | Low | 54.3 | Low | 133 Ų | 133 | 129.8 Ų | 129.8 | 68% | 0.682 | 70% | 0.699 | S | S | * | * | trans | -72.2 | 87.8 | 135.6 | -60 | 173.6 | 0 | 0 | 0 | 103.6 | D24 | I22-D24 PolarHBondContact O-N 2.94Š| ||
| 23 | A | 53.6 | Low | 54.3 | Low | 70 Ų | 70 | 128 Ų | 128 | 58% | 0.579 | 69% | 0.689 | S | S | * | * | trans | -46.2 | 143.9 | 167.4 | 0 | 0 | 0 | 0 | 0 | 107.4 | S21 I25 | S21-A23 PolarHBondContact O-N 2.82Å; A23-I25 WeakPolarHBondContact O-CG1 3.29Å; A23-I25 PolarHBondContact O-N 2.87Å | ||
| 24 | D | 51.4 | Low | 54.9 | Low | 171 Ų | 171 | 127.9 Ų | 127.9 | 91% | 0.914 | 69% | 0.694 | S | S | * | * | trans | -56.7 | 81.8 | 176.8 | -68.1 | -55.8 | 0 | 0 | 0 | 109.7 | I22 D26 | I22-D24 PolarHBondContact O-N 2.94Å; D24-D26 PolarHBondContact O-N 3Å; D24-D26 VanDerWaalsContact O-N 3.15Å | ||
| 25 | I | 57.3 | Low | 54.9 | Low | 126 Ų | 126 | 127.2 Ų | 127.2 | 65% | 0.646 | 68% | 0.682 | S | S | * | * | trans | -70.4 | 113.2 | 172.3 | -66.6 | 167.4 | 0 | 0 | 0 | 103.6 | A23 K27 | A23-I25 WeakPolarHBondContact O-CG1 3.29Å; A23-I25 PolarHBondContact O-N 2.87Å; I25-K27 PolarHBondContact O-N 3.3Å | ||
| 26 | D | 57.2 | Low | 55.3 | Low | 102 Ų | 102 | 125.6 Ų | 125.6 | 55% | 0.545 | 67% | 0.672 | S | S | . | * | trans | -39.7 | 111 | 173.7 | -171.4 | 1 | 0 | 0 | 0 | 109.8 | D24 D28 V29 | D24-D26 PolarHBondContact O-N 3Å; D24-D26 VanDerWaalsContact O-N 3.15Å; D26-D28 PolarHBondContact O-N 3.49Å; D26-V29 HydrophobicContact CB-CG2 4.21Å; D26-V29 PolarHBondContact O-N 3.02Å | ||
| 27 | K | 58.6 | Low | 55.9 | Low | 191 Ų | 191 | 126.6 Ų | 126.6 | 83% | 0.83 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.8 | -7.9 | -169.8 | -64.8 | -155.8 | 178.5 | -169.5 | 0 | 112.9 | I25 | I25-K27 PolarHBondContact O-N 3.3Š|
| 28 | D | 58.4 | Low | 56.3 | Low | 145 Ų | 145 | 124.6 Ų | 124.6 | 78% | 0.775 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | -7.7 | -179.6 | -65 | -20.6 | 0 | 0 | 0 | 112.8 | D26 Y30 | D26-D28 PolarHBondContact O-N 3.49Å; D28-Y30 VanDerWaalsContact C-N 3.33Å; D28-Y30 PolarHBondContact O-N 3.02Å |
| 29 | V | 61.9 | Low | 57 | Low | 96 Ų | 96 | 120.8 Ų | 120.8 | 58% | 0.582 | 65% | 0.65 | S | S | * | * | trans | -84.7 | 80 | 170.4 | -171.4 | 0 | 0 | 0 | 0 | 108.8 | D26 P31 | D26-V29 HydrophobicContact CB-CG2 4.21Å; D26-V29 PolarHBondContact O-N 3.02Å; V29-P31 VanDerWaalsContact O-CD 3.28Å; V29-P31 WeakPolarHBondContact O-CD 3.4Å | ||
| 30 | Y | 53.8 | Low | 57.6 | Low | 204 Ų | 204 | 118 Ų | 118 | 80% | 0.8 | 64% | 0.635 | S | S | * | * | trans | -59 | 117.1 | 161.1 | -103.9 | -94.5 | 0 | 0 | 0 | 107.4 | D28 T32 | D28-Y30 VanDerWaalsContact C-N 3.33Å; D28-Y30 PolarHBondContact O-N 3.02Å; Y30-T32 PolarHBondContact O-N 3.26Å | ||
| 31 | P | 53.8 | Low | 58 | Low | 55 Ų | 55 | 116 Ų | 116 | 36% | 0.357 | 63% | 0.625 | S | S | . | * | trans | -65.4 | 109.6 | 175.2 | 9.9 | -2.2 | 0 | 0 | 0 | 106.6 | V29 D33 F37 | V29-P31 VanDerWaalsContact O-CD 3.28Å; V29-P31 WeakPolarHBondContact O-CD 3.4Å; P31-D33 PolarHBondContact O-N 2.83Å; P31-D33 VanDerWaalsContact O-N 3.07Å; P31-F37 HydrophobicContact CB-CD2 4.19Å; P31-F37 HydrophobicContact CG-CD2 3.4Å; P31-F37 VanDerWaalsContact CG-CD2 3.4Å; P31-F37 HydrophobicContact CG-CE2 3.82Å | ||
| 32 | T | 59.1 | Low | 58.6 | Low | 153 Ų | 153 | 115.1 Ų | 115.1 | 94% | 0.939 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -59.7 | -15.7 | 179.3 | 17 | 0 | 0 | 0 | 0 | 112.6 | Y30 | Y30-T32 PolarHBondContact O-N 3.26Š|
| 33 | D | 59.2 | Low | 59.2 | Low | 90 Ų | 90 | 117.2 Ų | 117.2 | 48% | 0.481 | 61% | 0.613 | S | S | . | * | trans | -137.5 | 128.8 | -179.8 | -162.8 | -13.7 | 0 | 0 | 0 | 110.6 | P31 H35 T36 | P31-D33 PolarHBondContact O-N 2.83Å; P31-D33 VanDerWaalsContact O-N 3.07Å; D33-H35 PolarHBondContact O-N 3.38Å; D33-H35 PolarHBondContact OD1-N 3.49Å; D33-T36 PolarHBondContact O-N 3.03Å; D33-T36 PolarHBondContact O-OG1 3.3Å; D33-T36 VanDerWaalsContact O-OG1 3.14Å | ||
| 34 | L | 62.9 | Low | 59.7 | Low | 135 Ų | 135 | 119.5 Ų | 119.5 | 71% | 0.707 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -59.2 | -29 | 176 | -72.6 | 170.8 | 0 | 0 | 0 | 111 | T36 F37 F38 | L34-T36 VanDerWaalsContact C-N 3.31Å; L34-T36 PolarHBondContact O-N 2.84Å; L34-F37 WeakPolarHBondContact O-CB 3.37Å; L34-F37 PolarHBondContact O-N 2.94Å; L34-F37 VanDerWaalsContact O-N 3.16Å; L34-F38 VanDerWaalsContact O-CD2 3.24Å; L34-F38 WeakPolarHBondContact O-CD2 3.47Å; L34-F38 PolarHBondContact O-N 2.61Å |
| 35 | H | 58.8 | Low | 60.1 | Low | 119 Ų | 119 | 115 Ų | 115 | 55% | 0.551 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -60 | -39.8 | -179.5 | -170.2 | 32.4 | 0 | 0 | 0 | 112.6 | D33 F37 F38 L39 | D33-H35 PolarHBondContact O-N 3.38Å; D33-H35 PolarHBondContact OD1-N 3.49Å; H35-F37 VanDerWaalsContact C-N 3.3Å; H35-F37 PolarHBondContact O-N 3.14Å; H35-F38 PolarHBondContact O-N 3.15Å; H35-L39 PolarHBondContact O-N 3.02Å |
| 36 | T | 62.2 | Low | 59.7 | Low | 78 Ų | 78 | 112.1 Ų | 112.1 | 48% | 0.479 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -67.2 | -31.3 | 178.7 | -14.3 | 0 | 0 | 0 | 0 | 112.1 | D33 L34 L39 A40 | D33-T36 PolarHBondContact O-N 3.03Å; D33-T36 PolarHBondContact O-OG1 3.3Å; D33-T36 VanDerWaalsContact O-OG1 3.14Å; L34-T36 VanDerWaalsContact C-N 3.31Å; L34-T36 PolarHBondContact O-N 2.84Å; T36-L39 PolarHBondContact O-N 3.49Å; T36-A40 WeakPolarHBondContact O-CB 3.38Å; T36-A40 PolarHBondContact O-N 3.38Å |
| 37 | F | 60.3 | Low | 59.5 | Low | 134 Ų | 134 | 112.6 Ų | 112.6 | 59% | 0.588 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -66.3 | -41.7 | 177.5 | -145.7 | -93.5 | 0 | 0 | 0 | 111.7 | P31 L34 H35 A40 A41 | P31-F37 HydrophobicContact CB-CD2 4.19Å; P31-F37 HydrophobicContact CG-CD2 3.4Å; P31-F37 VanDerWaalsContact CG-CD2 3.4Å; P31-F37 HydrophobicContact CG-CE2 3.82Å; L34-F37 WeakPolarHBondContact O-CB 3.37Å; L34-F37 PolarHBondContact O-N 2.94Å; L34-F37 VanDerWaalsContact O-N 3.16Å; H35-F37 VanDerWaalsContact C-N 3.3Å; H35-F37 PolarHBondContact O-N 3.14Å; F37-A40 PolarHBondContact O-N 3.46Å; F37-A41 WeakPolarHBondContact O-CB 3.36Å; F37-A41 PolarHBondContact O-N 2.94Å |
| 38 | F | 62.5 | Low | 59.1 | Low | 149 Ų | 149 | 112 Ų | 112 | 65% | 0.654 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -65.7 | -42.9 | 176.4 | -73.6 | -70.6 | 0 | 0 | 0 | 111.9 | L34 H35 A40 A41 E42 | L34-F38 VanDerWaalsContact O-CD2 3.24Å; L34-F38 WeakPolarHBondContact O-CD2 3.47Å; L34-F38 PolarHBondContact O-N 2.61Å; H35-F38 PolarHBondContact O-N 3.15Å; F38-A40 PolarHBondContact O-N 3.34Å; F38-A41 PolarHBondContact O-N 2.95Å; F38-E42 WeakPolarHBondContact O-CB 3.24Å; F38-E42 PolarHBondContact O-N 3.38Å |
| 39 | L | 64 | Low | 58.8 | Low | 75 Ų | 75 | 114.6 Ų | 114.6 | 39% | 0.393 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64.9 | -37.8 | 176.7 | -71 | 171 | 0 | 0 | 0 | 112.5 | H35 T36 K43 | H35-L39 PolarHBondContact O-N 3.02Å; T36-L39 PolarHBondContact O-N 3.49Å; L39-K43 WeakPolarHBondContact O-CG 3.42Å; L39-K43 PolarHBondContact O-N 3.46Å; L39-K43 VanDerWaalsContact O-N 3.14Å |
| 40 | A | 63 | Low | 58.1 | Low | 55 Ų | 55 | 115.3 Ų | 115.3 | 46% | 0.455 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -68.2 | -43.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | T36 F37 F38 E42 K43 V44 | T36-A40 WeakPolarHBondContact O-CB 3.38Å; T36-A40 PolarHBondContact O-N 3.38Å; F37-A40 PolarHBondContact O-N 3.46Å; F38-A40 PolarHBondContact O-N 3.34Å; A40-E42 VanDerWaalsContact C-N 3.33Å; A40-E42 PolarHBondContact O-N 3.48Å; A40-K43 PolarHBondContact O-N 3.22Å; A40-V44 WeakPolarHBondContact O-CG2 3.36Å; A40-V44 PolarHBondContact O-N 2.9Å |
| 41 | A | 62.5 | Low | 58 | Low | 55 Ų | 55 | 110.5 Ų | 110.5 | 46% | 0.455 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -63.1 | -38.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | F37 F38 V44 S45 | F37-A41 WeakPolarHBondContact O-CB 3.36Å; F37-A41 PolarHBondContact O-N 2.94Å; F38-A41 PolarHBondContact O-N 2.95Å; A41-V44 PolarHBondContact O-N 3.43Å; A41-S45 VanDerWaalsContact O-CB 3.29Å; A41-S45 WeakPolarHBondContact O-CB 3.44Å; A41-S45 PolarHBondContact O-N 3.16Å |
| 42 | E | 59.5 | Low | 57.8 | Low | 81 Ų | 81 | 115.5 Ų | 115.5 | 38% | 0.379 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -63.2 | -44 | 175.4 | -172.7 | 171.4 | -157.5 | 0 | 0 | 111.7 | F38 A40 S45 R49 | F38-E42 WeakPolarHBondContact O-CB 3.24Å; F38-E42 PolarHBondContact O-N 3.38Å; A40-E42 VanDerWaalsContact C-N 3.33Å; A40-E42 PolarHBondContact O-N 3.48Å; E42-S45 PolarHBondContact O-N 2.94Å; E42-R49 IonicContact OE1-NE 3.76Å |
| 43 | K | 62.7 | Low | 57.5 | Low | 177 Ų | 177 | 111.7 Ų | 111.7 | 77% | 0.77 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -65.1 | -39.7 | 177.7 | -74.5 | -178.9 | -178.7 | -176.4 | 0 | 113.3 | L39 A40 | L39-K43 WeakPolarHBondContact O-CG 3.42Å; L39-K43 PolarHBondContact O-N 3.46Å; L39-K43 VanDerWaalsContact O-N 3.14Å; A40-K43 PolarHBondContact O-N 3.22Å |
| 44 | V | 64.3 | Low | 57.2 | Low | 118 Ų | 118 | 113.1 Ų | 113.1 | 72% | 0.715 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -73.7 | -30.8 | 178.9 | 177.5 | 0 | 0 | 0 | 0 | 111.4 | A40 A41 G46 | A40-V44 WeakPolarHBondContact O-CG2 3.36Å; A40-V44 PolarHBondContact O-N 2.9Å; A41-V44 PolarHBondContact O-N 3.43Å; V44-G46 PolarHBondContact O-N 3.06Å |
| 45 | S | 59.4 | Low | 56.7 | Low | 77 Ų | 77 | 114.1 Ų | 114.1 | 54% | 0.538 | 63% | 0.633 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.8 | -9.3 | -178.5 | -170.6 | 0 | 0 | 0 | 0 | 114 | A41 E42 L47 | A41-S45 VanDerWaalsContact O-CB 3.29Å; A41-S45 WeakPolarHBondContact O-CB 3.44Å; A41-S45 PolarHBondContact O-N 3.16Å; E42-S45 PolarHBondContact O-N 2.94Å; S45-L47 PolarHBondContact O-N 3.31Å |
| 46 | G | 50.2 | Low | 56.2 | Low | 66 Ų | 66 | 114.4 Ų | 114.4 | 68% | 0.68 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 54.9 | 14.7 | -174.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | V44 Q48 | V44-G46 PolarHBondContact O-N 3.06Å; G46-Q48 VanDerWaalsContact C-N 3.26Å; G46-Q48 PolarHBondContact O-N 3.18Å |
| 47 | L | 53.6 | Low | 55.4 | Low | 112 Ų | 112 | 119 Ų | 119 | 59% | 0.586 | 66% | 0.659 | S | S | * | * | trans | -84.7 | 78.3 | -171.6 | -163.5 | 75.3 | 0 | 0 | 0 | 106.5 | S45 R49 | S45-L47 PolarHBondContact O-N 3.31Å; L47-R49 PolarHBondContact O-N 2.95Å | ||
| 48 | Q | 49.6 | Very low | 55 | Low | 179 Ų | 179 | 121.8 Ų | 121.8 | 84% | 0.836 | 67% | 0.674 | S | S | * | * | trans | -54.4 | 111.3 | 159 | -71.6 | -151.2 | -4.7 | 0 | 0 | 106.1 | G46 S50 | G46-Q48 VanDerWaalsContact C-N 3.26Å; G46-Q48 PolarHBondContact O-N 3.18Å; Q48-S50 VanDerWaalsContact C-N 3.28Å; Q48-S50 PolarHBondContact O-N 3.13Å | ||
| 49 | R | 51.4 | Low | 54.5 | Low | 199 Ų | 199 | 123.9 Ų | 123.9 | 75% | 0.751 | 68% | 0.677 | S | S | * | * | trans | -59.3 | 99.7 | 170.6 | -73.3 | 179.2 | 163.1 | -177 | -3 | 106 | E42 L47 S51 | E42-R49 IonicContact OE1-NE 3.76Å; L47-R49 PolarHBondContact O-N 2.95Å; R49-S51 PolarHBondContact O-N 3.16Å | ||
| 50 | S | 47.2 | Very low | 54.1 | Low | 110 Ų | 110 | 127.5 Ų | 127.5 | 77% | 0.769 | 70% | 0.696 | S | S | * | * | trans | -62.6 | 93.4 | 160.5 | 42.3 | 0 | 0 | 0 | 0 | 105.6 | Q48 D52 | Q48-S50 VanDerWaalsContact C-N 3.28Å; Q48-S50 PolarHBondContact O-N 3.13Å; S50-D52 PolarHBondContact O-N 3.37Å | ||
| 51 | S | 51.1 | Low | 53.4 | Low | 103 Ų | 103 | 130.3 Ų | 130.3 | 72% | 0.72 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -70.4 | 73.7 | 176 | 56.3 | 0 | 0 | 0 | 0 | 108.4 | R49 | R49-S51 PolarHBondContact O-N 3.16Š|
| 52 | D | 51.3 | Low | 53.2 | Low | 160 Ų | 160 | 135.2 Ų | 135.2 | 86% | 0.856 | 72% | 0.723 | S | S | * | * | trans | -158.4 | 32 | 170.9 | -84.7 | -33.7 | 0 | 0 | 0 | 111.8 | S50 | S50-D52 PolarHBondContact O-N 3.37Š| ||
| 53 | S | 51.8 | Low | 52.8 | Low | 73 Ų | 73 | 135.8 Ų | 135.8 | 51% | 0.51 | 74% | 0.736 | S | S | . | * | trans | -104.4 | 113.5 | 168.2 | -174.6 | 0 | 0 | 0 | 0 | 110.1 | L55 T56 | S53-L55 PolarHBondContact O-N 3.17Å; S53-T56 PolarHBondContact O-OG1 3.4Å | ||
| 54 | P | 52.5 | Low | 52.1 | Low | 121 Ų | 121 | 135.1 Ų | 135.1 | 79% | 0.786 | 74% | 0.74 | S | S | * | * | G | 310 helix | trans | -71.9 | 5.9 | -178.6 | 30.1 | -34.7 | 0 | 0 | 0 | 113.7 | T56 | P54-T56 VanDerWaalsContact C-N 3.32Å; P54-T56 PolarHBondContact O-N 3.28Å |
| 55 | L | 52.1 | Low | 51.7 | Low | 156 Ų | 156 | 138 Ų | 138 | 82% | 0.817 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -84.1 | 1.1 | -180 | -120.8 | 82.4 | 0 | 0 | 0 | 114.3 | S53 | S53-L55 PolarHBondContact O-N 3.17Š|
| 56 | T | 48.5 | Very low | 51.3 | Low | 125 Ų | 125 | 143.1 Ų | 143.1 | 77% | 0.767 | 76% | 0.759 | S | S | * | * | G | 310 helix | trans | -89.7 | 6.2 | -177 | 38.5 | 0 | 0 | 0 | 0 | 116.2 | S53 P54 | S53-T56 PolarHBondContact O-OG1 3.4Å; P54-T56 VanDerWaalsContact C-N 3.32Å; P54-T56 PolarHBondContact O-N 3.28Å |
| 57 | E | 46 | Very low | 51.5 | Low | 175 Ų | 175 | 147 Ų | 147 | 82% | 0.818 | 76% | 0.759 | S | S | * | * | trans | -105.4 | 26 | -176.1 | -63.8 | -162.7 | 178.4 | 0 | 0 | 116 | R59 | E57-R59 PolarHBondContact O-N 3.22Š| ||
| 58 | Q | 50.9 | Low | 51.4 | Low | 191 Ų | 191 | 146 Ų | 146 | 89% | 0.893 | 76% | 0.762 | S | S | * | * | trans | -79.3 | 69.6 | 155.8 | -72.1 | -165.4 | -12 | 0 | 0 | 109.5 | L60 | Q58-L60 PolarHBondContact O-N 3.33Å; Q58-L60 VanDerWaalsContact O-N 3.13Å | ||
| 59 | R | 52 | Low | 51.1 | Low | 194 Ų | 194 | 144.7 Ų | 144.7 | 73% | 0.732 | 76% | 0.755 | S | S | * | * | trans | -65.5 | 108.2 | 169.9 | -161.5 | 176 | -172.9 | 160.1 | -0.5 | 106.9 | E57 E62 | E57-R59 PolarHBondContact O-N 3.22Å; R59-E62 IonicContact NH2-OE2 3.92Å | ||
| 60 | L | 55.8 | Low | 50.7 | Low | 150 Ų | 150 | 143.2 Ų | 143.2 | 79% | 0.785 | 76% | 0.757 | S | S | * | * | trans | -55 | 130.9 | 169 | -74.8 | 165.7 | 0 | 0 | 0 | 107.4 | Q58 E62 | Q58-L60 PolarHBondContact O-N 3.33Å; Q58-L60 VanDerWaalsContact O-N 3.13Å; L60-E62 PolarHBondContact O-N 3.14Å | ||
| 61 | P | 49.9 | Very low | 50.7 | Low | 114 Ų | 114 | 144.7 Ų | 144.7 | 74% | 0.74 | 76% | 0.756 | S | S | * | * | trans | -59.8 | 111.5 | 179.1 | 21 | -29.6 | 0 | 0 | 0 | 109.2 | S63 | P61-S63 PolarHBondContact O-N 3.07Š| ||
| 62 | E | 57 | Low | 50.2 | Low | 158 Ų | 158 | 147.6 Ų | 147.6 | 74% | 0.738 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -68.5 | 74.6 | 171.4 | -72.5 | 171.6 | 166.2 | 0 | 0 | 108.4 | R59 L60 | R59-E62 IonicContact NH2-OE2 3.92Å; L60-E62 PolarHBondContact O-N 3.14Å |
| 63 | S | 51 | Low | 50 | Low | 94 Ų | 94 | 150.5 Ų | 150.5 | 66% | 0.657 | 76% | 0.757 | S | S | * | * | trans | 160.5 | 81.5 | 160.5 | 42.6 | 0 | 0 | 0 | 0 | 109.4 | P61 | P61-S63 PolarHBondContact O-N 3.07Š| ||
| 64 | L | 49.6 | Very low | 49.2 | Very low | 163 Ų | 163 | 153 Ų | 153 | 85% | 0.853 | 77% | 0.769 | S | S | * | * | trans | -106.5 | 88.7 | 141.7 | -143.4 | 82.7 | 0 | 0 | 0 | 104.8 | F66 | L64-F66 VanDerWaalsContact C-N 3.27Å; L64-F66 PolarHBondContact O-N 3.4Å | ||
| 65 | E | 55.1 | Low | 48.5 | Very low | 178 Ų | 178 | 150.5 Ų | 150.5 | 83% | 0.832 | 77% | 0.765 | S | S | * | * | trans | -49.5 | 106.8 | 158.7 | -66.7 | -170.4 | 166.5 | 0 | 0 | 105.4 | E67 | E65-E67 PolarHBondContact O-N 2.9Š| ||
| 66 | F | 51.6 | Low | 47.8 | Very low | 184 Ų | 184 | 151 Ų | 151 | 81% | 0.807 | 76% | 0.762 | S | S | * | * | trans | -71.2 | 84.5 | 175.7 | -172.4 | -95.3 | 0 | 0 | 0 | 105 | L64 S68 | L64-F66 VanDerWaalsContact C-N 3.27Å; L64-F66 PolarHBondContact O-N 3.4Å; F66-S68 VanDerWaalsContact C-N 3.26Å; F66-S68 PolarHBondContact O-N 3.45Å | ||
| 67 | E | 53.8 | Low | 47.5 | Very low | 148 Ų | 148 | 153.8 Ų | 153.8 | 69% | 0.692 | 77% | 0.767 | S | S | * | * | trans | -58.3 | 99.6 | 169.5 | -166.7 | 178 | -175.6 | 0 | 0 | 105.4 | E65 H69 | E65-E67 PolarHBondContact O-N 2.9Å; E67-H69 PolarHBondContact O-N 2.93Å | ||
| 68 | S | 50.2 | Low | 47.2 | Very low | 91 Ų | 91 | 151.2 Ų | 151.2 | 64% | 0.636 | 76% | 0.759 | S | S | * | * | trans | -64 | 93.6 | 172.9 | 54.8 | 0 | 0 | 0 | 0 | 105.7 | F66 E70 | F66-S68 VanDerWaalsContact C-N 3.26Å; F66-S68 PolarHBondContact O-N 3.45Å; S68-E70 PolarHBondContact O-N 3.07Å | ||
| 69 | H | 44.2 | Very low | 46.9 | Very low | 151 Ų | 151 | 150.2 Ų | 150.2 | 70% | 0.699 | 76% | 0.76 | S | S | * | * | trans | -60.6 | 92.3 | 162.1 | -76.5 | -55.9 | 0 | 0 | 0 | 106.2 | E67 L71 | E67-H69 PolarHBondContact O-N 2.93Å; H69-L71 VanDerWaalsContact C-N 3.29Å; H69-L71 PolarHBondContact O-N 3.17Å | ||
| 70 | E | 42.5 | Very low | 46.5 | Very low | 169 Ų | 169 | 146.3 Ų | 146.3 | 79% | 0.79 | 76% | 0.757 | S | S | * | * | trans | -50.2 | 104.6 | 158 | -136.1 | -178.7 | -172.9 | 0 | 0 | 104.4 | S68 Q72 | S68-E70 PolarHBondContact O-N 3.07Å; E70-Q72 PolarHBondContact O-N 2.9Å | ||
| 71 | L | 47.8 | Very low | 46 | Very low | 141 Ų | 141 | 142.3 Ų | 142.3 | 74% | 0.738 | 75% | 0.752 | S | S | * | * | trans | -66 | 79.8 | 178.5 | -84.1 | 156.4 | 0 | 0 | 0 | 107.6 | H69 R73 | H69-L71 VanDerWaalsContact C-N 3.29Å; H69-L71 PolarHBondContact O-N 3.17Å; L71-R73 HydrophobicContact CD2-CG 4.13Å; L71-R73 PolarHBondContact O-N 3.25Å | ||
| 72 | Q | 40.5 | Very low | 45.7 | Very low | 164 Ų | 164 | 145.4 Ų | 145.4 | 77% | 0.766 | 76% | 0.759 | S | S | * | * | trans | -64.4 | 76.6 | 151.6 | -78.1 | -175.3 | 1.3 | 0 | 0 | 107.1 | E70 V74 | E70-Q72 PolarHBondContact O-N 2.9Å; Q72-V74 VanDerWaalsContact C-N 3.25Å; Q72-V74 PolarHBondContact O-N 2.94Å | ||
| 73 | R | 46.4 | Very low | 45.7 | Very low | 220 Ų | 220 | 143.1 Ų | 143.1 | 83% | 0.83 | 76% | 0.76 | S | S | * | * | trans | -92.7 | 77.4 | 156.6 | -71 | -147.6 | -176.3 | -174.9 | 2.4 | 108.1 | L71 | L71-R73 HydrophobicContact CD2-CG 4.13Å; L71-R73 PolarHBondContact O-N 3.25Å | ||
| 74 | V | 36.7 | Very low | 45.4 | Very low | 126 Ų | 126 | 147.7 Ų | 147.7 | 76% | 0.764 | 77% | 0.769 | S | S | * | * | trans | -45.9 | 136.7 | 147.6 | 177.4 | 0 | 0 | 0 | 0 | 107.7 | Q72 | Q72-V74 VanDerWaalsContact C-N 3.25Å; Q72-V74 PolarHBondContact O-N 2.94Å | ||
| 75 | G | 36.6 | Very low | 44.8 | Very low | 68 Ų | 68 | 143.7 Ų | 143.7 | 70% | 0.701 | 77% | 0.767 | S | S | * | * | trans | -53.4 | 143 | -165.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 76 | H | 37 | Very low | 44.6 | Very low | 166 Ų | 166 | 143.8 Ų | 143.8 | 77% | 0.769 | 77% | 0.765 | S | S | * | * | trans | -142.7 | 113.3 | 142.4 | -141.6 | 42.2 | 0 | 0 | 0 | 107.7 | D78 | H76-D78 IonicContact CD2-OD2 3.54Å; H76-D78 IonicContact NE2-OD2 3.64Å; H76-D78 PolarHBondContact O-N 3.07Å | ||
| 77 | Q | 43.5 | Very low | 44.2 | Very low | 184 Ų | 184 | 140.4 Ų | 140.4 | 86% | 0.86 | 76% | 0.761 | S | S | * | * | trans | -60.1 | 116.7 | 153.1 | -64.1 | -163.8 | -0.7 | 0 | 0 | 105.5 | ||||
| 78 | D | 38.8 | Very low | 44 | Very low | 122 Ų | 122 | 139.3 Ų | 139.3 | 65% | 0.652 | 76% | 0.764 | S | S | * | * | trans | -151.1 | 108.4 | 145 | -92.1 | -30.6 | 0 | 0 | 0 | 107.9 | H76 V80 | H76-D78 IonicContact CD2-OD2 3.54Å; H76-D78 IonicContact NE2-OD2 3.64Å; H76-D78 PolarHBondContact O-N 3.07Å; D78-V80 HydrophobicContact CB-CG2 4.38Å; D78-V80 PolarHBondContact O-N 2.93Å | ||
| 79 | N | 44.4 | Very low | 43.9 | Very low | 170 Ų | 170 | 143 Ų | 143 | 91% | 0.909 | 77% | 0.774 | S | S | * | * | trans | -72.7 | 69.4 | -179 | -162.4 | 16.3 | 0 | 0 | 0 | 108.6 | G81 | N79-G81 PolarHBondContact O-N 3.07Š| ||
| 80 | V | 44.8 | Very low | 44 | Very low | 112 Ų | 112 | 143.7 Ų | 143.7 | 68% | 0.679 | 78% | 0.779 | S | S | * | * | trans | -99 | 72.6 | 172.3 | -165.8 | 0 | 0 | 0 | 0 | 108.3 | D78 M82 | D78-V80 HydrophobicContact CB-CG2 4.38Å; D78-V80 PolarHBondContact O-N 2.93Å; V80-M82 VanDerWaalsContact C-N 3.28Å; V80-M82 HydrophobicContact CG1-CG 4.23Å; V80-M82 PolarHBondContact O-N 3.43Å | ||
| 81 | G | 45.6 | Very low | 44.4 | Very low | 66 Ų | 66 | 144.3 Ų | 144.3 | 68% | 0.68 | 78% | 0.782 | S | S | * | * | trans | -64.8 | 90.9 | 162.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | N79 S83 | N79-G81 PolarHBondContact O-N 3.07Å; G81-S83 VanDerWaalsContact C-N 3.3Å; G81-S83 PolarHBondContact O-N 3.4Å; G81-S83 VanDerWaalsContact O-N 3.08Å | ||
| 82 | M | 43.5 | Very low | 44.3 | Very low | 178 Ų | 178 | 143.7 Ų | 143.7 | 88% | 0.877 | 78% | 0.78 | S | S | * | * | trans | -74 | 87.2 | 161.8 | -78.4 | 173.3 | 122.9 | 0 | 0 | 108.4 | V80 | V80-M82 VanDerWaalsContact C-N 3.28Å; V80-M82 HydrophobicContact CG1-CG 4.23Å; V80-M82 PolarHBondContact O-N 3.43Å | ||
| 83 | S | 55.2 | Low | 44.5 | Very low | 110 Ų | 110 | 146.5 Ų | 146.5 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | trans | -91 | 108.4 | 162.2 | 54.8 | 0 | 0 | 0 | 0 | 109.2 | G81 G85 | G81-S83 VanDerWaalsContact C-N 3.3Å; G81-S83 PolarHBondContact O-N 3.4Å; G81-S83 VanDerWaalsContact O-N 3.08Å; S83-G85 PolarHBondContact O-N 3Å | ||
| 84 | F | 45.7 | Very low | 44.6 | Very low | 191 Ų | 191 | 139 Ų | 139 | 84% | 0.838 | 78% | 0.776 | S | S | * | * | trans | 2 | 108.8 | 157.2 | -101.8 | -106.6 | 0 | 0 | 0 | 115.9 | F86 | F84-F86 PolarHBondContact O-N 3.41Š| ||
| 85 | G | 37.7 | Very low | 45.3 | Very low | 79 Ų | 79 | 139.6 Ų | 139.6 | 81% | 0.814 | 78% | 0.78 | S | S | * | * | trans | -67 | 112.4 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | S83 | S83-G85 PolarHBondContact O-N 3Š| ||
| 86 | F | 49.1 | Very low | 46.1 | Very low | 179 Ų | 179 | 146.6 Ų | 146.6 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | trans | -78 | 149.2 | 158.1 | -88.6 | -94.3 | 0 | 0 | 0 | 109.2 | F84 V88 | F84-F86 PolarHBondContact O-N 3.41Å; F86-V88 PolarHBondContact O-N 3.03Å | ||
| 87 | P | 45.1 | Very low | 46.9 | Very low | 113 Ų | 113 | 143.7 Ų | 143.7 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | trans | -64.9 | 130 | -168.8 | 24.7 | -32 | 0 | 0 | 0 | 111.5 | M89 | P87-M89 PolarHBondContact O-N 3.3Š| ||
| 88 | V | 47.7 | Very low | 47.7 | Very low | 126 Ų | 126 | 140.6 Ų | 140.6 | 76% | 0.764 | 78% | 0.781 | S | S | * | * | trans | -55.1 | 101.9 | 171.4 | 176.3 | 0 | 0 | 0 | 0 | 108.7 | F86 M90 | F86-V88 PolarHBondContact O-N 3.03Å; V88-M90 HydrophobicContact CG1-CG 4.42Å; V88-M90 HydrophobicContact CG1-SD 4.32Å; V88-M90 PolarHBondContact O-N 3.42Å | ||
| 89 | M | 49 | Very low | 48.9 | Very low | 168 Ų | 168 | 140.4 Ų | 140.4 | 83% | 0.828 | 78% | 0.784 | S | S | * | * | trans | -79.9 | 109.3 | 155.1 | -68.9 | -159.2 | 90.1 | 0 | 0 | 106.5 | P87 Q91 | P87-M89 PolarHBondContact O-N 3.3Å; M89-Q91 PolarHBondContact O-N 3.05Å | ||
| 90 | M | 46.8 | Very low | 49.8 | Very low | 166 Ų | 166 | 140.3 Ų | 140.3 | 82% | 0.818 | 78% | 0.779 | S | S | * | * | trans | -56.5 | 103.6 | 164.5 | -66.6 | -75.1 | -124.3 | 0 | 0 | 107 | V88 | V88-M90 HydrophobicContact CG1-CG 4.42Å; V88-M90 HydrophobicContact CG1-SD 4.32Å; V88-M90 PolarHBondContact O-N 3.42Å | ||
| 91 | Q | 51.5 | Low | 50.7 | Low | 182 Ų | 182 | 139.9 Ų | 139.9 | 85% | 0.85 | 78% | 0.778 | S | S | * | * | trans | -119.7 | 105.5 | 166.3 | -118.3 | 177.4 | 18.2 | 0 | 0 | 108.1 | M89 Y93 | M89-Q91 PolarHBondContact O-N 3.05Å; Q91-Y93 PolarHBondContact O-N 3.33Å | ||
| 92 | D | 45.6 | Very low | 51.5 | Low | 128 Ų | 128 | 146.6 Ų | 146.6 | 68% | 0.684 | 79% | 0.788 | S | S | * | * | trans | -56.7 | 123.6 | 179.8 | -75.2 | -43.4 | 0 | 0 | 0 | 112 | ||||
| 93 | Y | 44.5 | Very low | 52.3 | Low | 223 Ų | 223 | 146.7 Ų | 146.7 | 88% | 0.875 | 78% | 0.784 | S | S | * | * | trans | 47.4 | 73 | 148 | -56.6 | -83.3 | 0 | 0 | 0 | 118.2 | Q91 | Q91-Y93 PolarHBondContact O-N 3.33Š| ||
| 94 | G | 48.6 | Very low | 52.8 | Low | 63 Ų | 63 | 146.7 Ų | 146.7 | 65% | 0.649 | 78% | 0.784 | S | S | * | * | trans | -99.4 | 106.6 | 150.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | Y96 | G94-Y96 PolarHBondContact O-N 2.98Š| ||
| 95 | T | 50.9 | Low | 53.7 | Low | 138 Ų | 138 | 143.6 Ų | 143.6 | 85% | 0.847 | 78% | 0.781 | S | S | * | * | trans | -48.4 | 107.1 | 171 | -54.6 | 0 | 0 | 0 | 0 | 109.7 | P97 | T95-P97 WeakPolarHBondContact O-CD 3.28Š| ||
| 96 | Y | 53.5 | Low | 54.8 | Low | 214 Ų | 214 | 145.9 Ų | 145.9 | 84% | 0.839 | 77% | 0.774 | S | S | * | * | trans | -61.7 | 123.6 | 173.6 | -81.8 | -89.9 | 0 | 0 | 0 | 108.2 | G94 S98 | G94-Y96 PolarHBondContact O-N 2.98Å; Y96-S98 PolarHBondContact O-N 3.42Å | ||
| 97 | P | 54.2 | Low | 55.7 | Low | 106 Ų | 106 | 145.1 Ų | 145.1 | 69% | 0.688 | 77% | 0.773 | S | S | * | * | trans | -65 | 114.9 | 169.5 | 27.2 | -31.3 | 0 | 0 | 0 | 107 | T95 V99 | T95-P97 WeakPolarHBondContact O-CD 3.28Å; P97-V99 HydrophobicContact CB-CG2 4.21Å; P97-V99 PolarHBondContact O-N 3.47Å | ||
| 98 | S | 60.6 | Low | 56.5 | Low | 118 Ų | 118 | 148.2 Ų | 148.2 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | trans | -68.6 | 69.8 | 170.3 | 60.9 | 0 | 0 | 0 | 0 | 108.9 | Y96 E100 | Y96-S98 PolarHBondContact O-N 3.42Å; S98-E100 PolarHBondContact O-N 3.5Å | ||
| 99 | V | 62.8 | Low | 56.9 | Low | 119 Ų | 119 | 145.6 Ų | 145.6 | 72% | 0.721 | 78% | 0.781 | S | S | * | * | trans | -80.8 | 97.6 | 164.5 | -173.3 | 0 | 0 | 0 | 0 | 104.8 | P97 | P97-V99 HydrophobicContact CB-CG2 4.21Å; P97-V99 PolarHBondContact O-N 3.47Å | ||
| 100 | E | 63.9 | Low | 57.4 | Low | 168 Ų | 168 | 140.3 Ų | 140.3 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | trans | -49.2 | 129 | 164.7 | -75.4 | -174.7 | 160.3 | 0 | 0 | 107.8 | S98 K102 | S98-E100 PolarHBondContact O-N 3.5Å; E100-K102 PolarHBondContact O-N 3.46Å | ||
| 101 | P | 63.8 | Low | 58.3 | Low | 102 Ų | 102 | 141.7 Ų | 141.7 | 66% | 0.662 | 77% | 0.774 | S | S | * | * | trans | -59.8 | 109.8 | 178.1 | 22.5 | -30.4 | 0 | 0 | 0 | 108.2 | F103 | P101-F103 HydrophobicContact CG-CE2 4.34Å; P101-F103 WeakPolarHBondContact O-CD2 3.45Å; P101-F103 PolarHBondContact O-N 3.31Å | ||
| 102 | K | 61.6 | Low | 58.8 | Low | 208 Ų | 208 | 140.7 Ų | 140.7 | 90% | 0.904 | 77% | 0.772 | S | S | * | * | trans | -65.3 | 103.9 | 174.2 | -125 | 175 | -177.4 | 177.4 | 0 | 107.3 | E100 S104 | E100-K102 PolarHBondContact O-N 3.46Å; K102-S104 PolarHBondContact O-N 2.87Å | ||
| 103 | F | 59.7 | Low | 59.9 | Low | 179 Ų | 179 | 139.1 Ų | 139.1 | 79% | 0.785 | 78% | 0.776 | S | S | * | * | trans | -69.8 | 119.9 | 163.2 | -67.1 | -85.6 | 0 | 0 | 0 | 106.8 | P101 V105 | P101-F103 HydrophobicContact CG-CE2 4.34Å; P101-F103 WeakPolarHBondContact O-CD2 3.45Å; P101-F103 PolarHBondContact O-N 3.31Å; F103-V105 PolarHBondContact O-N 3.45Å | ||
| 104 | S | 65.8 | Low | 60.9 | Low | 111 Ų | 111 | 134.1 Ų | 134.1 | 78% | 0.776 | 77% | 0.774 | S | S | * | * | trans | -60.1 | 106.2 | 166 | 50.5 | 0 | 0 | 0 | 0 | 107 | K102 L106 | K102-S104 PolarHBondContact O-N 2.87Å; S104-L106 PolarHBondContact O-N 2.87Å | ||
| 105 | V | 66.2 | Low | 61.8 | Low | 126 Ų | 126 | 136.4 Ų | 136.4 | 76% | 0.764 | 78% | 0.78 | S | S | * | * | trans | -56.9 | 113.1 | 166.7 | 178.2 | 0 | 0 | 0 | 0 | 105.1 | F103 E107 | F103-V105 PolarHBondContact O-N 3.45Å; V105-E107 PolarHBondContact O-N 3.11Å | ||
| 106 | L | 60 | Low | 63 | Low | 127 Ų | 127 | 135.8 Ų | 135.8 | 67% | 0.665 | 78% | 0.775 | S | S | * | * | trans | -68.6 | 100.3 | -179.1 | -167.8 | 73.8 | 0 | 0 | 0 | 106.2 | S104 D108 M112 | S104-L106 PolarHBondContact O-N 2.87Å; L106-D108 PolarHBondContact O-N 3.03Å; L106-M112 HydrophobicContact CD2-CE 4.19Å | ||
| 107 | E | 67 | Low | 63.9 | Low | 163 Ų | 163 | 131 Ų | 131 | 76% | 0.762 | 77% | 0.771 | S | S | * | * | trans | -55.8 | 122.3 | 171.3 | -68.3 | -87.2 | 149.8 | 0 | 0 | 108 | V105 G109 | V105-E107 PolarHBondContact O-N 3.11Å; E107-G109 PolarHBondContact O-N 2.97Å | ||
| 108 | D | 62.2 | Low | 65 | Low | 178 Ų | 178 | 137.3 Ų | 137.3 | 95% | 0.952 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.5 | 73.2 | 176.3 | -93 | -25.3 | 0 | 0 | 0 | 109.8 | L106 | L106-D108 PolarHBondContact O-N 3.03Š|
| 109 | G | 57.1 | Low | 65.9 | Low | 70 Ų | 70 | 141.1 Ų | 141.1 | 72% | 0.722 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -169 | -5.2 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | E107 E111 | E107-G109 PolarHBondContact O-N 2.97Å; G109-E111 PolarHBondContact O-N 3.43Å |
| 110 | G | 58.6 | Low | 66.8 | Low | 57 Ų | 57 | 144.3 Ų | 144.3 | 59% | 0.588 | 79% | 0.79 | S | S | * | * | trans | -79.1 | 109.4 | 173 | 0 | 0 | 0 | 0 | 0 | 110.7 | M112 | G110-M112 PolarHBondContact O-N 3.22Š| ||
| 111 | E | 65.7 | Low | 67.6 | Low | 195 Ų | 195 | 145.8 Ų | 145.8 | 91% | 0.911 | 79% | 0.793 | S | S | * | * | trans | -44 | 110.9 | 161.3 | -72.5 | -179.8 | 163.6 | 0 | 0 | 108.5 | G109 A113 | G109-E111 PolarHBondContact O-N 3.43Å; E111-A113 VanDerWaalsContact C-N 3.32Å; E111-A113 PolarHBondContact O-N 3.19Å | ||
| 112 | M | 63.6 | Low | 68.4 | Low | 162 Ų | 162 | 152.4 Ų | 152.4 | 80% | 0.798 | 81% | 0.805 | S | S | * | * | trans | -64.1 | 96.2 | -179.6 | -70.7 | -74.9 | -165.1 | 0 | 0 | 107.7 | L106 G110 S114 | L106-M112 HydrophobicContact CD2-CE 4.19Å; G110-M112 PolarHBondContact O-N 3.22Å; M112-S114 PolarHBondContact O-N 3.34Å; M112-S114 VanDerWaalsContact O-N 3.1Å | ||
| 113 | A | 66.9 | Low | 69.4 | Low | 94 Ų | 94 | 151.8 Ų | 151.8 | 78% | 0.777 | 80% | 0.803 | S | S | * | * | trans | -53.4 | 122.9 | 173 | 0 | 0 | 0 | 0 | 0 | 107.9 | E111 S115 | E111-A113 VanDerWaalsContact C-N 3.32Å; E111-A113 PolarHBondContact O-N 3.19Å; A113-S115 PolarHBondContact O-N 3.15Å | ||
| 114 | S | 66.1 | Low | 70.4 | Confident | 119 Ų | 119 | 155 Ų | 155 | 83% | 0.832 | 81% | 0.809 | S | S | * | * | trans | -62 | 97.8 | -176.6 | 51.5 | 0 | 0 | 0 | 0 | 109.4 | M112 V116 | M112-S114 PolarHBondContact O-N 3.34Å; M112-S114 VanDerWaalsContact O-N 3.1Å; S114-V116 PolarHBondContact O-N 3.09Å; S114-V116 VanDerWaalsContact O-N 3.17Å | ||
| 115 | S | 68.6 | Low | 71 | Confident | 110 Ų | 110 | 159.3 Ų | 159.3 | 77% | 0.769 | 81% | 0.814 | S | S | * | * | trans | -63.8 | 121.8 | 178.3 | 71.3 | 0 | 0 | 0 | 0 | 108.2 | A113 | A113-S115 PolarHBondContact O-N 3.15Š| ||
| 116 | V | 74.6 | Confident | 71.6 | Confident | 125 Ų | 125 | 158.8 Ų | 158.8 | 76% | 0.758 | 82% | 0.816 | S | S | * | * | trans | -53.6 | 130.8 | 178.4 | 179.9 | 0 | 0 | 0 | 0 | 108.9 | S114 R118 | S114-V116 PolarHBondContact O-N 3.09Å; S114-V116 VanDerWaalsContact O-N 3.17Å; V116-R118 PolarHBondContact O-N 3Å | ||
| 117 | P | 73.6 | Confident | 72.5 | Confident | 114 Ų | 114 | 157.8 Ų | 157.8 | 74% | 0.74 | 81% | 0.806 | S | S | * | * | trans | -55 | 112 | -178 | 18.3 | -30.2 | 0 | 0 | 0 | 109.8 | K119 | P117-K119 PolarHBondContact O-N 2.71Š| ||
| 118 | R | 77.4 | Confident | 73.4 | Confident | 238 Ų | 238 | 153.4 Ų | 153.4 | 90% | 0.898 | 79% | 0.794 | S | S | * | * | trans | -65.1 | 105.6 | -179.5 | -171.7 | 172.7 | 176.3 | 161.9 | -2.4 | 107.3 | V116 Q120 | V116-R118 PolarHBondContact O-N 3Å; R118-Q120 PolarHBondContact O-N 2.98Å | ||
| 119 | K | 79.7 | Confident | 74.3 | Confident | 199 Ų | 199 | 151 Ų | 151 | 87% | 0.865 | 78% | 0.78 | S | S | * | * | trans | -50.2 | 112.6 | 177.4 | -68 | -177.9 | 179.8 | 178.6 | 0 | 108.7 | P117 K121 | P117-K119 PolarHBondContact O-N 2.71Å; K119-K121 PolarHBondContact O-N 2.61Å | ||
| 120 | Q | 80.3 | Confident | 75.7 | Confident | 186 Ų | 186 | 155.5 Ų | 155.5 | 87% | 0.869 | 78% | 0.782 | S | S | * | * | trans | -58.9 | 114.6 | 176.4 | -73.6 | -178.5 | -3.6 | 0 | 0 | 108.1 | R118 R122 | R118-Q120 PolarHBondContact O-N 2.98Å; Q120-R122 PolarHBondContact O-N 3.44Å | ||
| 121 | K | 81.4 | Confident | 77 | Confident | 199 Ų | 199 | 154.5 Ų | 154.5 | 87% | 0.865 | 77% | 0.769 | S | S | * | * | trans | -65.8 | 104 | 172.5 | -71.6 | -169.8 | 178.2 | -176.4 | 0 | 107.2 | K119 K123 | K119-K121 PolarHBondContact O-N 2.61Å; K121-K123 PolarHBondContact O-N 3Å | ||
| 122 | R | 81.5 | Confident | 77.6 | Confident | 241 Ų | 241 | 146.9 Ų | 146.9 | 91% | 0.909 | 73% | 0.733 | S | S | * | * | trans | -56.7 | 114.8 | 173.1 | -70.2 | -179.4 | 85.4 | -178.4 | 6.6 | 108 | Q120 R124 | Q120-R122 PolarHBondContact O-N 3.44Å; R122-R124 PolarHBondContact O-N 3.35Å | ||
| 123 | K | 81.6 | Confident | 78.5 | Confident | 195 Ų | 195 | 146.3 Ų | 146.3 | 85% | 0.848 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 123.8 | 170.2 | -67.6 | -74.6 | -174.9 | 168.4 | 0 | 107.3 | K121 K125 | K121-K123 PolarHBondContact O-N 3Å; K123-K125 PolarHBondContact O-N 3.45Å |
| 124 | R | 80.1 | Confident | 79.3 | Confident | 245 Ų | 245 | 144.8 Ų | 144.8 | 93% | 0.925 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -70 | 124.8 | 169.9 | -67.2 | -177.4 | 177.4 | 178.7 | -1.8 | 107 | R122 | R122-R124 PolarHBondContact O-N 3.35Š|
| 125 | K | 80 | Confident | 80 | Confident | 203 Ų | 203 | 142.8 Ų | 142.8 | 88% | 0.883 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 139.7 | 170.5 | -63.8 | -170 | 177.9 | -173.4 | 0 | 108.3 | K123 | K123-K125 PolarHBondContact O-N 3.45Š|
| 126 | S | 78.2 | Confident | 80.3 | Confident | 115 Ų | 115 | 139.1 Ų | 139.1 | 80% | 0.804 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 137.4 | 168.2 | 46.3 | 0 | 0 | 0 | 0 | 108.8 | ||
| 127 | K | 78.3 | Confident | 80.6 | Confident | 105 Ų | 105 | 142.5 Ų | 142.5 | 46% | 0.457 | 66% | 0.664 | S | S | . | * | P | Polyproline II helix | trans | -65.1 | 147.1 | 173.3 | -64.8 | -174.1 | -176 | -176.6 | 0 | 108.9 | A131 M132 E135 | K127-A131 HydrophobicContact CB-CB 4.43Å; K127-M132 HydrophobicContact CB-CG 4.04Å; K127-E135 IonicContact NZ-OE1 2.61Å; K127-E135 PolarHBondContact NZ-OE1 2.88Å; K127-E135 IonicContact NZ-OE2 2.71Å; K127-E135 PolarHBondContact NZ-OE2 3.03Å |
| 128 | S | 85.7 | Confident | 81 | Confident | 72 Ų | 72 | 146 Ų | 146 | 50% | 0.503 | 67% | 0.668 | S | S | . | * | P | Polyproline II helix | trans | -63.3 | 153.2 | 170.5 | 59.5 | 0 | 0 | 0 | 0 | 110.3 | E130 A131 M132 | S128-E130 PolarHBondContact O-N 3.48Å; S128-A131 PolarHBondContact O-N 3.17Å; S128-A131 WeakPolarHBondContact OG-CB 3.41Å; S128-A131 PolarHBondContact OG-N 3.49Å; S128-M132 WeakPolarHBondContact O-CG 3.38Å; S128-M132 PolarHBondContact O-N 2.78Å |
| 129 | L | 82.1 | Confident | 80.7 | Confident | 127 Ų | 127 | 135.9 Ų | 135.9 | 67% | 0.665 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -54.6 | -42.2 | 177.9 | -77.3 | 162.3 | 0 | 0 | 0 | 112.1 | A131 M132 Y133 | L129-A131 PolarHBondContact O-N 2.87Å; L129-M132 HydrophobicContact CB-CE 4.3Å; L129-M132 HydrophobicContact CD2-CE 3.42Å; L129-M132 VanDerWaalsContact CD2-CE 3.42Å; L129-M132 HydrophobicContact CG-CE 3.94Å; L129-M132 WeakPolarHBondContact O-CB 3.46Å; L129-M132 PolarHBondContact O-N 3.23Å; L129-M132 VanDerWaalsContact O-N 3.11Å; L129-Y133 VanDerWaalsContact O-CD2 3.27Å; L129-Y133 WeakPolarHBondContact O-CD2 3.08Å; L129-Y133 PolarHBondContact O-N 3.31Å |
| 130 | E | 86.4 | Confident | 80.4 | Confident | 164 Ų | 164 | 135 Ų | 135 | 77% | 0.766 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -60.1 | -44.1 | 178.1 | -169.4 | 179.9 | -176.9 | 0 | 0 | 112.7 | S128 M132 Y133 A134 | S128-E130 PolarHBondContact O-N 3.48Å; E130-M132 VanDerWaalsContact C-N 3.26Å; E130-M132 PolarHBondContact O-N 2.83Å; E130-Y133 PolarHBondContact O-N 3.41Å; E130-A134 PolarHBondContact O-N 2.73Å |
| 131 | A | 84.9 | Confident | 79.8 | Confident | 36 Ų | 36 | 135 Ų | 135 | 30% | 0.298 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -63.6 | -33.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | K127 S128 L129 E135 | K127-A131 HydrophobicContact CB-CB 4.43Å; S128-A131 PolarHBondContact O-N 3.17Å; S128-A131 WeakPolarHBondContact OG-CB 3.41Å; S128-A131 PolarHBondContact OG-N 3.49Å; L129-A131 PolarHBondContact O-N 2.87Å; A131-E135 WeakPolarHBondContact O-CG 3.44Å; A131-E135 PolarHBondContact O-N 2.78Å; A131-E135 VanDerWaalsContact O-N 3.15Å |
| 132 | M | 79.5 | Confident | 79 | Confident | 35 Ų | 35 | 134.5 Ų | 134.5 | 17% | 0.172 | 63% | 0.629 | C | S | . | * | H | α-helix | trans | -68.1 | -41 | 175.9 | -61.7 | -172.5 | -69 | 0 | 0 | 111.6 | K127 S128 L129 E130 E135 L136 Y151 | K127-M132 HydrophobicContact CB-CG 4.04Å; S128-M132 WeakPolarHBondContact O-CG 3.38Å; S128-M132 PolarHBondContact O-N 2.78Å; L129-M132 HydrophobicContact CB-CE 4.3Å; L129-M132 HydrophobicContact CD2-CE 3.42Å; L129-M132 VanDerWaalsContact CD2-CE 3.42Å; L129-M132 HydrophobicContact CG-CE 3.94Å; L129-M132 WeakPolarHBondContact O-CB 3.46Å; L129-M132 PolarHBondContact O-N 3.23Å; L129-M132 VanDerWaalsContact O-N 3.11Å; E130-M132 VanDerWaalsContact C-N 3.26Å; E130-M132 PolarHBondContact O-N 2.83Å; M132-E135 PolarHBondContact O-N 3.08Å; M132-L136 WeakPolarHBondContact O-CG 3.3Å; M132-L136 PolarHBondContact O-N 3.04Å; M132-Y151 HydrophobicContact CB-CD2 4.5Å; M132-Y151 HydrophobicContact CB-CE1 4.3Å; M132-Y151 HydrophobicContact CB-CE2 4.26Å; M132-Y151 HydrophobicContact CG-CD1 3.92Å; M132-Y151 HydrophobicContact CG-CE1 3.51Å; M132-Y151 HydrophobicContact CG-CE2 4.32Å; M132-Y151 HydrophobicContact CG-CG 4.46Å; M132-Y151 HydrophobicContact SD-CD1 3.07Å; M132-Y151 WeakPolarHBondContact SD-CD1 3.44Å; M132-Y151 HydrophobicContact SD-CD2 4.49Å; M132-Y151 HydrophobicContact SD-CE1 3.22Å; M132-Y151 WeakPolarHBondContact SD-CE1 3.49Å; M132-Y151 HydrophobicContact SD-CG 3.77Å |
| 133 | Y | 81.2 | Confident | 78.7 | Confident | 151 Ų | 151 | 126.5 Ų | 126.5 | 59% | 0.592 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -64.4 | -42.1 | 175.1 | -83.1 | -70.4 | 0 | 0 | 0 | 112.7 | L129 E130 E135 L136 K137 | L129-Y133 VanDerWaalsContact O-CD2 3.27Å; L129-Y133 WeakPolarHBondContact O-CD2 3.08Å; L129-Y133 PolarHBondContact O-N 3.31Å; E130-Y133 PolarHBondContact O-N 3.41Å; Y133-E135 VanDerWaalsContact C-N 3.35Å; Y133-E135 PolarHBondContact O-N 3.32Å; Y133-L136 PolarHBondContact O-N 2.96Å; Y133-K137 PolarHBondContact O-N 3.28Å |
| 134 | A | 84 | Confident | 78.5 | Confident | 62 Ų | 62 | 119 Ų | 119 | 51% | 0.512 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -61.8 | -41.7 | 177 | 0 | 0 | 0 | 0 | 0 | 112.2 | E130 K137 K138 | E130-A134 PolarHBondContact O-N 2.73Å; A134-K137 PolarHBondContact O-N 2.86Å; A134-K138 WeakPolarHBondContact O-CB 3.41Å; A134-K138 PolarHBondContact O-N 2.94Å; A134-K138 VanDerWaalsContact O-N 3.09Å |
| 135 | E | 81.4 | Confident | 78.4 | Confident | 76 Ų | 76 | 113.7 Ų | 113.7 | 36% | 0.355 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.8 | -41.8 | 176.1 | -75.9 | -177.6 | 175.3 | 0 | 0 | 112.4 | K127 A131 M132 Y133 K138 A139 Y151 | K127-E135 IonicContact NZ-OE1 2.61Å; K127-E135 PolarHBondContact NZ-OE1 2.88Å; K127-E135 IonicContact NZ-OE2 2.71Å; K127-E135 PolarHBondContact NZ-OE2 3.03Å; A131-E135 WeakPolarHBondContact O-CG 3.44Å; A131-E135 PolarHBondContact O-N 2.78Å; A131-E135 VanDerWaalsContact O-N 3.15Å; M132-E135 PolarHBondContact O-N 3.08Å; Y133-E135 VanDerWaalsContact C-N 3.35Å; Y133-E135 PolarHBondContact O-N 3.32Å; E135-K138 PolarHBondContact O-N 2.94Å; E135-A139 VanDerWaalsContact O-CB 3.3Å; E135-A139 WeakPolarHBondContact O-CB 3.27Å; E135-A139 PolarHBondContact O-N 3.43Å; E135-Y151 PolarHBondContact OE2-OH 2.97Å |
| 136 | L | 75.7 | Confident | 78.4 | Confident | 33 Ų | 33 | 110.7 Ų | 110.7 | 17% | 0.173 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -62.8 | -41.2 | 176 | -76.5 | 171.5 | 0 | 0 | 0 | 112.4 | M132 Y133 K138 A139 L147 | M132-L136 WeakPolarHBondContact O-CG 3.3Å; M132-L136 PolarHBondContact O-N 3.04Å; Y133-L136 PolarHBondContact O-N 2.96Å; L136-K138 VanDerWaalsContact C-N 3.32Å; L136-K138 PolarHBondContact O-N 3.37Å; L136-A139 PolarHBondContact O-N 2.89Å; L136-L147 HydrophobicContact CD2-CB 3.53Å; L136-L147 HydrophobicContact CD2-CD1 4.1Å; L136-L147 HydrophobicContact CD2-CG 4.41Å |
| 137 | K | 79.4 | Confident | 78.3 | Confident | 196 Ų | 196 | 106.2 Ų | 106.2 | 85% | 0.852 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67 | -33.7 | 177.6 | -172 | 176.4 | 178.7 | 179.9 | 0 | 112.3 | Y133 A134 | Y133-K137 PolarHBondContact O-N 3.28Å; A134-K137 PolarHBondContact O-N 2.86Å |
| 138 | K | 81.6 | Confident | 78.4 | Confident | 189 Ų | 189 | 107.9 Ų | 107.9 | 82% | 0.822 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -82.3 | -24.3 | 178 | -170.2 | 174.7 | 180 | 178 | 0 | 113 | A134 E135 L136 | A134-K138 WeakPolarHBondContact O-CB 3.41Å; A134-K138 PolarHBondContact O-N 2.94Å; A134-K138 VanDerWaalsContact O-N 3.09Å; E135-K138 PolarHBondContact O-N 2.94Å; L136-K138 VanDerWaalsContact C-N 3.32Å; L136-K138 PolarHBondContact O-N 3.37Å |
| 139 | A | 72.5 | Confident | 78.2 | Confident | 24 Ų | 24 | 112.8 Ų | 112.8 | 20% | 0.198 | 53% | 0.526 | C | S | . | . | S | Bend | trans | -66.5 | 134.2 | -178.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | E135 L136 I144 L147 | E135-A139 VanDerWaalsContact O-CB 3.3Å; E135-A139 WeakPolarHBondContact O-CB 3.27Å; E135-A139 PolarHBondContact O-N 3.43Å; L136-A139 PolarHBondContact O-N 2.89Å; A139-I144 HydrophobicContact CB-CG1 4.46Å; A139-L147 HydrophobicContact CB-CD1 3.72Å |
| 140 | K | 72.7 | Confident | 78.1 | Confident | 182 Ų | 182 | 114.4 Ų | 114.4 | 79% | 0.791 | 53% | 0.527 | S | S | * | . | trans | -61.8 | 148.2 | 168.5 | -67.1 | -177 | 177.5 | -177.6 | 0 | 109.1 | H142 N143 | K140-H142 PolarHBondContact O-N 2.77Å; K140-N143 PolarHBondContact O-N 2.94Å | ||
| 141 | F | 67.7 | Low | 77.8 | Confident | 184 Ų | 184 | 109.2 Ų | 109.2 | 81% | 0.807 | 50% | 0.501 | S | S | * | . | G | 310 helix | trans | -44.5 | -35.6 | -178.3 | -71.6 | -80.4 | 0 | 0 | 0 | 114 | N143 I144 | F141-N143 PolarHBondContact O-N 2.69Å; F141-N143 VanDerWaalsContact O-N 3.16Å; F141-I144 HydrophobicContact CD1-CD1 4.18Å; F141-I144 PolarHBondContact O-N 3.05Å |
| 142 | H | 65.1 | Low | 77.5 | Confident | 189 Ų | 189 | 113.1 Ų | 113.1 | 88% | 0.875 | 51% | 0.512 | S | S | * | . | G | 310 helix | trans | -62.9 | -20 | -179 | -146.7 | 64.2 | 0 | 0 | 0 | 114.8 | K140 | K140-H142 PolarHBondContact O-N 2.77Š|
| 143 | N | 75.6 | Confident | 77.4 | Confident | 73 Ų | 73 | 120.3 Ų | 120.3 | 39% | 0.39 | 54% | 0.542 | S | S | . | . | G | 310 helix | trans | -110.4 | -1 | -178.1 | -156.4 | -2.9 | 0 | 0 | 0 | 113.6 | K140 F141 H145 L147 | K140-N143 PolarHBondContact O-N 2.94Å; F141-N143 PolarHBondContact O-N 2.69Å; F141-N143 VanDerWaalsContact O-N 3.16Å; N143-H145 VanDerWaalsContact C-N 3.35Å; N143-H145 PolarHBondContact O-N 3.23Å; N143-L147 WeakPolarHBondContact O-CD1 3.22Å; N143-L147 WeakPolarHBondContact O-CG 3.41Å; N143-L147 PolarHBondContact O-N 2.9Å |
| 144 | I | 77.5 | Confident | 76.9 | Confident | 39 Ų | 39 | 118.3 Ų | 118.3 | 20% | 0.2 | 54% | 0.541 | C | S | . | . | H | α-helix | trans | -66.6 | -38.1 | -177.3 | -71.8 | 176.5 | 0 | 0 | 0 | 111.3 | A139 F141 R148 | A139-I144 HydrophobicContact CB-CG1 4.46Å; F141-I144 HydrophobicContact CD1-CD1 4.18Å; F141-I144 PolarHBondContact O-N 3.05Å; I144-R148 WeakPolarHBondContact O-CB 3.45Å; I144-R148 PolarHBondContact O-N 2.96Å |
| 145 | H | 77.4 | Confident | 76.2 | Confident | 132 Ų | 132 | 126.3 Ų | 126.3 | 61% | 0.611 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -69.7 | -40.9 | -178.7 | -67.4 | -72.4 | 0 | 0 | 0 | 112.7 | N143 R148 R149 | N143-H145 VanDerWaalsContact C-N 3.35Å; N143-H145 PolarHBondContact O-N 3.23Å; H145-R148 PolarHBondContact O-N 2.88Å; H145-R149 PolarHBondContact O-N 3.37Å |
| 146 | E | 79.7 | Confident | 76 | Confident | 141 Ų | 141 | 128.8 Ų | 128.8 | 66% | 0.659 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.4 | -43.1 | 174.9 | -67.1 | -166 | 169.5 | 0 | 0 | 111.5 | R149 K150 | E146-R149 PolarHBondContact O-N 3.17Å; E146-K150 WeakPolarHBondContact O-CB 3.48Å; E146-K150 PolarHBondContact O-N 2.8Å |
| 147 | L | 76.9 | Confident | 76 | Confident | 21 Ų | 21 | 133.8 Ų | 133.8 | 11% | 0.11 | 61% | 0.607 | C | S | . | * | H | α-helix | trans | -63.8 | -42.2 | 176 | -75.5 | 161.5 | 0 | 0 | 0 | 111.8 | L136 A139 N143 K150 Y151 | L136-L147 HydrophobicContact CD2-CB 3.53Å; L136-L147 HydrophobicContact CD2-CD1 4.1Å; L136-L147 HydrophobicContact CD2-CG 4.41Å; A139-L147 HydrophobicContact CB-CD1 3.72Å; N143-L147 WeakPolarHBondContact O-CD1 3.22Å; N143-L147 WeakPolarHBondContact O-CG 3.41Å; N143-L147 PolarHBondContact O-N 2.9Å; L147-K150 PolarHBondContact O-N 2.98Å; L147-Y151 HydrophobicContact CB-CD2 4.31Å; L147-Y151 HydrophobicContact CB-CE2 4.17Å; L147-Y151 HydrophobicContact CD2-CD2 4.43Å; L147-Y151 HydrophobicContact CD2-CE2 3.57Å; L147-Y151 HydrophobicContact CG-CE2 4.47Å; L147-Y151 WeakPolarHBondContact O-CD2 3.07Å; L147-Y151 PolarHBondContact O-N 3.03Å |
| 148 | R | 79.1 | Confident | 75.8 | Confident | 140 Ų | 140 | 130.4 Ų | 130.4 | 53% | 0.528 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -59 | -48.3 | 175.3 | -87.3 | -173.7 | 174.2 | -175.6 | -0 | 111.9 | I144 H145 K150 Y151 F152 | I144-R148 WeakPolarHBondContact O-CB 3.45Å; I144-R148 PolarHBondContact O-N 2.96Å; H145-R148 PolarHBondContact O-N 2.88Å; R148-K150 VanDerWaalsContact C-N 3.32Å; R148-K150 PolarHBondContact O-N 2.94Å; R148-Y151 PolarHBondContact O-N 2.8Å; R148-F152 HydrophobicContact CG-CD2 4.42Å; R148-F152 WeakPolarHBondContact O-CB 3.42Å; R148-F152 WeakPolarHBondContact O-CD2 3.36Å; R148-F152 PolarHBondContact O-N 3.24Å |
| 149 | R | 81.5 | Confident | 75.5 | Confident | 175 Ų | 175 | 126.9 Ų | 126.9 | 66% | 0.66 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -59 | -44.9 | 176.7 | -69.8 | -172.2 | -163.3 | -164.9 | 3.8 | 111.5 | H145 E146 Y151 K153 | H145-R149 PolarHBondContact O-N 3.37Å; E146-R149 PolarHBondContact O-N 3.17Å; R149-Y151 PolarHBondContact O-N 3.1Å; R149-K153 PolarHBondContact O-N 2.75Å; R149-K153 VanDerWaalsContact O-N 3.07Å |
| 150 | K | 80.8 | Confident | 75.6 | Confident | 161 Ų | 161 | 133.4 Ų | 133.4 | 70% | 0.7 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -63.1 | -38.4 | -178.6 | -173.3 | 177.2 | -178.8 | 177.3 | 0 | 113.9 | E146 L147 R148 | E146-K150 WeakPolarHBondContact O-CB 3.48Å; E146-K150 PolarHBondContact O-N 2.8Å; L147-K150 PolarHBondContact O-N 2.98Å; R148-K150 VanDerWaalsContact C-N 3.32Å; R148-K150 PolarHBondContact O-N 2.94Å |
| 151 | Y | 79 | Confident | 75.8 | Confident | 55 Ų | 55 | 130.1 Ų | 130.1 | 22% | 0.216 | 59% | 0.592 | C | S | . | * | H | α-helix | trans | -88.9 | -37.2 | -177.5 | -67 | -54.1 | 0 | 0 | 0 | 113.8 | M132 E135 L147 R148 R149 | M132-Y151 HydrophobicContact CB-CD2 4.5Å; M132-Y151 HydrophobicContact CB-CE1 4.3Å; M132-Y151 HydrophobicContact CB-CE2 4.26Å; M132-Y151 HydrophobicContact CG-CD1 3.92Å; M132-Y151 HydrophobicContact CG-CE1 3.51Å; M132-Y151 HydrophobicContact CG-CE2 4.32Å; M132-Y151 HydrophobicContact CG-CG 4.46Å; M132-Y151 HydrophobicContact SD-CD1 3.07Å; M132-Y151 WeakPolarHBondContact SD-CD1 3.44Å; M132-Y151 HydrophobicContact SD-CD2 4.49Å; M132-Y151 HydrophobicContact SD-CE1 3.22Å; M132-Y151 WeakPolarHBondContact SD-CE1 3.49Å; M132-Y151 HydrophobicContact SD-CG 3.77Å; E135-Y151 PolarHBondContact OE2-OH 2.97Å; L147-Y151 HydrophobicContact CB-CD2 4.31Å; L147-Y151 HydrophobicContact CB-CE2 4.17Å; L147-Y151 HydrophobicContact CD2-CD2 4.43Å; L147-Y151 HydrophobicContact CD2-CE2 3.57Å; L147-Y151 HydrophobicContact CG-CE2 4.47Å; L147-Y151 WeakPolarHBondContact O-CD2 3.07Å; L147-Y151 PolarHBondContact O-N 3.03Å; R148-Y151 PolarHBondContact O-N 2.8Å; R149-Y151 PolarHBondContact O-N 3.1Å |
| 152 | F | 80.3 | Confident | 76.4 | Confident | 118 Ų | 118 | 126.3 Ų | 126.3 | 52% | 0.518 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -96.5 | -3.2 | -174.2 | -67.8 | -80.9 | 0 | 0 | 0 | 114.2 | R148 L154 | R148-F152 HydrophobicContact CG-CD2 4.42Å; R148-F152 WeakPolarHBondContact O-CB 3.42Å; R148-F152 WeakPolarHBondContact O-CD2 3.36Å; R148-F152 PolarHBondContact O-N 3.24Å; F152-L154 HydrophobicContact CB-CD1 3.91Å; F152-L154 HydrophobicContact CB-CG 3.92Å; F152-L154 PolarHBondContact O-N 2.93Å |
| 153 | K | 77.3 | Confident | 77.3 | Confident | 186 Ų | 186 | 121.5 Ų | 121.5 | 81% | 0.809 | 55% | 0.554 | S | S | * | * | trans | 50.4 | 41.7 | -176.5 | -57.6 | 179.1 | 179 | 178.8 | 0 | 112.2 | R149 D155 | R149-K153 PolarHBondContact O-N 2.75Å; R149-K153 VanDerWaalsContact O-N 3.07Å; K153-D155 PolarHBondContact O-N 3.34Å | ||
| 154 | L | 69.9 | Low | 77.4 | Confident | 108 Ų | 108 | 125.5 Ų | 125.5 | 57% | 0.565 | 57% | 0.567 | S | S | * | * | trans | -82.4 | 102.2 | 173.5 | -68.3 | 165.3 | 0 | 0 | 0 | 107.2 | F152 | F152-L154 HydrophobicContact CB-CD1 3.91Å; F152-L154 HydrophobicContact CB-CG 3.92Å; F152-L154 PolarHBondContact O-N 2.93Å | ||
| 155 | D | 69.7 | Low | 77.4 | Confident | 230 Ų | 230 | 133.4 Ų | 133.4 | 100% | 1.23 | 60% | 0.601 | S | S | * | * | trans | -79.2 | 0 | 165.8 | -80.1 | -23.8 | 0 | 0 | 0 | 110.6 | K153 | K153-D155 PolarHBondContact O-N 3.34Š|
Retrieved 155 of 155 residues in 20.8 ms
(Link to these results)