| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 44 | Very low | 49 | Very low | 238 Ų | 238 | 163.7 Ų | 163.7 | 100% | 1.172 | 86% | 0.857 | S | S | * | * | 0 | 116.1 | 0 | -79.3 | 168.3 | 56.9 | 0 | 0 | 107.8 | |||||
| 2 | I | 45.6 | Very low | 48.5 | Very low | 169 Ų | 169 | 157.5 Ų | 157.5 | 87% | 0.867 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 127.4 | -172.8 | -60.7 | 162.2 | 0 | 0 | 0 | 109.3 | ||
| 3 | P | 55.7 | Low | 48.2 | Very low | 117 Ų | 117 | 152.8 Ų | 152.8 | 76% | 0.76 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 141.8 | 162.2 | -7.1 | 25.9 | 0 | 0 | 0 | 111 | ||
| 4 | K | 49.7 | Very low | 47.9 | Very low | 200 Ų | 200 | 153.7 Ų | 153.7 | 87% | 0.87 | 84% | 0.841 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 130.3 | -167.8 | -63.6 | -109.1 | -178 | 174.1 | 0 | 113.4 | ||
| 5 | E | 53.9 | Low | 47.6 | Very low | 184 Ų | 184 | 146.8 Ų | 146.8 | 86% | 0.86 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 125.7 | 162.8 | -66.6 | -141.5 | 146.8 | 0 | 0 | 110.7 | ||
| 6 | Q | 54.9 | Low | 47.3 | Very low | 197 Ų | 197 | 146.8 Ų | 146.8 | 92% | 0.921 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 117.1 | 164 | -66.3 | -178.1 | 27.9 | 0 | 0 | 107.8 | ||
| 7 | K | 52.6 | Low | 47.3 | Very low | 200 Ų | 200 | 149.8 Ų | 149.8 | 87% | 0.87 | 82% | 0.82 | S | S | * | * | trans | -112.9 | 117.3 | 171.4 | -152.5 | 171.1 | -174 | 176.8 | 0 | 107.7 | ||||
| 8 | G | 46.2 | Very low | 47.5 | Very low | 58 Ų | 58 | 148.2 Ų | 148.2 | 60% | 0.598 | 82% | 0.816 | S | S | * | * | trans | -63.8 | 171.9 | -171.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | V10 | G8-V10 PolarHBondContact O-N 3.15Š| ||
| 9 | P | 48.4 | Very low | 48.2 | Very low | 125 Ų | 125 | 148.8 Ų | 148.8 | 81% | 0.812 | 81% | 0.813 | S | S | * | * | trans | -69.1 | 123.1 | -176.1 | 27.7 | -31.8 | 0 | 0 | 0 | 110.7 | M11 | P9-M11 PolarHBondContact O-N 2.95Š| ||
| 10 | V | 43.7 | Very low | 48.8 | Very low | 141 Ų | 141 | 147.3 Ų | 147.3 | 86% | 0.855 | 81% | 0.81 | S | S | * | * | trans | -70.9 | 111.9 | 170.6 | 175 | 0 | 0 | 0 | 0 | 107.5 | G8 A12 | G8-V10 PolarHBondContact O-N 3.15Å; V10-A12 PolarHBondContact O-N 3.32Å; V10-A12 VanDerWaalsContact O-N 3.15Å | ||
| 11 | M | 44.6 | Very low | 49.6 | Very low | 172 Ų | 172 | 145.7 Ų | 145.7 | 85% | 0.847 | 81% | 0.805 | S | S | * | * | trans | -61.9 | 113.6 | 174.8 | -67.7 | -73.4 | -83 | 0 | 0 | 109.2 | P9 A13 | P9-M11 PolarHBondContact O-N 2.95Å; M11-A13 PolarHBondContact O-N 3.02Å | ||
| 12 | A | 42.3 | Very low | 50.6 | Low | 89 Ų | 89 | 139.7 Ų | 139.7 | 74% | 0.736 | 78% | 0.784 | S | S | * | * | trans | -69.1 | 95.5 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108.2 | V10 M14 | V10-A12 PolarHBondContact O-N 3.32Å; V10-A12 VanDerWaalsContact O-N 3.15Å; A12-M14 PolarHBondContact O-N 3.28Å | ||
| 13 | A | 44.8 | Very low | 51.7 | Low | 97 Ų | 97 | 137.9 Ų | 137.9 | 80% | 0.802 | 78% | 0.78 | S | S | * | * | trans | -67.8 | 91.1 | 162.1 | 0 | 0 | 0 | 0 | 0 | 107.3 | M11 G15 | M11-A13 PolarHBondContact O-N 3.02Å; A13-G15 VanDerWaalsContact C-N 3.26Å; A13-G15 PolarHBondContact O-N 2.98Å | ||
| 14 | M | 44.5 | Very low | 52.6 | Low | 165 Ų | 165 | 139 Ų | 139 | 81% | 0.813 | 78% | 0.779 | S | S | * | * | trans | -59 | 96 | 163.4 | -70.9 | -82.8 | -158.8 | 0 | 0 | 106.5 | A12 N16 | A12-M14 PolarHBondContact O-N 3.28Å; M14-N16 PolarHBondContact O-N 2.83Å | ||
| 15 | G | 43 | Very low | 53.6 | Low | 50 Ų | 50 | 136.6 Ų | 136.6 | 52% | 0.515 | 78% | 0.776 | S | S | . | * | trans | -58 | 111.9 | 166.4 | 0 | 0 | 0 | 0 | 0 | 107.1 | A13 F17 | A13-G15 VanDerWaalsContact C-N 3.26Å; A13-G15 PolarHBondContact O-N 2.98Å; G15-F17 WeakPolarHBondContact O-CD2 3.33Å; G15-F17 PolarHBondContact O-N 3.06Å | ||
| 16 | N | 42.8 | Very low | 54.6 | Low | 147 Ų | 147 | 134.3 Ų | 134.3 | 79% | 0.786 | 77% | 0.769 | S | S | * | * | trans | -65 | 91.1 | 165.7 | -66.4 | -41.9 | 0 | 0 | 0 | 106.4 | M14 T18 | M14-N16 PolarHBondContact O-N 2.83Å; N16-T18 PolarHBondContact O-N 2.96Å | ||
| 17 | F | 47.8 | Very low | 55.4 | Low | 197 Ų | 197 | 127 Ų | 127 | 86% | 0.864 | 75% | 0.746 | S | S | * | * | trans | -71.1 | 66.9 | 162.7 | -66.1 | -80.6 | 0 | 0 | 0 | 107.7 | G15 E19 | G15-F17 WeakPolarHBondContact O-CD2 3.33Å; G15-F17 PolarHBondContact O-N 3.06Å; F17-E19 PolarHBondContact O-N 2.87Å | ||
| 18 | T | 51 | Low | 56.5 | Low | 122 Ų | 122 | 127.4 Ų | 127.4 | 75% | 0.748 | 75% | 0.748 | S | S | * | * | trans | -72.5 | 87.3 | 157.6 | -56.4 | 0 | 0 | 0 | 0 | 104.6 | N16 | N16-T18 PolarHBondContact O-N 2.96Š| ||
| 19 | E | 59.9 | Low | 57.7 | Low | 160 Ų | 160 | 133.3 Ų | 133.3 | 75% | 0.748 | 76% | 0.757 | S | S | * | * | trans | -50.9 | 128.4 | 167.2 | -77.8 | -151.8 | 152.4 | 0 | 0 | 108.2 | F17 V21 | F17-E19 PolarHBondContact O-N 2.87Å; E19-V21 PolarHBondContact O-N 2.84Å | ||
| 20 | P | 61.1 | Low | 58.3 | Low | 118 Ų | 118 | 135.3 Ų | 135.3 | 77% | 0.766 | 76% | 0.76 | S | S | * | * | trans | -67.4 | 105.9 | 169.4 | 27 | -29 | 0 | 0 | 0 | 106.4 | P22 | P20-P22 WeakPolarHBondContact O-CD 3.5Å; P20-P22 VanDerWaalsContact O-N 3.08Å | ||
| 21 | V | 65.6 | Low | 59.3 | Low | 114 Ų | 114 | 132.8 Ų | 132.8 | 69% | 0.691 | 75% | 0.749 | S | S | * | * | trans | -45 | 122 | 168.8 | 176.2 | 0 | 0 | 0 | 0 | 106.9 | E19 T23 | E19-V21 PolarHBondContact O-N 2.84Å; V21-T23 VanDerWaalsContact C-N 3.28Å; V21-T23 PolarHBondContact O-N 3.01Å; V21-T23 PolarHBondContact O-OG1 2.72Å | ||
| 22 | P | 65.5 | Low | 60.3 | Low | 112 Ų | 112 | 130.6 Ų | 130.6 | 73% | 0.727 | 75% | 0.745 | S | S | * | * | trans | -62.3 | 97.7 | -179.2 | 22.7 | -30.8 | 0 | 0 | 0 | 107.6 | P20 L24 | P20-P22 WeakPolarHBondContact O-CD 3.5Å; P20-P22 VanDerWaalsContact O-N 3.08Å; P22-L24 VanDerWaalsContact C-N 3.32Å; P22-L24 PolarHBondContact O-N 3.2Å | ||
| 23 | T | 68.3 | Low | 61.3 | Low | 130 Ų | 130 | 131.8 Ų | 131.8 | 80% | 0.798 | 75% | 0.745 | S | S | * | * | trans | -79 | 93.5 | 178.2 | -58.8 | 0 | 0 | 0 | 0 | 105 | V21 D25 | V21-T23 VanDerWaalsContact C-N 3.28Å; V21-T23 PolarHBondContact O-N 3.01Å; V21-T23 PolarHBondContact O-OG1 2.72Å; T23-D25 PolarHBondContact O-N 2.98Å; T23-D25 VanDerWaalsContact O-N 3.08Å | ||
| 24 | L | 73.4 | Confident | 62.1 | Low | 140 Ų | 140 | 133.4 Ų | 133.4 | 73% | 0.733 | 74% | 0.736 | S | S | * | * | trans | -59.1 | 112 | 173.1 | -73.5 | 164.9 | 0 | 0 | 0 | 107.8 | P22 L26 | P22-L24 VanDerWaalsContact C-N 3.32Å; P22-L24 PolarHBondContact O-N 3.2Å; L24-L26 VanDerWaalsContact C-N 3.34Å; L24-L26 HydrophobicContact CB-CD2 4.23Å; L24-L26 PolarHBondContact O-N 3.08Å | ||
| 25 | D | 70.4 | Confident | 63.3 | Low | 150 Ų | 150 | 130.6 Ų | 130.6 | 80% | 0.802 | 72% | 0.724 | S | S | * | * | trans | -70.6 | 95.8 | 169.1 | -174.5 | 6.3 | 0 | 0 | 0 | 107.8 | T23 G27 | T23-D25 PolarHBondContact O-N 2.98Å; T23-D25 VanDerWaalsContact O-N 3.08Å; D25-G27 PolarHBondContact O-N 3.04Å; D25-G27 PolarHBondContact OD1-N 3.12Å | ||
| 26 | L | 76.1 | Confident | 64.3 | Low | 137 Ų | 137 | 133.9 Ų | 133.9 | 72% | 0.717 | 73% | 0.73 | S | S | * | * | trans | -72.5 | 11.1 | -179.9 | -63 | 176.5 | 0 | 0 | 0 | 112.8 | L24 | L24-L26 VanDerWaalsContact C-N 3.34Å; L24-L26 HydrophobicContact CB-CD2 4.23Å; L24-L26 PolarHBondContact O-N 3.08Å | ||
| 27 | G | 72.1 | Confident | 65.3 | Low | 43 Ų | 43 | 133.7 Ų | 133.7 | 44% | 0.443 | 73% | 0.726 | S | S | . | * | trans | 65.7 | 171.6 | -175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | D25 K29 | D25-G27 PolarHBondContact O-N 3.04Å; D25-G27 PolarHBondContact OD1-N 3.12Å; G27-K29 PolarHBondContact O-N 3.18Å; G27-K29 VanDerWaalsContact O-N 3.12Å | ||
| 28 | K | 74.8 | Confident | 66.4 | Low | 208 Ų | 208 | 129.8 Ų | 129.8 | 90% | 0.904 | 71% | 0.712 | S | S | * | * | trans | -66.8 | 115.5 | 172.9 | -65.1 | 179.3 | -177.3 | 177.3 | 0 | 107.9 | L30 | K28-L30 PolarHBondContact O-N 3.22Š| ||
| 29 | K | 72.4 | Confident | 67.6 | Low | 183 Ų | 183 | 128.5 Ų | 128.5 | 80% | 0.796 | 70% | 0.697 | S | S | * | * | trans | -57.5 | 111.8 | 168.4 | -63.5 | -162 | 179.4 | -164.9 | 0 | 107.4 | G27 S31 | G27-K29 PolarHBondContact O-N 3.18Å; G27-K29 VanDerWaalsContact O-N 3.12Å; K29-S31 PolarHBondContact O-N 3.41Å; K29-S31 VanDerWaalsContact O-N 3.15Å | ||
| 30 | L | 59.9 | Low | 68.4 | Low | 166 Ų | 166 | 125 Ų | 125 | 87% | 0.869 | 68% | 0.681 | S | S | * | * | trans | -54.2 | 123.5 | 169.2 | -64.5 | 175 | 0 | 0 | 0 | 106.2 | K28 | K28-L30 PolarHBondContact O-N 3.22Š| ||
| 31 | S | 64.3 | Low | 68.9 | Low | 89 Ų | 89 | 121.9 Ų | 121.9 | 62% | 0.622 | 66% | 0.657 | S | S | * | * | trans | -50 | 148.2 | 177.7 | 46.9 | 0 | 0 | 0 | 0 | 109.3 | K29 | K29-S31 PolarHBondContact O-N 3.41Å; K29-S31 VanDerWaalsContact O-N 3.15Å | ||
| 32 | V | 66.4 | Low | 69.4 | Low | 126 Ų | 126 | 120.2 Ų | 120.2 | 76% | 0.764 | 65% | 0.651 | S | S | * | * | S | Bend | trans | -26.4 | 126.6 | 175.6 | 178.9 | 0 | 0 | 0 | 0 | 109.7 | Q34 | V32-Q34 PolarHBondContact O-N 3.08Š|
| 33 | P | 63.6 | Low | 70.1 | Confident | 114 Ų | 114 | 118.8 Ų | 118.8 | 74% | 0.74 | 64% | 0.636 | S | S | * | * | trans | -43.8 | 107.3 | -173.1 | -25.3 | 30.8 | 0 | 0 | 0 | 108.2 | D35 | P33-D35 PolarHBondContact O-N 3.08Š| ||
| 34 | Q | 61.8 | Low | 70.3 | Confident | 130 Ų | 130 | 123 Ų | 123 | 61% | 0.607 | 64% | 0.638 | S | S | * | * | trans | -60.9 | 120.3 | -178.9 | -151.7 | 131.4 | 16.8 | 0 | 0 | 103.2 | V32 L36 | V32-Q34 PolarHBondContact O-N 3.08Å; Q34-L36 PolarHBondContact O-N 2.77Å | ||
| 35 | D | 68.8 | Low | 70.7 | Confident | 107 Ų | 107 | 123.7 Ų | 123.7 | 57% | 0.572 | 64% | 0.642 | S | S | * | * | trans | -59.3 | 91 | -179.3 | -83.4 | -31.3 | 0 | 0 | 0 | 106.9 | P33 M37 M38 E39 | P33-D35 PolarHBondContact O-N 3.08Å; D35-M37 PolarHBondContact O-N 2.97Å; D35-M38 HydrophobicContact CB-CB 4.21Å; D35-M38 HydrophobicContact CB-CG 4.07Å; D35-M38 PolarHBondContact O-N 2.84Å; D35-E39 PolarHBondContact O-N 3.31Å | ||
| 36 | L | 64.1 | Low | 71.5 | Confident | 119 Ų | 119 | 119.4 Ų | 119.4 | 62% | 0.623 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -55.2 | -31.4 | -174.8 | -69.9 | 171.2 | 0 | 0 | 0 | 108.9 | Q34 M38 E39 E40 | Q34-L36 PolarHBondContact O-N 2.77Å; L36-M38 PolarHBondContact O-N 3.06Å; L36-E39 PolarHBondContact O-N 3.48Å; L36-E40 VanDerWaalsContact O-CB 3.22Å; L36-E40 WeakPolarHBondContact O-CB 3.49Å; L36-E40 WeakPolarHBondContact O-CG 3.32Å; L36-E40 PolarHBondContact O-N 3.39Å |
| 37 | M | 65.1 | Low | 72.1 | Confident | 143 Ų | 143 | 122.6 Ų | 122.6 | 70% | 0.704 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -58.7 | -40.1 | 173.3 | -62.2 | -176.8 | -75.2 | 0 | 0 | 113.5 | D35 L41 | D35-M37 PolarHBondContact O-N 2.97Å; M37-L41 WeakPolarHBondContact O-CB 3.37Å; M37-L41 WeakPolarHBondContact O-CD1 3.24Å; M37-L41 WeakPolarHBondContact O-CG 3.38Å; M37-L41 PolarHBondContact O-N 3.1Å; M37-L41 VanDerWaalsContact O-N 3.16Å |
| 38 | M | 70.4 | Confident | 72.9 | Confident | 115 Ų | 115 | 122.1 Ų | 122.1 | 57% | 0.567 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -77.6 | -35.4 | 178.6 | -68.7 | -58.4 | -63.8 | 0 | 0 | 112.1 | D35 L36 L41 S42 | D35-M38 HydrophobicContact CB-CB 4.21Å; D35-M38 HydrophobicContact CB-CG 4.07Å; D35-M38 PolarHBondContact O-N 2.84Å; L36-M38 PolarHBondContact O-N 3.06Å; M38-L41 PolarHBondContact O-N 2.94Å; M38-L41 HydrophobicContact SD-CD1 4.29Å; M38-S42 PolarHBondContact O-N 2.89Å; M38-S42 VanDerWaalsContact O-N 3.09Å |
| 39 | E | 75.6 | Confident | 73.5 | Confident | 94 Ų | 94 | 112.2 Ų | 112.2 | 44% | 0.439 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -65.9 | -46 | 174 | -173.8 | 173.3 | 178.1 | 0 | 0 | 111.3 | D35 L36 L41 S42 L43 | D35-E39 PolarHBondContact O-N 3.31Å; L36-E39 PolarHBondContact O-N 3.48Å; E39-L41 VanDerWaalsContact C-N 3.26Å; E39-L41 PolarHBondContact O-N 2.76Å; E39-S42 WeakPolarHBondContact O-CA 3.45Å; E39-S42 WeakPolarHBondContact O-CB 3.46Å; E39-S42 PolarHBondContact O-N 2.7Å; E39-S42 PolarHBondContact O-OG 3.23Å; E39-L43 PolarHBondContact O-N 3.38Å |
| 40 | E | 76.3 | Confident | 74.4 | Confident | 87 Ų | 87 | 107 Ų | 107 | 41% | 0.407 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -60.7 | -34.5 | 174.4 | -73.3 | -62.9 | 147.1 | 0 | 0 | 112.5 | L36 S42 N46 | L36-E40 VanDerWaalsContact O-CB 3.22Å; L36-E40 WeakPolarHBondContact O-CB 3.49Å; L36-E40 WeakPolarHBondContact O-CG 3.32Å; L36-E40 PolarHBondContact O-N 3.39Å; E40-S42 VanDerWaalsContact C-N 3.29Å; E40-N46 PolarHBondContact OE2-ND2 3.47Å |
| 41 | L | 72.4 | Confident | 76 | Confident | 52 Ų | 52 | 103.6 Ų | 103.6 | 27% | 0.272 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -73.8 | -19.2 | 173.8 | -73.2 | 175.4 | 0 | 0 | 0 | 113.3 | M37 M38 E39 S49 F52 | M37-L41 WeakPolarHBondContact O-CB 3.37Å; M37-L41 WeakPolarHBondContact O-CD1 3.24Å; M37-L41 WeakPolarHBondContact O-CG 3.38Å; M37-L41 PolarHBondContact O-N 3.1Å; M37-L41 VanDerWaalsContact O-N 3.16Å; M38-L41 PolarHBondContact O-N 2.94Å; M38-L41 HydrophobicContact SD-CD1 4.29Å; E39-L41 VanDerWaalsContact C-N 3.26Å; E39-L41 PolarHBondContact O-N 2.76Å; L41-S49 WeakPolarHBondContact O-CB 3.39Å; L41-F52 HydrophobicContact CD1-CD2 4.44Å; L41-F52 HydrophobicContact CD1-CG 4.43Å; L41-F52 HydrophobicContact CD2-CB 3.65Å; L41-F52 HydrophobicContact CD2-CD1 4.37Å; L41-F52 HydrophobicContact CD2-CG 3.97Å |
| 42 | S | 75.4 | Confident | 77.3 | Confident | 80 Ų | 80 | 103.2 Ų | 103.2 | 56% | 0.559 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -82.4 | -25.4 | 176.2 | 82.4 | 0 | 0 | 0 | 0 | 112.6 | M38 E39 E40 R44 | M38-S42 PolarHBondContact O-N 2.89Å; M38-S42 VanDerWaalsContact O-N 3.09Å; E39-S42 WeakPolarHBondContact O-CA 3.45Å; E39-S42 WeakPolarHBondContact O-CB 3.46Å; E39-S42 PolarHBondContact O-N 2.7Å; E39-S42 PolarHBondContact O-OG 3.23Å; E40-S42 VanDerWaalsContact C-N 3.29Å; S42-R44 PolarHBondContact O-N 3.15Å |
| 43 | L | 81.3 | Confident | 78.4 | Confident | 81 Ų | 81 | 100.1 Ų | 100.1 | 42% | 0.424 | 50% | 0.501 | S | S | . | . | trans | -65.3 | 119.3 | 179.1 | -67.1 | 172.9 | 0 | 0 | 0 | 111.2 | E39 N45 N46 S49 | E39-L43 PolarHBondContact O-N 3.38Å; L43-N45 PolarHBondContact O-N 3.02Å; L43-N45 VanDerWaalsContact O-N 3.11Å; L43-N46 HydrophobicContact CB-CB 4.46Å; L43-S49 WeakPolarHBondContact O-CB 3.32Å; L43-S49 PolarHBondContact O-OG 3.37Å | ||
| 44 | R | 72.2 | Confident | 79.8 | Confident | 220 Ų | 220 | 100.7 Ų | 100.7 | 83% | 0.83 | 49% | 0.492 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.7 | -7.8 | -175.2 | -76.8 | 179.6 | 153.2 | -166.7 | -5.2 | 116 | S42 | S42-R44 PolarHBondContact O-N 3.15Š|
| 45 | N | 81.1 | Confident | 81.4 | Confident | 154 Ų | 154 | 102.6 Ų | 102.6 | 82% | 0.824 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -109.5 | -9.9 | -174.3 | -167.4 | 15.9 | 0 | 0 | 0 | 113.7 | L43 | L43-N45 PolarHBondContact O-N 3.02Å; L43-N45 VanDerWaalsContact O-N 3.11Å |
| 46 | N | 88.1 | Confident | 82.4 | Confident | 60 Ų | 60 | 101.4 Ų | 101.4 | 32% | 0.321 | 49% | 0.485 | S | S | . | . | trans | -77.2 | 139.7 | -179.8 | -170.6 | -42.3 | 0 | 0 | 0 | 110.8 | E40 L43 G48 S49 L50 | E40-N46 PolarHBondContact OE2-ND2 3.47Å; L43-N46 HydrophobicContact CB-CB 4.46Å; N46-G48 PolarHBondContact O-N 2.8Å; N46-G48 PolarHBondContact OD1-N 3.22Å; N46-S49 PolarHBondContact O-N 3.1Å; N46-S49 PolarHBondContact O-OG 3.3Å; N46-L50 WeakPolarHBondContact O-CG 3.2Å; N46-L50 PolarHBondContact O-N 3.14Å; N46-L50 VanDerWaalsContact O-N 3.15Å | ||
| 47 | R | 87.2 | Confident | 83.7 | Confident | 203 Ų | 203 | 103.3 Ų | 103.3 | 77% | 0.766 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -58.7 | -37.5 | 174.7 | -174.5 | 177.6 | 178.3 | -176.4 | -0 | 112 | L51 | R47-L51 HydrophobicContact CG-CD1 4.27Å; R47-L51 WeakPolarHBondContact O-CG 3.46Å; R47-L51 PolarHBondContact O-N 3.46Å |
| 48 | G | 88.9 | Confident | 85.1 | Confident | 33 Ų | 33 | 104.4 Ų | 104.4 | 34% | 0.34 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.7 | -46.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | N46 L50 L51 F52 | N46-G48 PolarHBondContact O-N 2.8Å; N46-G48 PolarHBondContact OD1-N 3.22Å; G48-L50 PolarHBondContact O-N 3.45Å; G48-L51 PolarHBondContact O-N 2.86Å; G48-F52 WeakPolarHBondContact O-CB 3.29Å; G48-F52 PolarHBondContact O-N 3.4Å |
| 49 | S | 88.9 | Confident | 86.2 | Confident | 1 Ų | 1 | 102.5 Ų | 102.5 | 1% | 0.007 | 47% | 0.474 | C | S | . | . | H | α-helix | trans | -64.9 | -39.2 | 177.5 | 64.5 | 0 | 0 | 0 | 0 | 112.3 | L41 L43 N46 F52 Q53 | L41-S49 WeakPolarHBondContact O-CB 3.39Å; L43-S49 WeakPolarHBondContact O-CB 3.32Å; L43-S49 PolarHBondContact O-OG 3.37Å; N46-S49 PolarHBondContact O-N 3.1Å; N46-S49 PolarHBondContact O-OG 3.3Å; S49-F52 PolarHBondContact O-N 3.18Å; S49-Q53 WeakPolarHBondContact O-CG 3.1Å; S49-Q53 PolarHBondContact O-N 2.87Å |
| 50 | L | 91.5 | Very high | 86.8 | Confident | 74 Ų | 74 | 103.1 Ų | 103.1 | 39% | 0.387 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64 | -42.3 | 175.2 | -69.4 | 173.4 | 0 | 0 | 0 | 112 | N46 G48 F52 Q53 K54 | N46-L50 WeakPolarHBondContact O-CG 3.2Å; N46-L50 PolarHBondContact O-N 3.14Å; N46-L50 VanDerWaalsContact O-N 3.15Å; G48-L50 PolarHBondContact O-N 3.45Å; L50-F52 VanDerWaalsContact C-N 3.35Å; L50-Q53 PolarHBondContact O-N 3.13Å; L50-K54 WeakPolarHBondContact O-CB 3.11Å; L50-K54 WeakPolarHBondContact O-CG 2.89Å; L50-K54 PolarHBondContact O-N 3.06Å |
| 51 | L | 93.5 | Very high | 87.2 | Confident | 94 Ų | 94 | 105 Ų | 105 | 49% | 0.492 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.9 | -40.1 | 175.7 | -75 | 173 | 0 | 0 | 0 | 111.7 | R47 G48 K54 R55 | R47-L51 HydrophobicContact CG-CD1 4.27Å; R47-L51 WeakPolarHBondContact O-CG 3.46Å; R47-L51 PolarHBondContact O-N 3.46Å; G48-L51 PolarHBondContact O-N 2.86Å; L51-K54 PolarHBondContact O-N 2.91Å; L51-R55 WeakPolarHBondContact O-CB 3.42Å; L51-R55 PolarHBondContact O-N 3.06Å |
| 52 | F | 91.3 | Very high | 87.5 | Confident | 80 Ų | 80 | 108.7 Ų | 108.7 | 35% | 0.351 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.2 | -47.9 | 174.7 | 176.5 | -106.1 | 0 | 0 | 0 | 111.9 | L41 G48 S49 L50 K54 R55 Q56 | L41-F52 HydrophobicContact CD1-CD2 4.44Å; L41-F52 HydrophobicContact CD1-CG 4.43Å; L41-F52 HydrophobicContact CD2-CB 3.65Å; L41-F52 HydrophobicContact CD2-CD1 4.37Å; L41-F52 HydrophobicContact CD2-CG 3.97Å; G48-F52 WeakPolarHBondContact O-CB 3.29Å; G48-F52 PolarHBondContact O-N 3.4Å; S49-F52 PolarHBondContact O-N 3.18Å; L50-F52 VanDerWaalsContact C-N 3.35Å; F52-K54 PolarHBondContact O-N 3.1Å; F52-R55 CarbonylContact O-C 3.57Å; F52-R55 WeakPolarHBondContact O-CA 3.4Å; F52-R55 WeakPolarHBondContact O-CB 3.33Å; F52-R55 PolarHBondContact O-N 3.18Å; F52-Q56 HydrophobicContact CD1-CG 4.39Å; F52-Q56 HydrophobicContact CE1-CG 4.05Å; F52-Q56 HydrophobicContact CE2-CG 4.36Å; F52-Q56 HydrophobicContact CZ-CG 4.04Å; F52-Q56 VanDerWaalsContact CZ-NE2 3.31Å; F52-Q56 WeakPolarHBondContact O-CG 3.31Å; F52-Q56 PolarHBondContact O-N 3.01Å |
| 53 | Q | 89.9 | Confident | 87.8 | Confident | 62 Ų | 62 | 108.6 Ų | 108.6 | 29% | 0.29 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.7 | -40.5 | 175.7 | -71.5 | 176.8 | 16.1 | 0 | 0 | 112.6 | S49 L50 R55 Q56 R57 | S49-Q53 WeakPolarHBondContact O-CG 3.1Å; S49-Q53 PolarHBondContact O-N 2.87Å; L50-Q53 PolarHBondContact O-N 3.13Å; Q53-R55 VanDerWaalsContact C-N 3.29Å; Q53-R55 PolarHBondContact O-N 2.74Å; Q53-Q56 PolarHBondContact O-N 2.62Å; Q53-R57 PolarHBondContact O-N 3.21Å |
| 54 | K | 93.2 | Very high | 87.2 | Confident | 125 Ų | 125 | 111.9 Ų | 111.9 | 54% | 0.543 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63 | -37 | 173.2 | -75.7 | 178.4 | 179.2 | -178.5 | 0 | 111.4 | L50 L51 F52 R58 | L50-K54 WeakPolarHBondContact O-CB 3.11Å; L50-K54 WeakPolarHBondContact O-CG 2.89Å; L50-K54 PolarHBondContact O-N 3.06Å; L51-K54 PolarHBondContact O-N 2.91Å; F52-K54 PolarHBondContact O-N 3.1Å; K54-R58 WeakPolarHBondContact O-CG 3.22Å; K54-R58 PolarHBondContact O-N 2.85Å |
| 55 | R | 93.8 | Very high | 86.9 | Confident | 171 Ų | 171 | 106.4 Ų | 106.4 | 65% | 0.645 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -65.2 | -46.1 | 173.9 | -167.1 | 177 | -166.8 | 169.6 | 2.9 | 111.2 | L51 F52 Q53 R57 R58 V59 | L51-R55 WeakPolarHBondContact O-CB 3.42Å; L51-R55 PolarHBondContact O-N 3.06Å; F52-R55 CarbonylContact O-C 3.57Å; F52-R55 WeakPolarHBondContact O-CA 3.4Å; F52-R55 WeakPolarHBondContact O-CB 3.33Å; F52-R55 PolarHBondContact O-N 3.18Å; Q53-R55 VanDerWaalsContact C-N 3.29Å; Q53-R55 PolarHBondContact O-N 2.74Å; R55-R57 VanDerWaalsContact C-N 3.35Å; R55-R57 PolarHBondContact O-N 3.04Å; R55-R58 PolarHBondContact O-N 3.47Å; R55-V59 WeakPolarHBondContact O-CG2 3.17Å; R55-V59 PolarHBondContact O-N 3.12Å |
| 56 | Q | 91.1 | Very high | 86.3 | Confident | 82 Ų | 82 | 102.4 Ų | 102.4 | 38% | 0.383 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -57.3 | -46.3 | 175.4 | -70.3 | -62.6 | -18.7 | 0 | 0 | 111.8 | F52 Q53 R58 V59 Q60 | F52-Q56 HydrophobicContact CD1-CG 4.39Å; F52-Q56 HydrophobicContact CE1-CG 4.05Å; F52-Q56 HydrophobicContact CE2-CG 4.36Å; F52-Q56 HydrophobicContact CZ-CG 4.04Å; F52-Q56 VanDerWaalsContact CZ-NE2 3.31Å; F52-Q56 WeakPolarHBondContact O-CG 3.31Å; F52-Q56 PolarHBondContact O-N 3.01Å; Q53-Q56 PolarHBondContact O-N 2.62Å; Q56-R58 PolarHBondContact O-N 3.04Å; Q56-V59 PolarHBondContact O-N 3.39Å; Q56-Q60 WeakPolarHBondContact O-CG 3.45Å; Q56-Q60 PolarHBondContact O-N 2.78Å |
| 57 | R | 91.4 | Very high | 85.4 | Confident | 158 Ų | 158 | 101.2 Ų | 101.2 | 60% | 0.596 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -61.3 | -41.7 | 175.9 | -75.4 | -170.5 | -105.7 | -154.2 | -5 | 113 | Q53 R55 K61 | Q53-R57 PolarHBondContact O-N 3.21Å; R55-R57 VanDerWaalsContact C-N 3.35Å; R55-R57 PolarHBondContact O-N 3.04Å; R57-K61 VanDerWaalsContact O-CB 3.32Å; R57-K61 WeakPolarHBondContact O-CB 3.46Å; R57-K61 PolarHBondContact O-N 2.98Å |
| 58 | R | 94.2 | Very high | 84.5 | Confident | 167 Ų | 167 | 94.2 Ų | 94.2 | 63% | 0.63 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -63.3 | -41.2 | 175 | -76.2 | -175.9 | -69.2 | 174.1 | -0.4 | 112 | K54 R55 Q56 F62 | K54-R58 WeakPolarHBondContact O-CG 3.22Å; K54-R58 PolarHBondContact O-N 2.85Å; R55-R58 PolarHBondContact O-N 3.47Å; Q56-R58 PolarHBondContact O-N 3.04Å; R58-F62 WeakPolarHBondContact O-CB 3.15Å; R58-F62 PolarHBondContact O-N 2.92Å |
| 59 | V | 92.9 | Very high | 83.3 | Confident | 74 Ų | 74 | 95.4 Ų | 95.4 | 45% | 0.448 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -64.1 | -50.4 | 176.8 | 169.4 | 0 | 0 | 0 | 0 | 110.6 | R55 Q56 K61 F62 T63 | R55-V59 WeakPolarHBondContact O-CG2 3.17Å; R55-V59 PolarHBondContact O-N 3.12Å; Q56-V59 PolarHBondContact O-N 3.39Å; V59-K61 VanDerWaalsContact C-N 3.33Å; V59-K61 PolarHBondContact O-N 3.4Å; V59-F62 PolarHBondContact O-N 2.85Å; V59-F62 VanDerWaalsContact O-N 3.17Å; V59-T63 PolarHBondContact O-N 3.34Å; V59-T63 PolarHBondContact O-OG1 3.48Å |
| 60 | Q | 88.4 | Confident | 82.3 | Confident | 108 Ų | 108 | 100.8 Ų | 100.8 | 51% | 0.505 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -57.4 | -46.9 | 177.6 | -73 | 177 | -16.3 | 0 | 0 | 111.4 | Q56 F62 T63 F64 | Q56-Q60 WeakPolarHBondContact O-CG 3.45Å; Q56-Q60 PolarHBondContact O-N 2.78Å; Q60-F62 PolarHBondContact O-N 2.94Å; Q60-T63 PolarHBondContact O-N 2.82Å; Q60-F64 HydrophobicContact CB-CE2 4.32Å; Q60-F64 WeakPolarHBondContact O-CD2 3.49Å; Q60-F64 PolarHBondContact O-N 2.78Å |
| 61 | K | 85.1 | Confident | 81.1 | Confident | 126 Ų | 126 | 105.7 Ų | 105.7 | 55% | 0.548 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -57.1 | -47.9 | 176 | -176.5 | 174.8 | 178.3 | 178 | 0 | 111.6 | R57 V59 T63 F64 E65 | R57-K61 VanDerWaalsContact O-CB 3.32Å; R57-K61 WeakPolarHBondContact O-CB 3.46Å; R57-K61 PolarHBondContact O-N 2.98Å; V59-K61 VanDerWaalsContact C-N 3.33Å; V59-K61 PolarHBondContact O-N 3.4Å; K61-T63 PolarHBondContact O-N 2.96Å; K61-F64 PolarHBondContact O-N 3.41Å; K61-E65 VanDerWaalsContact CE-CD 3.43Å; K61-E65 WeakPolarHBondContact CE-OE1 3.34Å; K61-E65 HydrophobicContact CG-CG 4.29Å; K61-E65 IonicContact NZ-OE1 3.66Å; K61-E65 WeakPolarHBondContact O-CB 3.21Å; K61-E65 WeakPolarHBondContact O-CG 3.13Å; K61-E65 PolarHBondContact O-N 3.16Å |
| 62 | F | 78.6 | Confident | 79.9 | Confident | 129 Ų | 129 | 104.2 Ų | 104.2 | 57% | 0.566 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.3 | -42.9 | 177.5 | -180 | -98.8 | 0 | 0 | 0 | 112.1 | R58 V59 Q60 F64 E65 L66 | R58-F62 WeakPolarHBondContact O-CB 3.15Å; R58-F62 PolarHBondContact O-N 2.92Å; V59-F62 PolarHBondContact O-N 2.85Å; V59-F62 VanDerWaalsContact O-N 3.17Å; Q60-F62 PolarHBondContact O-N 2.94Å; F62-F64 PolarHBondContact O-N 2.91Å; F62-E65 PolarHBondContact O-N 3.31Å; F62-L66 HydrophobicContact CE1-CD2 3.95Å; F62-L66 HydrophobicContact CZ-CD2 4.22Å; F62-L66 WeakPolarHBondContact O-CB 3.37Å; F62-L66 PolarHBondContact O-N 2.83Å |
| 63 | T | 80.8 | Confident | 78.5 | Confident | 79 Ų | 79 | 107.8 Ų | 107.8 | 49% | 0.485 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -61.8 | -43.4 | 178.6 | -56.4 | 0 | 0 | 0 | 0 | 111.9 | V59 Q60 K61 A67 | V59-T63 PolarHBondContact O-N 3.34Å; V59-T63 PolarHBondContact O-OG1 3.48Å; Q60-T63 PolarHBondContact O-N 2.82Å; K61-T63 PolarHBondContact O-N 2.96Å; T63-A67 WeakPolarHBondContact O-CB 3.49Å; T63-A67 PolarHBondContact O-N 3.36Å; T63-A67 VanDerWaalsContact O-N 3.16Å |
| 64 | F | 69.4 | Low | 77.1 | Confident | 150 Ų | 150 | 111.5 Ų | 111.5 | 66% | 0.658 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -73.2 | -41.4 | 178.9 | -68.2 | -62.4 | 0 | 0 | 0 | 112.9 | Q60 K61 F62 A67 A68 | Q60-F64 HydrophobicContact CB-CE2 4.32Å; Q60-F64 WeakPolarHBondContact O-CD2 3.49Å; Q60-F64 PolarHBondContact O-N 2.78Å; K61-F64 PolarHBondContact O-N 3.41Å; F62-F64 PolarHBondContact O-N 2.91Å; F64-A67 PolarHBondContact O-N 3Å; F64-A68 WeakPolarHBondContact O-CB 3.09Å; F64-A68 PolarHBondContact O-N 3.33Å |
| 65 | E | 66.4 | Low | 75.4 | Confident | 104 Ų | 104 | 108.8 Ų | 108.8 | 49% | 0.486 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -67.8 | -35.6 | 176.9 | -72.4 | -178.2 | 168.3 | 0 | 0 | 112 | K61 F62 A68 S69 | K61-E65 VanDerWaalsContact CE-CD 3.43Å; K61-E65 WeakPolarHBondContact CE-OE1 3.34Å; K61-E65 HydrophobicContact CG-CG 4.29Å; K61-E65 IonicContact NZ-OE1 3.66Å; K61-E65 WeakPolarHBondContact O-CB 3.21Å; K61-E65 WeakPolarHBondContact O-CG 3.13Å; K61-E65 PolarHBondContact O-N 3.16Å; F62-E65 PolarHBondContact O-N 3.31Å; E65-A68 PolarHBondContact O-N 3.24Å; E65-S69 WeakPolarHBondContact O-CB 3.32Å; E65-S69 PolarHBondContact O-N 3.39Å; E65-S69 PolarHBondContact O-OG 2.61Å |
| 66 | L | 68.4 | Low | 73.6 | Confident | 71 Ų | 71 | 103.4 Ų | 103.4 | 37% | 0.372 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -65.4 | -44 | 174.5 | -176.5 | 67.7 | 0 | 0 | 0 | 111.4 | F62 S69 Q70 | F62-L66 HydrophobicContact CE1-CD2 3.95Å; F62-L66 HydrophobicContact CZ-CD2 4.22Å; F62-L66 WeakPolarHBondContact O-CB 3.37Å; F62-L66 PolarHBondContact O-N 2.83Å; L66-S69 WeakPolarHBondContact CA-OG 3.44Å; L66-S69 PolarHBondContact O-OG 2.93Å; L66-Q70 WeakPolarHBondContact O-CB 3.44Å; L66-Q70 WeakPolarHBondContact O-CG 3.37Å; L66-Q70 PolarHBondContact O-N 3.09Å |
| 67 | A | 67.8 | Low | 71.8 | Confident | 35 Ų | 35 | 104.7 Ų | 104.7 | 29% | 0.289 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -67.4 | -40.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T63 F64 R71 | T63-A67 WeakPolarHBondContact O-CB 3.49Å; T63-A67 PolarHBondContact O-N 3.36Å; T63-A67 VanDerWaalsContact O-N 3.16Å; F64-A67 PolarHBondContact O-N 3Å; A67-R71 WeakPolarHBondContact O-CG 3.36Å; A67-R71 PolarHBondContact O-N 2.78Å; A67-R71 VanDerWaalsContact O-N 3.11Å |
| 68 | A | 69.8 | Low | 70 | Confident | 56 Ų | 56 | 101.6 Ų | 101.6 | 46% | 0.463 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -68.1 | -42.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | F64 E65 R71 A72 | F64-A68 WeakPolarHBondContact O-CB 3.09Å; F64-A68 PolarHBondContact O-N 3.33Å; E65-A68 PolarHBondContact O-N 3.24Å; A68-R71 PolarHBondContact O-N 3.02Å; A68-A72 WeakPolarHBondContact O-CB 3.35Å; A68-A72 PolarHBondContact O-N 3.05Å |
| 69 | S | 63.7 | Low | 67.9 | Low | 57 Ų | 57 | 103 Ų | 103 | 40% | 0.399 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.6 | -39.5 | 176.2 | 57.8 | 0 | 0 | 0 | 0 | 112.3 | E65 L66 R71 A72 M73 | E65-S69 WeakPolarHBondContact O-CB 3.32Å; E65-S69 PolarHBondContact O-N 3.39Å; E65-S69 PolarHBondContact O-OG 2.61Å; L66-S69 WeakPolarHBondContact CA-OG 3.44Å; L66-S69 PolarHBondContact O-OG 2.93Å; S69-R71 VanDerWaalsContact C-N 3.33Å; S69-R71 PolarHBondContact O-N 3.19Å; S69-A72 PolarHBondContact O-N 3.3Å; S69-M73 WeakPolarHBondContact O-CB 3.38Å; S69-M73 WeakPolarHBondContact O-CG 3.41Å; S69-M73 PolarHBondContact O-N 3.09Å |
| 70 | Q | 66.8 | Low | 65.4 | Low | 114 Ų | 114 | 111.2 Ų | 111.2 | 53% | 0.533 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -59.2 | -43.3 | 171 | -80.6 | -179.7 | 40.7 | 0 | 0 | 111.9 | L66 M73 L74 | L66-Q70 WeakPolarHBondContact O-CB 3.44Å; L66-Q70 WeakPolarHBondContact O-CG 3.37Å; L66-Q70 PolarHBondContact O-N 3.09Å; Q70-M73 PolarHBondContact O-N 3.06Å; Q70-L74 WeakPolarHBondContact O-CG 3.45Å; Q70-L74 PolarHBondContact O-N 2.99Å; Q70-L74 VanDerWaalsContact O-N 3.11Å |
| 71 | R | 67.1 | Low | 63.3 | Low | 178 Ų | 178 | 115.5 Ų | 115.5 | 67% | 0.672 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -65.1 | -39.7 | 174.9 | -72.2 | -179.7 | -175.1 | 114.8 | -2.8 | 112.6 | A67 A68 S69 M73 L74 A75 | A67-R71 WeakPolarHBondContact O-CG 3.36Å; A67-R71 PolarHBondContact O-N 2.78Å; A67-R71 VanDerWaalsContact O-N 3.11Å; A68-R71 PolarHBondContact O-N 3.02Å; S69-R71 VanDerWaalsContact C-N 3.33Å; S69-R71 PolarHBondContact O-N 3.19Å; R71-M73 VanDerWaalsContact C-N 3.35Å; R71-L74 PolarHBondContact O-N 3.07Å; R71-A75 WeakPolarHBondContact O-CB 3.46Å; R71-A75 PolarHBondContact O-N 3.44Å |
| 72 | A | 68.3 | Low | 60.7 | Low | 63 Ų | 63 | 115.9 Ų | 115.9 | 52% | 0.521 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -65.2 | -37.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | A68 S69 A75 G76 | A68-A72 WeakPolarHBondContact O-CB 3.35Å; A68-A72 PolarHBondContact O-N 3.05Å; S69-A72 PolarHBondContact O-N 3.3Å; A72-A75 PolarHBondContact O-N 3.23Å; A72-G76 PolarHBondContact O-N 3.06Å |
| 73 | M | 60.7 | Low | 58.5 | Low | 155 Ų | 155 | 116.1 Ų | 116.1 | 76% | 0.764 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -65.4 | -39.1 | 174.9 | -70.7 | -76.1 | -73.2 | 0 | 0 | 112 | S69 Q70 R71 | S69-M73 WeakPolarHBondContact O-CB 3.38Å; S69-M73 WeakPolarHBondContact O-CG 3.41Å; S69-M73 PolarHBondContact O-N 3.09Å; Q70-M73 PolarHBondContact O-N 3.06Å; R71-M73 VanDerWaalsContact C-N 3.35Å |
| 74 | L | 60.8 | Low | 56.1 | Low | 139 Ų | 139 | 115.4 Ų | 115.4 | 73% | 0.728 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -69.7 | -39.9 | 174.5 | -69.7 | 170.2 | 0 | 0 | 0 | 112.3 | Q70 R71 S77 | Q70-L74 WeakPolarHBondContact O-CG 3.45Å; Q70-L74 PolarHBondContact O-N 2.99Å; Q70-L74 VanDerWaalsContact O-N 3.11Å; R71-L74 PolarHBondContact O-N 3.07Å; L74-S77 PolarHBondContact O-N 2.73Å |
| 75 | A | 58.3 | Low | 54.2 | Low | 69 Ų | 69 | 115.3 Ų | 115.3 | 57% | 0.57 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -71.4 | -31.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | R71 A72 S77 A78 | R71-A75 WeakPolarHBondContact O-CB 3.46Å; R71-A75 PolarHBondContact O-N 3.44Å; A72-A75 PolarHBondContact O-N 3.23Å; A75-S77 PolarHBondContact O-N 2.93Å; A75-A78 PolarHBondContact O-N 3.32Å |
| 76 | G | 55.3 | Low | 52.6 | Low | 58 Ų | 58 | 114 Ų | 114 | 60% | 0.598 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | -15.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | A72 | A72-G76 PolarHBondContact O-N 3.06Š|
| 77 | S | 53.9 | Low | 51.1 | Low | 109 Ų | 109 | 119.2 Ų | 119.2 | 76% | 0.762 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.8 | -16.1 | 176.6 | -170.6 | 0 | 0 | 0 | 0 | 113.9 | L74 A75 | L74-S77 PolarHBondContact O-N 2.73Å; A75-S77 PolarHBondContact O-N 2.93Å |
| 78 | A | 53.3 | Low | 49.6 | Very low | 92 Ų | 92 | 123.5 Ų | 123.5 | 76% | 0.76 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -101.8 | -1.4 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.5 | A75 | A75-A78 PolarHBondContact O-N 3.32Š|
| 79 | K | 50.1 | Low | 47.6 | Very low | 198 Ų | 198 | 124.3 Ų | 124.3 | 86% | 0.861 | 73% | 0.727 | S | S | * | * | trans | -125.2 | 67.9 | -172.7 | -137.3 | 175.6 | -174.1 | 179.9 | 0 | 112.2 | ||||
| 80 | R | 41 | Very low | 46.1 | Very low | 246 Ų | 246 | 127.8 Ų | 127.8 | 93% | 0.928 | 75% | 0.746 | S | S | * | * | trans | -133.4 | 99.4 | 157.4 | -175.3 | 178.9 | -81.4 | 157.6 | -5.3 | 109.1 | ||||
| 81 | K | 42.9 | Very low | 44.5 | Very low | 198 Ų | 198 | 128.7 Ų | 128.7 | 86% | 0.861 | 76% | 0.759 | S | S | * | * | trans | 138.4 | 112.8 | 140 | -154.7 | 174.4 | -166.8 | -163.1 | 0 | 110.1 | ||||
| 82 | V | 32.2 | Very low | 42.7 | Very low | 133 Ų | 133 | 125 Ų | 125 | 81% | 0.806 | 77% | 0.767 | S | S | * | * | 176.5 | 128.3 | 128 | 155.1 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 83 | T | 32.2 | Very low | 41.3 | Very low | 134 Ų | 134 | 129.7 Ų | 129.7 | 82% | 0.822 | 78% | 0.783 | S | S | * | * | trans | -38.6 | 149.7 | 171.3 | 29.1 | 0 | 0 | 0 | 0 | 118 | ||||
| 84 | G | 30.4 | Very low | 40.1 | Very low | 65 Ų | 65 | 126 Ų | 126 | 67% | 0.67 | 78% | 0.777 | S | S | * | * | trans | 111.9 | 112 | 131.6 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 85 | T | 29.2 | Very low | 38.8 | Very low | 147 Ų | 147 | 127 Ų | 127 | 90% | 0.902 | 78% | 0.783 | S | S | * | * | 67.3 | 136.1 | 126.6 | -37.3 | 0 | 0 | 0 | 0 | 121.4 | |||||
| 86 | A | 32.4 | Very low | 37.6 | Very low | 78 Ų | 78 | 127.1 Ų | 127.1 | 65% | 0.645 | 79% | 0.791 | S | S | * | * | trans | 89.6 | 108 | 154.8 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 87 | E | 36.4 | Very low | 37.2 | Very low | 180 Ų | 180 | 130.5 Ų | 130.5 | 84% | 0.841 | 80% | 0.802 | S | S | * | * | 57 | 128.9 | 124.9 | 84 | -163.1 | 153.4 | 0 | 0 | 125.9 | |||||
| 88 | S | 36.1 | Very low | 36.4 | Very low | 125 Ų | 125 | 134.2 Ų | 134.2 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | trans | 32.1 | 132.5 | 132.6 | -152.4 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 89 | G | 29.6 | Very low | 36.1 | Very low | 73 Ų | 73 | 132.3 Ų | 132.3 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | trans | 169.3 | 84.8 | 161.6 | 0 | 0 | 0 | 0 | 0 | 118 | ||||
| 90 | T | 30.6 | Very low | 35.6 | Very low | 129 Ų | 129 | 130 Ų | 130 | 79% | 0.791 | 79% | 0.79 | S | S | * | * | trans | 8.4 | 125.7 | 142.8 | -57.6 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 91 | V | 33.3 | Very low | 35.8 | Very low | 133 Ų | 133 | 125.4 Ų | 125.4 | 81% | 0.806 | 78% | 0.783 | S | S | * | * | trans | 55 | 118.2 | 139.6 | -173.6 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 92 | A | 29.6 | Very low | 35.7 | Very low | 102 Ų | 102 | 125.6 Ų | 125.6 | 84% | 0.843 | 78% | 0.78 | S | S | * | * | trans | -153 | 117.7 | 132.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 93 | N | 38.3 | Very low | 36 | Very low | 161 Ų | 161 | 128.7 Ų | 128.7 | 86% | 0.861 | 78% | 0.777 | S | S | * | * | trans | -83.2 | 119.9 | 172.3 | -155.2 | 15 | 0 | 0 | 0 | 107.4 | ||||
| 94 | A | 36.2 | Very low | 36.8 | Very low | 78 Ų | 78 | 127.3 Ų | 127.3 | 65% | 0.645 | 77% | 0.773 | S | S | * | * | trans | -168.6 | 116.6 | 158.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 95 | N | 33.7 | Very low | 37.3 | Very low | 159 Ų | 159 | 129.4 Ų | 129.4 | 85% | 0.85 | 77% | 0.766 | S | S | * | * | trans | 81.5 | 91.1 | 152 | -49 | -26.4 | 0 | 0 | 0 | 118 | ||||
| 96 | G | 33.4 | Very low | 38.1 | Very low | 71 Ų | 71 | 129.2 Ų | 129.2 | 73% | 0.732 | 76% | 0.758 | S | S | * | * | trans | -71.2 | -178.8 | 149.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 97 | P | 46.8 | Very low | 38.6 | Very low | 129 Ų | 129 | 133.2 Ų | 133.2 | 84% | 0.838 | 76% | 0.763 | S | S | * | * | -91.2 | 140 | -111.5 | 33.2 | -33.8 | 0 | 0 | 0 | 112.4 | G99 | P97-G99 PolarHBondContact O-N 3.3Š| |||
| 98 | E | 37.6 | Very low | 38.7 | Very low | 187 Ų | 187 | 131.1 Ų | 131.1 | 87% | 0.874 | 76% | 0.756 | S | S | * | * | trans | -68.7 | 96.1 | 169 | -162.7 | 168 | -171.4 | 0 | 0 | 108.8 | Q100 | E98-Q100 PolarHBondContact O-N 3.37Å; E98-Q100 VanDerWaalsContact O-N 3.12Å | ||
| 99 | G | 45.8 | Very low | 38.6 | Very low | 53 Ų | 53 | 134.8 Ų | 134.8 | 55% | 0.546 | 76% | 0.757 | S | S | . | * | trans | -66 | 104.4 | 175 | 0 | 0 | 0 | 0 | 0 | 110.3 | P97 N101 | P97-G99 PolarHBondContact O-N 3.3Å; G99-N101 VanDerWaalsContact C-N 3.31Å; G99-N101 PolarHBondContact O-N 3.32Å; G99-N101 PolarHBondContact O-ND2 3.48Å; G99-N101 VanDerWaalsContact O-ND2 3.1Å | ||
| 100 | Q | 40.9 | Very low | 38.8 | Very low | 149 Ų | 149 | 141.5 Ų | 141.5 | 70% | 0.696 | 76% | 0.76 | S | S | * | * | trans | -74.4 | 94.3 | 165.7 | -68.2 | -168.3 | -3.3 | 0 | 0 | 108.9 | E98 Y102 | E98-Q100 PolarHBondContact O-N 3.37Å; E98-Q100 VanDerWaalsContact O-N 3.12Å; Q100-Y102 PolarHBondContact O-N 2.81Å; Q100-Y102 VanDerWaalsContact O-N 3.14Å | ||
| 101 | N | 43.4 | Very low | 38.9 | Very low | 149 Ų | 149 | 140.2 Ų | 140.2 | 80% | 0.797 | 76% | 0.762 | S | S | * | * | trans | -60.8 | 100.5 | 167.1 | -74.6 | -87.1 | 0 | 0 | 0 | 109.4 | G99 R103 | G99-N101 VanDerWaalsContact C-N 3.31Å; G99-N101 PolarHBondContact O-N 3.32Å; G99-N101 PolarHBondContact O-ND2 3.48Å; G99-N101 VanDerWaalsContact O-ND2 3.1Å; N101-R103 VanDerWaalsContact C-N 3.27Å; N101-R103 PolarHBondContact O-N 2.52Å; N101-R103 VanDerWaalsContact O-N 3.09Å | ||
| 102 | Y | 41.8 | Very low | 39 | Very low | 203 Ų | 203 | 137.3 Ų | 137.3 | 80% | 0.796 | 75% | 0.748 | S | S | * | * | trans | -78.9 | 85.6 | 159.5 | -68.1 | -77.8 | 0 | 0 | 0 | 108.3 | Q100 S104 | Q100-Y102 PolarHBondContact O-N 2.81Å; Q100-Y102 VanDerWaalsContact O-N 3.14Å; Y102-S104 PolarHBondContact O-N 3Å | ||
| 103 | R | 38.5 | Very low | 39.5 | Very low | 197 Ų | 197 | 138.6 Ų | 138.6 | 74% | 0.743 | 75% | 0.748 | S | S | * | * | trans | -78.2 | 100.7 | 166.9 | -168.4 | -161.7 | -169.5 | 176.3 | 8.4 | 108.1 | N101 E105 | N101-R103 VanDerWaalsContact C-N 3.27Å; N101-R103 PolarHBondContact O-N 2.52Å; N101-R103 VanDerWaalsContact O-N 3.09Å; R103-E105 HydrophobicContact CG-CG 4.16Å; R103-E105 IonicContact CZ-OE1 3Å; R103-E105 IonicContact NE-OE1 3.37Å; R103-E105 PolarHBondContact NE-OE1 3.49Å; R103-E105 IonicContact NH1-OE1 2.62Å; R103-E105 PolarHBondContact NH1-OE1 3.21Å; R103-E105 IonicContact NH2-OE1 3.73Å; R103-E105 PolarHBondContact O-N 3.11Å | ||
| 104 | S | 48 | Very low | 39.1 | Very low | 105 Ų | 105 | 134.7 Ų | 134.7 | 73% | 0.734 | 75% | 0.745 | S | S | * | * | trans | -80.4 | 97.8 | 163.4 | 49.5 | 0 | 0 | 0 | 0 | 108.3 | Y102 L106 | Y102-S104 PolarHBondContact O-N 3Å; S104-L106 PolarHBondContact O-N 3.35Å | ||
| 105 | E | 41.4 | Very low | 38.9 | Very low | 109 Ų | 109 | 135.7 Ų | 135.7 | 51% | 0.509 | 75% | 0.754 | S | S | . | * | trans | -68.1 | 94.1 | 168.2 | -70.2 | -159.5 | -171.9 | 0 | 0 | 109.9 | R103 H107 | R103-E105 HydrophobicContact CG-CG 4.16Å; R103-E105 IonicContact CZ-OE1 3Å; R103-E105 IonicContact NE-OE1 3.37Å; R103-E105 PolarHBondContact NE-OE1 3.49Å; R103-E105 IonicContact NH1-OE1 2.62Å; R103-E105 PolarHBondContact NH1-OE1 3.21Å; R103-E105 IonicContact NH2-OE1 3.73Å; R103-E105 PolarHBondContact O-N 3.11Å; E105-H107 PolarHBondContact O-N 2.92Å; E105-H107 IonicContact OE2-CE1 3.54Å | ||
| 106 | L | 46.3 | Very low | 38.8 | Very low | 143 Ų | 143 | 133.3 Ų | 133.3 | 75% | 0.749 | 75% | 0.75 | S | S | * | * | trans | -78.4 | 107.7 | 155.6 | -71.9 | 170.7 | 0 | 0 | 0 | 106.9 | S104 I108 | S104-L106 PolarHBondContact O-N 3.35Å; L106-I108 HydrophobicContact CB-CD1 4.39Å; L106-I108 HydrophobicContact CB-CG1 4.2Å; L106-I108 PolarHBondContact O-N 2.72Å | ||
| 107 | H | 42.3 | Very low | 38.8 | Very low | 163 Ų | 163 | 137.9 Ų | 137.9 | 76% | 0.755 | 76% | 0.756 | S | S | * | * | trans | -62.2 | 86.4 | 164.2 | -79.3 | 80.9 | 0 | 0 | 0 | 108.5 | E105 | E105-H107 PolarHBondContact O-N 2.92Å; E105-H107 IonicContact OE2-CE1 3.54Å | ||
| 108 | I | 39.1 | Very low | 38.1 | Very low | 135 Ų | 135 | 135.9 Ų | 135.9 | 69% | 0.692 | 76% | 0.759 | S | S | * | * | trans | -99.7 | 109.6 | 164.3 | -59.9 | 174.1 | 0 | 0 | 0 | 104.7 | L106 R110 | L106-I108 HydrophobicContact CB-CD1 4.39Å; L106-I108 HydrophobicContact CB-CG1 4.2Å; L106-I108 PolarHBondContact O-N 2.72Å; I108-R110 PolarHBondContact O-N 3.17Å | ||
| 109 | F | 33.9 | Very low | 37.8 | Very low | 202 Ų | 202 | 130.7 Ų | 130.7 | 89% | 0.886 | 76% | 0.755 | S | S | * | * | trans | -53.4 | 108.4 | 166 | -78.3 | -84.7 | 0 | 0 | 0 | 108.2 | A111 | F109-A111 PolarHBondContact O-N 2.97Š| ||
| 110 | R | 34 | Very low | 37.9 | Very low | 214 Ų | 214 | 134 Ų | 134 | 81% | 0.808 | 77% | 0.767 | S | S | * | * | trans | -78.8 | 96.8 | 173.1 | -179.2 | 162.8 | -173 | 148.6 | -1.6 | 108.3 | I108 S112 | I108-R110 PolarHBondContact O-N 3.17Å; R110-S112 PolarHBondContact NE-OG 3.21Å; R110-S112 PolarHBondContact NH2-OG 2.9Å; R110-S112 PolarHBondContact O-N 3.09Å | ||
| 111 | A | 33.7 | Very low | 37.8 | Very low | 103 Ų | 103 | 136.5 Ų | 136.5 | 85% | 0.851 | 78% | 0.779 | S | S | * | * | trans | -87.2 | 92.1 | 155.8 | 0 | 0 | 0 | 0 | 0 | 107.5 | F109 | F109-A111 PolarHBondContact O-N 2.97Š| ||
| 112 | S | 34.1 | Very low | 37.3 | Very low | 71 Ų | 71 | 133 Ų | 133 | 50% | 0.497 | 78% | 0.779 | S | S | . | * | trans | -101.9 | 150.5 | 159.9 | -74.6 | 0 | 0 | 0 | 0 | 109.4 | R110 | R110-S112 PolarHBondContact NE-OG 3.21Å; R110-S112 PolarHBondContact NH2-OG 2.9Å; R110-S112 PolarHBondContact O-N 3.09Å | ||
| 113 | P | 40.9 | Very low | 37.1 | Very low | 130 Ų | 130 | 128 Ų | 128 | 84% | 0.844 | 78% | 0.779 | S | S | * | * | trans | -96.2 | 140.4 | -154 | 6.3 | 14.8 | 0 | 0 | 0 | 112.5 | ||||
| 114 | G | 30.1 | Very low | 37.3 | Very low | 78 Ų | 78 | 127.4 Ų | 127.4 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | 113.8 | 98.9 | 150.6 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 115 | A | 30.3 | Very low | 36.7 | Very low | 100 Ų | 100 | 128.5 Ų | 128.5 | 83% | 0.826 | 79% | 0.792 | S | S | * | * | 171.8 | 113.5 | 119.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 116 | S | 32 | Very low | 36.3 | Very low | 109 Ų | 109 | 127.9 Ų | 127.9 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | trans | 58.2 | 116.5 | 142.7 | -149.3 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 117 | L | 35 | Very low | 35.8 | Very low | 167 Ų | 167 | 125.8 Ų | 125.8 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | 169.6 | 114.3 | 92.5 | -154.4 | 76.1 | 0 | 0 | 0 | 112.8 | |||||
| 118 | G | 30.1 | Very low | 35.8 | Very low | 87 Ų | 87 | 122.7 Ų | 122.7 | 90% | 0.897 | 81% | 0.811 | S | S | * | * | trans | 68.7 | 129.8 | 153.1 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 119 | G | 32 | Very low | 35.9 | Very low | 77 Ų | 77 | 122.2 Ų | 122.2 | 79% | 0.794 | 82% | 0.817 | S | S | * | * | cis | 166.6 | -173.8 | 6.4 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 120 | P | 48.5 | Very low | 36.5 | Very low | 122 Ų | 122 | 117.3 Ų | 117.3 | 79% | 0.792 | 81% | 0.814 | S | S | * | * | cis | -119.8 | 163.5 | -19.3 | 39 | -23 | 0 | 0 | 0 | 115 | ||||
| 121 | E | 38.1 | Very low | 37.2 | Very low | 202 Ų | 202 | 110.5 Ų | 110.5 | 94% | 0.944 | 81% | 0.81 | S | S | * | * | trans | 44.9 | 125.5 | 149.5 | -63.3 | -160 | 142 | 0 | 0 | 124.3 | ||||
| 122 | G | 33.1 | Very low | 37.7 | Very low | 77 Ų | 77 | 111.4 Ų | 111.4 | 79% | 0.794 | 81% | 0.809 | S | S | * | * | trans | 174.8 | 73.9 | 162.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 123 | A | 38.7 | Very low | 38.6 | Very low | 96 Ų | 96 | 113.1 Ų | 113.1 | 79% | 0.793 | 82% | 0.816 | S | S | * | * | trans | -69.7 | 131.3 | -173 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 124 | H | 41.5 | Very low | 39.2 | Very low | 185 Ų | 185 | 112.9 Ų | 112.9 | 86% | 0.856 | 81% | 0.814 | S | S | * | * | -171.3 | 116.1 | 125.5 | 41.2 | -85.9 | 0 | 0 | 0 | 111.6 | |||||
| 125 | S | 36.5 | Very low | 40.4 | Very low | 128 Ų | 128 | 111.9 Ų | 111.9 | 90% | 0.895 | 80% | 0.795 | S | S | * | * | trans | -79.8 | 139.3 | 168.8 | -66.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 126 | A | 32.5 | Very low | 42 | Very low | 97 Ų | 97 | 112.2 Ų | 112.2 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | -170.1 | 107.8 | 140.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 127 | A | 35.1 | Very low | 43.2 | Very low | 98 Ų | 98 | 111.6 Ų | 111.6 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | trans | 42.1 | 115.2 | 145.6 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 128 | A | 43.2 | Very low | 44.4 | Very low | 98 Ų | 98 | 107.5 Ų | 107.5 | 81% | 0.81 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 145.2 | 151.8 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 129 | P | 41.3 | Very low | 45.9 | Very low | 125 Ų | 125 | 108.6 Ų | 108.6 | 81% | 0.812 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -94.9 | 141.4 | 148.7 | 32 | -22 | 0 | 0 | 0 | 110.2 | ||
| 130 | A | 45.7 | Very low | 47.1 | Very low | 99 Ų | 99 | 107.9 Ų | 107.9 | 82% | 0.818 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 152.3 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | C132 | A130-C132 PolarHBondContact O-N 3.18Š|
| 131 | G | 48.7 | Very low | 47.7 | Very low | 71 Ų | 71 | 108.8 Ų | 108.8 | 73% | 0.732 | 75% | 0.752 | S | S | * | * | trans | 32.3 | 88.3 | 146.7 | 0 | 0 | 0 | 0 | 0 | 117.2 | V133 | G131-V133 VanDerWaalsContact C-N 3.25Å; G131-V133 PolarHBondContact O-N 3.43Å | ||
| 132 | C | 44.7 | Very low | 48.8 | Very low | 123 Ų | 123 | 102.8 Ų | 102.8 | 83% | 0.831 | 74% | 0.744 | S | S | * | * | trans | -71.8 | 90.1 | 159.5 | -166.4 | 0 | 0 | 0 | 0 | 108.1 | A130 P134 | A130-C132 PolarHBondContact O-N 3.18Å; C132-P134 WeakPolarHBondContact O-CD 3.36Å | ||
| 133 | V | 53.8 | Low | 50.1 | Low | 107 Ų | 107 | 108 Ų | 108 | 65% | 0.648 | 74% | 0.741 | S | S | * | * | trans | -63 | 122.8 | 162.3 | 178.6 | 0 | 0 | 0 | 0 | 106.2 | G131 S135 | G131-V133 VanDerWaalsContact C-N 3.25Å; G131-V133 PolarHBondContact O-N 3.43Å; V133-S135 VanDerWaalsContact C-N 3.3Å; V133-S135 PolarHBondContact O-N 3.47Å; V133-S135 PolarHBondContact O-OG 2.88Å | ||
| 134 | P | 52.9 | Low | 51.2 | Low | 124 Ų | 124 | 106.3 Ų | 106.3 | 81% | 0.805 | 73% | 0.727 | S | S | * | * | trans | -65.4 | 95.7 | 177.1 | 25.1 | -30.6 | 0 | 0 | 0 | 108.1 | C132 | C132-P134 WeakPolarHBondContact O-CD 3.36Š| ||
| 135 | S | 55.8 | Low | 52.6 | Low | 58 Ų | 58 | 103.9 Ų | 103.9 | 41% | 0.406 | 72% | 0.716 | S | S | . | * | trans | -93.5 | 131.7 | 177.1 | 32.9 | 0 | 0 | 0 | 0 | 107.5 | V133 S137 A138 | V133-S135 VanDerWaalsContact C-N 3.3Å; V133-S135 PolarHBondContact O-N 3.47Å; V133-S135 PolarHBondContact O-OG 2.88Å; S135-S137 PolarHBondContact O-N 3.41Å; S135-A138 WeakPolarHBondContact O-CB 3.47Å; S135-A138 PolarHBondContact O-N 3.05Å | ||
| 136 | P | 62 | Low | 54.3 | Low | 107 Ų | 107 | 103.2 Ų | 103.2 | 70% | 0.695 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -62.7 | -12.1 | -175.4 | 25.7 | -34.5 | 0 | 0 | 0 | 113.2 | A138 | P136-A138 VanDerWaalsContact C-N 3.29Å; P136-A138 PolarHBondContact O-N 3.04Å |
| 137 | S | 57.7 | Low | 56.1 | Low | 95 Ų | 95 | 105.5 Ų | 105.5 | 66% | 0.664 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -77.2 | -7.8 | 175.2 | -32.7 | 0 | 0 | 0 | 0 | 114.2 | S135 L139 | S135-S137 PolarHBondContact O-N 3.41Å; S137-L139 VanDerWaalsContact C-N 3.33Å |
| 138 | A | 60.9 | Low | 57.7 | Low | 81 Ų | 81 | 109.3 Ų | 109.3 | 67% | 0.669 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -87.7 | 2.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | S135 P136 | S135-A138 WeakPolarHBondContact O-CB 3.47Å; S135-A138 PolarHBondContact O-N 3.05Å; P136-A138 VanDerWaalsContact C-N 3.29Å; P136-A138 PolarHBondContact O-N 3.04Å |
| 139 | L | 61.3 | Low | 59 | Low | 111 Ų | 111 | 108 Ų | 108 | 58% | 0.581 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -70.2 | 149 | 167.2 | -62.8 | 175.6 | 0 | 0 | 0 | 109.1 | S137 | S137-L139 VanDerWaalsContact C-N 3.33Š|
| 140 | A | 57.1 | Low | 60.5 | Low | 61 Ų | 61 | 106.7 Ų | 106.7 | 50% | 0.504 | 69% | 0.691 | S | S | . | * | trans | -42.9 | 139.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G142 Y143 | A140-G142 PolarHBondContact O-N 3.4Å; A140-Y143 HydrophobicContact CB-CD2 4.23Å; A140-Y143 PolarHBondContact O-N 2.95Å; A140-Y143 VanDerWaalsContact O-N 3.1Å | ||
| 141 | P | 60.2 | Low | 62 | Low | 142 Ų | 142 | 106.9 Ų | 106.9 | 92% | 0.922 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49.2 | 112 | -179.4 | -25.8 | 33 | 0 | 0 | 0 | 110.6 | ||
| 142 | G | 61.3 | Low | 63.2 | Low | 76 Ų | 76 | 109.1 Ų | 109.1 | 78% | 0.784 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 123.6 | -12.3 | -176.5 | 0 | 0 | 0 | 0 | 0 | 116.4 | A140 | A140-G142 PolarHBondContact O-N 3.4Š|
| 143 | Y | 60.2 | Low | 64.7 | Low | 186 Ų | 186 | 111.3 Ų | 111.3 | 73% | 0.729 | 68% | 0.684 | S | S | * | * | S | Bend | trans | -107.8 | 2.8 | -179.6 | -72.4 | -87 | 0 | 0 | 0 | 114.9 | A140 | A140-Y143 HydrophobicContact CB-CD2 4.23Å; A140-Y143 PolarHBondContact O-N 2.95Å; A140-Y143 VanDerWaalsContact O-N 3.1Å |
| 144 | A | 62.1 | Low | 65.4 | Low | 60 Ų | 60 | 115.4 Ų | 115.4 | 50% | 0.496 | 69% | 0.693 | S | S | . | * | S | Bend | trans | -84.6 | -12.8 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 145 | E | 72 | Confident | 66 | Low | 134 Ų | 134 | 116.4 Ų | 116.4 | 63% | 0.626 | 69% | 0.685 | S | S | * | * | S | Bend | trans | -110.9 | 126.9 | -179.8 | -74.7 | -158.5 | 124.6 | 0 | 0 | 111.8 | L147 K148 | E145-L147 PolarHBondContact O-N 3.05Å; E145-K148 IonicContact OE1-NZ 2.92Å; E145-K148 PolarHBondContact OE1-NZ 2.78Å |
| 146 | P | 72.1 | Confident | 66.5 | Low | 115 Ų | 115 | 119.3 Ų | 119.3 | 75% | 0.747 | 70% | 0.696 | S | S | * | * | trans | -53.4 | 138.3 | 164.7 | -23.2 | 33.2 | 0 | 0 | 0 | 110.1 | K148 | P146-K148 PolarHBondContact O-N 3.15Š| ||
| 147 | L | 69.5 | Low | 66.3 | Low | 144 Ų | 144 | 122.6 Ų | 122.6 | 75% | 0.754 | 70% | 0.701 | S | S | * | * | trans | -56.1 | 92.1 | -178.3 | -65.4 | 171.6 | 0 | 0 | 0 | 111 | E145 G149 V150 | E145-L147 PolarHBondContact O-N 3.05Å; L147-G149 PolarHBondContact O-N 3.46Å; L147-V150 HydrophobicContact CB-CB 4.46Å; L147-V150 HydrophobicContact CB-CG2 4.09Å; L147-V150 HydrophobicContact CD1-CG2 4.16Å; L147-V150 PolarHBondContact O-N 3.01Å | ||
| 148 | K | 70.1 | Confident | 66.2 | Low | 178 Ų | 178 | 124 Ų | 124 | 77% | 0.774 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.6 | -11.5 | -177.3 | -100.4 | 165.2 | -179 | 162 | 0 | 114.5 | E145 P146 | E145-K148 IonicContact OE1-NZ 2.92Å; E145-K148 PolarHBondContact OE1-NZ 2.78Å; P146-K148 PolarHBondContact O-N 3.15Å |
| 149 | G | 68.9 | Low | 65.9 | Low | 72 Ų | 72 | 123.2 Ų | 123.2 | 74% | 0.742 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.7 | -4.9 | -175 | 0 | 0 | 0 | 0 | 0 | 115.6 | L147 P151 | L147-G149 PolarHBondContact O-N 3.46Å; G149-P151 WeakPolarHBondContact O-CD 3.45Å |
| 150 | V | 73.1 | Confident | 65.9 | Low | 97 Ų | 97 | 124.3 Ų | 124.3 | 59% | 0.588 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -95.5 | 112.6 | 177.9 | -178.4 | 0 | 0 | 0 | 0 | 108 | L147 | L147-V150 HydrophobicContact CB-CB 4.46Å; L147-V150 HydrophobicContact CB-CG2 4.09Å; L147-V150 HydrophobicContact CD1-CG2 4.16Å; L147-V150 PolarHBondContact O-N 3.01Å |
| 151 | P | 78.3 | Confident | 66.1 | Low | 102 Ų | 102 | 126.5 Ų | 126.5 | 66% | 0.662 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 137.4 | 174.9 | 25.1 | -31.9 | 0 | 0 | 0 | 108.6 | G149 E153 | G149-P151 WeakPolarHBondContact O-CD 3.45Å; P151-E153 PolarHBondContact O-N 2.87Å |
| 152 | P | 73.4 | Confident | 66.4 | Low | 119 Ų | 119 | 129.6 Ų | 129.6 | 77% | 0.773 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 128.2 | 177.8 | 23.2 | -32.4 | 0 | 0 | 0 | 108.8 | K154 | P152-K154 PolarHBondContact O-N 3.17Š|
| 153 | E | 75.5 | Confident | 66.9 | Low | 168 Ų | 168 | 128.8 Ų | 128.8 | 79% | 0.785 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 116.9 | 176.1 | -174.2 | 179.2 | 165.7 | 0 | 0 | 108.4 | P151 F155 | P151-E153 PolarHBondContact O-N 2.87Å; E153-F155 PolarHBondContact O-N 3.38Å |
| 154 | K | 69.7 | Low | 67.5 | Low | 194 Ų | 194 | 129 Ų | 129 | 84% | 0.843 | 71% | 0.706 | S | S | * | * | trans | -75.7 | 78.1 | 174.4 | -65.2 | -175.4 | -177.8 | -179.7 | 0 | 107.4 | P152 N156 | P152-K154 PolarHBondContact O-N 3.17Å; K154-N156 PolarHBondContact O-N 2.86Å; K154-N156 VanDerWaalsContact O-N 3.1Å | ||
| 155 | F | 64.1 | Low | 67.7 | Low | 145 Ų | 145 | 134.6 Ų | 134.6 | 64% | 0.636 | 71% | 0.714 | S | S | * | * | trans | -56.8 | 118.9 | 169.1 | -157.9 | -95.9 | 0 | 0 | 0 | 107.1 | E153 H157 | E153-F155 PolarHBondContact O-N 3.38Å; F155-H157 PolarHBondContact O-N 3.34Å | ||
| 156 | N | 66 | Low | 67.8 | Low | 119 Ų | 119 | 130.1 Ų | 130.1 | 64% | 0.636 | 70% | 0.697 | S | S | * | * | trans | -61.4 | 106 | -179.2 | -68.6 | -57.5 | 0 | 0 | 0 | 108.6 | K154 T158 A159 | K154-N156 PolarHBondContact O-N 2.86Å; K154-N156 VanDerWaalsContact O-N 3.1Å; N156-T158 PolarHBondContact O-N 2.95Å; N156-A159 PolarHBondContact O-N 2.84Å | ||
| 157 | H | 58.4 | Low | 68 | Low | 175 Ų | 175 | 128.4 Ų | 128.4 | 81% | 0.81 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61 | -1.9 | 174.2 | -76.3 | -72.8 | 0 | 0 | 0 | 113.6 | F155 | F155-H157 PolarHBondContact O-N 3.34Š|
| 158 | T | 56 | Low | 67.9 | Low | 124 Ų | 124 | 129.4 Ų | 129.4 | 76% | 0.761 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.5 | -6.5 | 174.6 | 53.3 | 0 | 0 | 0 | 0 | 113.7 | N156 I160 | N156-T158 PolarHBondContact O-N 2.95Å; T158-I160 PolarHBondContact O-N 2.9Å |
| 159 | A | 54.8 | Low | 67.9 | Low | 66 Ų | 66 | 126.7 Ų | 126.7 | 55% | 0.545 | 67% | 0.67 | S | S | . | * | trans | -77.3 | 57.6 | 159 | 0 | 0 | 0 | 0 | 0 | 109.1 | N156 P161 | N156-A159 PolarHBondContact O-N 2.84Å; A159-P161 VanDerWaalsContact C-N 3.32Å; A159-P161 WeakPolarHBondContact O-CD 3.37Å | ||
| 160 | I | 60.7 | Low | 67.8 | Low | 133 Ų | 133 | 129.8 Ų | 129.8 | 68% | 0.682 | 67% | 0.665 | S | S | * | * | trans | -72.1 | 99.5 | 152.9 | -59.7 | 172.8 | 0 | 0 | 0 | 102.3 | T158 K162 | T158-I160 PolarHBondContact O-N 2.9Å; I160-K162 PolarHBondContact O-N 3.29Å | ||
| 161 | P | 61.6 | Low | 67.2 | Low | 107 Ų | 107 | 132.4 Ų | 132.4 | 70% | 0.695 | 67% | 0.669 | S | S | * | * | trans | -53.1 | 123.5 | 166.6 | 24.4 | -32 | 0 | 0 | 0 | 104.2 | A159 G163 | A159-P161 VanDerWaalsContact C-N 3.32Å; A159-P161 WeakPolarHBondContact O-CD 3.37Å; P161-G163 WeakPolarHBondContact O-CA 3.45Å; P161-G163 PolarHBondContact O-N 2.83Å | ||
| 162 | K | 66.8 | Low | 66.3 | Low | 207 Ų | 207 | 131.2 Ų | 131.2 | 90% | 0.9 | 66% | 0.659 | S | S | * | * | trans | -39.3 | 111.8 | 174.1 | -70.2 | -170.5 | 177.4 | -176.2 | 0 | 105.8 | I160 Y164 | I160-K162 PolarHBondContact O-N 3.29Å; K162-Y164 PolarHBondContact O-N 3.3Å | ||
| 163 | G | 71.5 | Confident | 65.6 | Low | 59 Ų | 59 | 127.7 Ų | 127.7 | 61% | 0.608 | 64% | 0.638 | S | S | * | * | trans | -50.2 | 139.2 | -166.2 | 0 | 0 | 0 | 0 | 0 | 108.6 | P161 R165 | P161-G163 WeakPolarHBondContact O-CA 3.45Å; P161-G163 PolarHBondContact O-N 2.83Å; G163-R165 PolarHBondContact O-N 3Å | ||
| 164 | Y | 73.9 | Confident | 64.6 | Low | 192 Ų | 192 | 128.6 Ų | 128.6 | 75% | 0.753 | 64% | 0.635 | S | S | * | * | trans | -42.7 | 110.2 | -178.9 | 168.9 | -99 | 0 | 0 | 0 | 109.8 | K162 C166 P167 | K162-Y164 PolarHBondContact O-N 3.3Å; Y164-C166 HydrophobicContact CE1-CB 4.46Å; Y164-C166 PolarHBondContact O-N 3.42Å; Y164-P167 WeakPolarHBondContact OH-CD 3.36Å | ||
| 165 | R | 66 | Low | 63.9 | Low | 176 Ų | 176 | 128.2 Ų | 128.2 | 66% | 0.664 | 63% | 0.628 | S | S | * | * | trans | -86.3 | 110.3 | 178.2 | -163.7 | 179.6 | 177 | -145.8 | -13.8 | 106.4 | G163 P167 E170 | G163-R165 PolarHBondContact O-N 3Å; R165-P167 VanDerWaalsContact O-CD 3.29Å; R165-P167 WeakPolarHBondContact O-CD 3.33Å; R165-E170 IonicContact CZ-OE1 2.82Å; R165-E170 IonicContact NH1-OE1 3.78Å; R165-E170 IonicContact NH2-OE1 3.6Å; R165-E170 PolarHBondContact NH2-OE1 2.95Å | ||
| 166 | C | 73.1 | Confident | 63.5 | Low | 41 Ų | 41 | 126.9 Ų | 126.9 | 28% | 0.277 | 63% | 0.628 | S | S | . | * | trans | -50.2 | 117.5 | 175.2 | 165.4 | 0 | 0 | 0 | 0 | 110 | Y164 W168 Q169 | Y164-C166 HydrophobicContact CE1-CB 4.46Å; Y164-C166 PolarHBondContact O-N 3.42Å; C166-W168 PolarHBondContact O-N 2.92Å; C166-W168 VanDerWaalsContact O-N 3.12Å; C166-W168 PolarHBondContact SG-N 3.44Å; C166-W168 VanDerWaalsContact SG-N 3.39Å; C166-Q169 HydrophobicContact CB-CB 4.22Å; C166-Q169 WeakPolarHBondContact O-CB 3.35Å; C166-Q169 PolarHBondContact O-N 3.03Å; C166-Q169 PolarHBondContact SG-N 3.31Å | ||
| 167 | P | 76 | Confident | 63 | Low | 79 Ų | 79 | 129.9 Ų | 129.9 | 51% | 0.513 | 63% | 0.631 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -62.5 | -19.1 | 177.3 | -23.1 | 33.7 | 0 | 0 | 0 | 113.1 | Y164 R165 | Y164-P167 WeakPolarHBondContact OH-CD 3.36Å; R165-P167 VanDerWaalsContact O-CD 3.29Å; R165-P167 WeakPolarHBondContact O-CD 3.33Å |
| 168 | W | 67.3 | Low | 62.7 | Low | 164 Ų | 164 | 127.5 Ų | 127.5 | 62% | 0.621 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.2 | -4.9 | 179 | -50.9 | 103.2 | 0 | 0 | 0 | 113.2 | C166 E170 F171 V172 | C166-W168 PolarHBondContact O-N 2.92Å; C166-W168 VanDerWaalsContact O-N 3.12Å; C166-W168 PolarHBondContact SG-N 3.44Å; C166-W168 VanDerWaalsContact SG-N 3.39Å; W168-E170 PolarHBondContact O-N 3.07Å; W168-F171 HydrophobicContact CE3-CB 4.48Å; W168-F171 HydrophobicContact CE3-CD2 4.12Å; W168-F171 HydrophobicContact CE3-CG 4.4Å; W168-F171 PolarHBondContact O-N 3.4Å; W168-V172 PolarHBondContact O-N 3.04Å |
| 169 | Q | 70.3 | Confident | 62.6 | Low | 121 Ų | 121 | 125.9 Ų | 125.9 | 57% | 0.565 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57 | -33.4 | 179.4 | -171 | 84.4 | 38.6 | 0 | 0 | 111.8 | C166 | C166-Q169 HydrophobicContact CB-CB 4.22Å; C166-Q169 WeakPolarHBondContact O-CB 3.35Å; C166-Q169 PolarHBondContact O-N 3.03Å; C166-Q169 PolarHBondContact SG-N 3.31Å |
| 170 | E | 67.1 | Low | 62.4 | Low | 138 Ų | 138 | 130.1 Ų | 130.1 | 65% | 0.645 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.7 | -20.1 | -179.7 | -64.6 | 175.3 | -175.9 | 0 | 0 | 112.5 | R165 W168 | R165-E170 IonicContact CZ-OE1 2.82Å; R165-E170 IonicContact NH1-OE1 3.78Å; R165-E170 IonicContact NH2-OE1 3.6Å; R165-E170 PolarHBondContact NH2-OE1 2.95Å; W168-E170 PolarHBondContact O-N 3.07Å |
| 171 | F | 61.8 | Low | 61.9 | Low | 152 Ų | 152 | 128.2 Ų | 128.2 | 67% | 0.667 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.2 | -22.4 | 179.2 | -71.4 | -83.5 | 0 | 0 | 0 | 113.3 | W168 S173 | W168-F171 HydrophobicContact CE3-CB 4.48Å; W168-F171 HydrophobicContact CE3-CD2 4.12Å; W168-F171 HydrophobicContact CE3-CG 4.4Å; W168-F171 PolarHBondContact O-N 3.4Å; F171-S173 VanDerWaalsContact C-N 3.31Å; F171-S173 PolarHBondContact O-N 3.28Å; F171-S173 VanDerWaalsContact O-N 3.17Å |
| 172 | V | 58.7 | Low | 61.5 | Low | 77 Ų | 77 | 131.8 Ų | 131.8 | 47% | 0.467 | 64% | 0.641 | S | S | . | * | S | Bend | trans | -86.9 | 78.2 | 171.3 | -172 | 0 | 0 | 0 | 0 | 107.7 | W168 Y174 Y177 | W168-V172 PolarHBondContact O-N 3.04Å; V172-Y174 PolarHBondContact O-N 3.24Å; V172-Y177 HydrophobicContact CG1-CE2 4.28Å |
| 173 | S | 58.1 | Low | 60.8 | Low | 45 Ų | 45 | 127.4 Ų | 127.4 | 32% | 0.315 | 64% | 0.636 | S | S | . | * | trans | -69 | 120.9 | 172.8 | 96.6 | 0 | 0 | 0 | 0 | 107.9 | F171 R175 D176 | F171-S173 VanDerWaalsContact C-N 3.31Å; F171-S173 PolarHBondContact O-N 3.28Å; F171-S173 VanDerWaalsContact O-N 3.17Å; S173-R175 PolarHBondContact O-N 2.87Å; S173-D176 PolarHBondContact O-N 2.73Å; S173-D176 VanDerWaalsContact O-N 3.07Å; S173-D176 PolarHBondContact OG-OD2 3.08Å | ||
| 174 | Y | 55.2 | Low | 60.1 | Low | 186 Ų | 186 | 131 Ų | 131 | 73% | 0.729 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -59.3 | -11.8 | 174.7 | -99.1 | -93.7 | 0 | 0 | 0 | 112.8 | V172 D176 Y177 | V172-Y174 PolarHBondContact O-N 3.24Å; Y174-D176 VanDerWaalsContact C-N 3.32Å; Y174-Y177 PolarHBondContact O-N 3.27Å |
| 175 | R | 55 | Low | 59.4 | Low | 186 Ų | 186 | 127.7 Ų | 127.7 | 70% | 0.702 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -72.3 | -24.7 | 177.2 | -55.5 | -62.9 | -83 | -167.1 | -13.8 | 112.4 | S173 Y177 Q178 | S173-R175 PolarHBondContact O-N 2.87Å; R175-Y177 PolarHBondContact O-N 2.84Å; R175-Q178 WeakPolarHBondContact O-CB 3.09Å; R175-Q178 PolarHBondContact O-N 3.01Å |
| 176 | D | 55.1 | Low | 59 | Low | 117 Ų | 117 | 122.4 Ų | 122.4 | 63% | 0.626 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -69.8 | -18.9 | 175.8 | -60 | -44.7 | 0 | 0 | 0 | 112.4 | S173 Y174 | S173-D176 PolarHBondContact O-N 2.73Å; S173-D176 VanDerWaalsContact O-N 3.07Å; S173-D176 PolarHBondContact OG-OD2 3.08Å; Y174-D176 VanDerWaalsContact C-N 3.32Å |
| 177 | Y | 54.8 | Low | 58.3 | Low | 182 Ų | 182 | 122.8 Ų | 122.8 | 71% | 0.714 | 63% | 0.628 | S | S | * | * | G | 310 helix | trans | -91.9 | -3.5 | 171.8 | -65 | -74.6 | 0 | 0 | 0 | 113.6 | V172 Y174 R175 | V172-Y177 HydrophobicContact CG1-CE2 4.28Å; Y174-Y177 PolarHBondContact O-N 3.27Å; R175-Y177 PolarHBondContact O-N 2.84Å |
| 178 | Q | 53.4 | Low | 57.5 | Low | 125 Ų | 125 | 124.5 Ų | 124.5 | 58% | 0.584 | 64% | 0.639 | S | S | * | * | trans | -97.4 | 16.1 | -177.5 | -123.6 | 151.5 | 46.9 | 0 | 0 | 112.4 | R175 D180 | R175-Q178 WeakPolarHBondContact O-CB 3.09Å; R175-Q178 PolarHBondContact O-N 3.01Å; Q178-D180 PolarHBondContact O-N 2.94Å | ||
| 179 | S | 53.3 | Low | 57.1 | Low | 90 Ų | 90 | 122.8 Ų | 122.8 | 63% | 0.629 | 64% | 0.642 | S | S | * | * | S | Bend | trans | -70.2 | 119.8 | 170.6 | 80.6 | 0 | 0 | 0 | 0 | 109.6 | G181 | S179-G181 PolarHBondContact O-N 3.44Š|
| 180 | D | 50.3 | Low | 56.9 | Low | 156 Ų | 156 | 121.9 Ų | 121.9 | 83% | 0.834 | 64% | 0.641 | S | S | * | * | trans | -27.5 | 111.7 | 173.7 | -78.9 | -43 | 0 | 0 | 0 | 114.1 | Q178 R182 | Q178-D180 PolarHBondContact O-N 2.94Å; D180-R182 PolarHBondContact O-N 3.11Å | ||
| 181 | G | 51.5 | Low | 56.7 | Low | 93 Ų | 93 | 122.3 Ų | 122.3 | 96% | 0.959 | 64% | 0.638 | S | S | * | * | S | Bend | trans | 48.2 | 0.2 | 139.3 | 0 | 0 | 0 | 0 | 0 | 121.4 | S179 | S179-G181 PolarHBondContact O-N 3.44Š|
| 182 | R | 52.2 | Low | 56.7 | Low | 181 Ų | 181 | 126 Ų | 126 | 68% | 0.683 | 65% | 0.648 | S | S | * | * | trans | -116.8 | 88.3 | -177.3 | -157.1 | 168.8 | -147 | -106 | 3.3 | 106.5 | D180 H184 | D180-R182 PolarHBondContact O-N 3.11Å; R182-H184 PolarHBondContact NH1-CE1 3.5Å; R182-H184 PolarHBondContact O-CD2 3.11Å; R182-H184 PolarHBondContact O-N 2.93Å | ||
| 183 | S | 52.7 | Low | 57 | Low | 115 Ų | 115 | 126 Ų | 126 | 80% | 0.804 | 65% | 0.645 | S | S | * | * | trans | -55.9 | 88.2 | 162.7 | -78.1 | 0 | 0 | 0 | 0 | 108.3 | T185 | S183-T185 PolarHBondContact O-N 3.39Š| ||
| 184 | H | 56.4 | Low | 57.4 | Low | 136 Ų | 136 | 133.9 Ų | 133.9 | 63% | 0.63 | 67% | 0.674 | S | S | * | * | trans | -70.4 | 85.8 | 157.6 | -71.2 | -82.4 | 0 | 0 | 0 | 104.9 | R182 P186 | R182-H184 PolarHBondContact NH1-CE1 3.5Å; R182-H184 PolarHBondContact O-CD2 3.11Å; R182-H184 PolarHBondContact O-N 2.93Å; H184-P186 WeakPolarHBondContact O-CD 3.32Å; H184-P186 VanDerWaalsContact O-N 3.13Å | ||
| 185 | T | 58.6 | Low | 57.8 | Low | 121 Ų | 121 | 132.1 Ų | 132.1 | 74% | 0.742 | 68% | 0.678 | S | S | * | * | trans | -63 | 109.4 | 160.4 | 37.8 | 0 | 0 | 0 | 0 | 105.5 | S183 S187 | S183-T185 PolarHBondContact O-N 3.39Å; T185-S187 PolarHBondContact O-N 2.92Å; T185-S187 VanDerWaalsContact O-N 3.13Å | ||
| 186 | P | 57.7 | Low | 58.4 | Low | 66 Ų | 66 | 129 Ų | 129 | 43% | 0.429 | 67% | 0.669 | S | S | . | * | trans | -59.9 | 126 | 176.1 | 24.8 | -31.6 | 0 | 0 | 0 | 106.7 | H184 D190 Y191 | H184-P186 WeakPolarHBondContact O-CD 3.32Å; H184-P186 VanDerWaalsContact O-N 3.13Å; P186-D190 HydrophobicContact CB-CB 4.1Å; P186-Y191 HydrophobicContact CB-CE2 4.24Å; P186-Y191 HydrophobicContact CG-CE2 4.01Å | ||
| 187 | S | 58.9 | Low | 58.7 | Low | 48 Ų | 48 | 129.2 Ų | 129.2 | 34% | 0.336 | 68% | 0.675 | S | S | . | * | trans | -61.6 | 152.6 | 177.7 | 74 | 0 | 0 | 0 | 0 | 108 | T185 N189 D190 | T185-S187 PolarHBondContact O-N 2.92Å; T185-S187 VanDerWaalsContact O-N 3.13Å; S187-N189 PolarHBondContact O-N 3.41Å; S187-D190 WeakPolarHBondContact CB-OD2 3.36Å; S187-D190 PolarHBondContact N-OD2 2.82Å; S187-D190 WeakPolarHBondContact O-CB 3.49Å; S187-D190 PolarHBondContact O-N 3.16Å; S187-D190 VanDerWaalsContact OG-CG 3.27Å; S187-D190 PolarHBondContact OG-OD2 3.5Å | ||
| 188 | P | 59.3 | Low | 58.9 | Low | 115 Ų | 115 | 126.3 Ų | 126.3 | 75% | 0.747 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.3 | -18.5 | 175.4 | -28.8 | 36.2 | 0 | 0 | 0 | 114.4 | ||
| 189 | N | 57.9 | Low | 59.3 | Low | 128 Ų | 128 | 124.7 Ų | 124.7 | 68% | 0.684 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.2 | -20.6 | 175.6 | -75.1 | -15.8 | 0 | 0 | 0 | 114.3 | S187 Y191 | S187-N189 PolarHBondContact O-N 3.41Å; N189-Y191 VanDerWaalsContact C-N 3.33Å |
| 190 | D | 66.3 | Low | 59.8 | Low | 102 Ų | 102 | 125.5 Ų | 125.5 | 55% | 0.545 | 68% | 0.68 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83 | -14.5 | -178.2 | -57.4 | -41.8 | 0 | 0 | 0 | 112.2 | P186 S187 R192 | P186-D190 HydrophobicContact CB-CB 4.1Å; S187-D190 WeakPolarHBondContact CB-OD2 3.36Å; S187-D190 PolarHBondContact N-OD2 2.82Å; S187-D190 WeakPolarHBondContact O-CB 3.49Å; S187-D190 PolarHBondContact O-N 3.16Å; S187-D190 VanDerWaalsContact OG-CG 3.27Å; S187-D190 PolarHBondContact OG-OD2 3.5Å; D190-R192 PolarHBondContact O-N 2.85Å |
| 191 | Y | 62.6 | Low | 60.2 | Low | 147 Ų | 147 | 127.2 Ų | 127.2 | 58% | 0.576 | 68% | 0.68 | S | S | * | * | trans | -72.5 | 115.1 | 175 | -71 | -89.7 | 0 | 0 | 0 | 111 | P186 N189 N193 | P186-Y191 HydrophobicContact CB-CE2 4.24Å; P186-Y191 HydrophobicContact CG-CE2 4.01Å; N189-Y191 VanDerWaalsContact C-N 3.33Å; Y191-N193 PolarHBondContact O-N 2.9Å; Y191-N193 VanDerWaalsContact O-N 3.09Å | ||
| 192 | R | 63.3 | Low | 60.7 | Low | 229 Ų | 229 | 125.3 Ų | 125.3 | 86% | 0.864 | 66% | 0.66 | S | S | * | * | trans | -71.4 | 99 | 165.7 | -66.2 | -70.7 | 150.5 | 177.5 | -2 | 108 | D190 | D190-R192 PolarHBondContact O-N 2.85Š| ||
| 193 | N | 64.7 | Low | 61.2 | Low | 79 Ų | 79 | 118.5 Ų | 118.5 | 42% | 0.422 | 65% | 0.647 | S | S | . | * | trans | -88.5 | 147.6 | 169 | 92.3 | -6.5 | 0 | 0 | 0 | 109.6 | Y191 N195 K196 | Y191-N193 PolarHBondContact O-N 2.9Å; Y191-N193 VanDerWaalsContact O-N 3.09Å; N193-N195 PolarHBondContact O-N 3.46Å; N193-N195 PolarHBondContact OD1-N 3.37Å; N193-K196 WeakPolarHBondContact OD1-CA 3Å; N193-K196 WeakPolarHBondContact OD1-CB 3.32Å; N193-K196 WeakPolarHBondContact OD1-CG 3.41Å; N193-K196 PolarHBondContact OD1-N 3.02Å | ||
| 194 | F | 65.3 | Low | 61.4 | Low | 209 Ų | 209 | 119.3 Ų | 119.3 | 92% | 0.917 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.2 | -1.8 | 174.9 | -70.1 | -86 | 0 | 0 | 0 | 113 | ||
| 195 | N | 64.9 | Low | 61.2 | Low | 150 Ų | 150 | 120.1 Ų | 120.1 | 80% | 0.802 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.8 | 1.6 | -179.5 | -64.8 | -27.1 | 0 | 0 | 0 | 113.1 | N193 | N193-N195 PolarHBondContact O-N 3.46Å; N193-N195 PolarHBondContact OD1-N 3.37Å |
| 196 | K | 66.9 | Low | 61 | Low | 121 Ų | 121 | 121.3 Ų | 121.3 | 53% | 0.526 | 66% | 0.664 | S | S | . | * | S | Bend | trans | -82.7 | 123.5 | 170.4 | -88.5 | 170.4 | 176.2 | -167.9 | 0 | 106.4 | N193 | N193-K196 WeakPolarHBondContact OD1-CA 3Å; N193-K196 WeakPolarHBondContact OD1-CB 3.32Å; N193-K196 WeakPolarHBondContact OD1-CG 3.41Å; N193-K196 PolarHBondContact OD1-N 3.02Å |
| 197 | T | 61.7 | Low | 60.7 | Low | 121 Ų | 121 | 121.9 Ų | 121.9 | 74% | 0.742 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 123.6 | 168 | 35.9 | 0 | 0 | 0 | 0 | 108 | V199 | T197-V199 PolarHBondContact O-N 3.46Å; T197-V199 VanDerWaalsContact O-N 3.07Å |
| 198 | P | 58.8 | Low | 60 | Low | 120 Ų | 120 | 121.6 Ų | 121.6 | 78% | 0.779 | 69% | 0.687 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 119.7 | 174.9 | 23.6 | -30.7 | 0 | 0 | 0 | 107 | P200 | P198-P200 WeakPolarHBondContact O-CD 3.06Š|
| 199 | V | 61.2 | Low | 59.4 | Low | 91 Ų | 91 | 122.9 Ų | 122.9 | 55% | 0.552 | 69% | 0.693 | S | S | * | * | trans | -85.2 | 106.8 | 173.2 | -176.3 | 0 | 0 | 0 | 0 | 106.1 | T197 F201 | T197-V199 PolarHBondContact O-N 3.46Å; T197-V199 VanDerWaalsContact O-N 3.07Å; V199-F201 PolarHBondContact O-N 3.22Å; V199-F201 VanDerWaalsContact O-N 3.09Å | ||
| 200 | P | 64.6 | Low | 58.6 | Low | 108 Ų | 108 | 126.2 Ų | 126.2 | 70% | 0.701 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.1 | -15.3 | -169.7 | 24.4 | -32.9 | 0 | 0 | 0 | 114.1 | P198 | P198-P200 WeakPolarHBondContact O-CD 3.06Š|
| 201 | F | 59.4 | Low | 57.6 | Low | 192 Ų | 192 | 126.8 Ų | 126.8 | 84% | 0.842 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129.1 | 22.6 | -174.8 | -61.3 | -70.2 | 0 | 0 | 0 | 114.9 | V199 | V199-F201 PolarHBondContact O-N 3.22Å; V199-F201 VanDerWaalsContact O-N 3.09Å |
| 202 | G | 61.9 | Low | 57 | Low | 52 Ų | 52 | 130.5 Ų | 130.5 | 54% | 0.536 | 72% | 0.724 | S | S | . | * | trans | 68.1 | 131 | -175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 203 | G | 61.5 | Low | 56.1 | Low | 39 Ų | 39 | 126 Ų | 126 | 40% | 0.402 | 72% | 0.724 | S | S | . | * | trans | -63.3 | 173 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L205 | G203-L205 PolarHBondContact O-N 3.43Š| ||
| 204 | P | 57 | Low | 55.4 | Low | 131 Ų | 131 | 125.8 Ų | 125.8 | 85% | 0.851 | 74% | 0.741 | S | S | * | * | trans | -56.7 | 112.7 | 179.3 | -17.2 | 28.8 | 0 | 0 | 0 | 109.9 | V206 | P204-V206 VanDerWaalsContact C-N 3.29Å; P204-V206 PolarHBondContact O-N 2.94Å | ||
| 205 | L | 52.1 | Low | 54.7 | Low | 154 Ų | 154 | 121.5 Ų | 121.5 | 81% | 0.806 | 73% | 0.732 | S | S | * | * | trans | -68.9 | 87.5 | 175.3 | -77.9 | 105.3 | 0 | 0 | 0 | 109.3 | G203 | G203-L205 PolarHBondContact O-N 3.43Š| ||
| 206 | V | 54.1 | Low | 53.9 | Low | 145 Ų | 145 | 119.8 Ų | 119.8 | 88% | 0.879 | 73% | 0.729 | S | S | * | * | S | Bend | trans | -88.6 | 100.8 | 158 | 177.7 | 0 | 0 | 0 | 0 | 106.6 | P204 | P204-V206 VanDerWaalsContact C-N 3.29Å; P204-V206 PolarHBondContact O-N 2.94Å |
| 207 | G | 52 | Low | 53.2 | Low | 79 Ų | 79 | 123.4 Ų | 123.4 | 81% | 0.814 | 75% | 0.745 | S | S | * | * | S | Bend | trans | 110.9 | 36.3 | 163.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||
| 208 | G | 44.8 | Very low | 52.7 | Low | 42 Ų | 42 | 124.2 Ų | 124.2 | 43% | 0.433 | 74% | 0.743 | S | S | . | * | trans | -107.2 | 112.2 | 162.9 | 0 | 0 | 0 | 0 | 0 | 110 | F210 | G208-F210 PolarHBondContact O-N 3.37Š| ||
| 209 | T | 45.4 | Very low | 52.3 | Low | 142 Ų | 142 | 123.4 Ų | 123.4 | 87% | 0.871 | 74% | 0.738 | S | S | * | * | trans | -55.6 | 112.8 | 166.4 | 37.5 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 210 | F | 42.4 | Very low | 52.2 | Low | 198 Ų | 198 | 127.4 Ų | 127.4 | 87% | 0.868 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 125.6 | 173.2 | -65.7 | -83.3 | 0 | 0 | 0 | 109.5 | G208 R212 | G208-F210 PolarHBondContact O-N 3.37Å; F210-R212 PolarHBondContact O-N 3.09Å |
| 211 | P | 45.8 | Very low | 51.7 | Low | 114 Ų | 114 | 127.5 Ų | 127.5 | 74% | 0.74 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 122.7 | 166.4 | 26.7 | -28.5 | 0 | 0 | 0 | 107.8 | ||
| 212 | R | 49.6 | Very low | 51.6 | Low | 224 Ų | 224 | 123.2 Ų | 123.2 | 85% | 0.845 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -47.9 | 136.1 | 173.8 | -176.7 | 176.7 | 177.6 | -148.2 | -0.2 | 110.4 | F210 G214 | F210-R212 PolarHBondContact O-N 3.09Å; R212-G214 PolarHBondContact O-N 3.49Å; R212-G214 VanDerWaalsContact O-N 3.08Å |
| 213 | P | 44.2 | Very low | 51.9 | Low | 134 Ų | 134 | 124 Ų | 124 | 87% | 0.87 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.9 | 111.3 | -179.5 | 27.8 | -31.8 | 0 | 0 | 0 | 108.8 | ||
| 214 | G | 49.9 | Very low | 52 | Low | 75 Ų | 75 | 124.3 Ų | 124.3 | 77% | 0.773 | 74% | 0.737 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 171.6 | -8.3 | -178.9 | 0 | 0 | 0 | 0 | 0 | 116.7 | R212 | R212-G214 PolarHBondContact O-N 3.49Å; R212-G214 VanDerWaalsContact O-N 3.08Å |
| 215 | T | 50.5 | Low | 52.4 | Low | 120 Ų | 120 | 123.9 Ų | 123.9 | 74% | 0.736 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -86.5 | 129 | 173.3 | 11.7 | 0 | 0 | 0 | 0 | 110.5 | F217 | T215-F217 PolarHBondContact O-N 2.62Š|
| 216 | P | 48.9 | Very low | 53.1 | Low | 113 Ų | 113 | 121 Ų | 121 | 73% | 0.734 | 71% | 0.71 | S | S | * | * | trans | -62.9 | 131.7 | 178.3 | 25.9 | -32.5 | 0 | 0 | 0 | 109.8 | I218 | P216-I218 PolarHBondContact O-N 3.37Š| ||
| 217 | F | 51.2 | Low | 53.7 | Low | 197 Ų | 197 | 119.2 Ų | 119.2 | 86% | 0.864 | 69% | 0.694 | S | S | * | * | trans | -59.8 | 102.1 | 174.2 | -148.5 | -95 | 0 | 0 | 0 | 107.9 | T215 P219 | T215-F217 PolarHBondContact O-N 2.62Å; F217-P219 VanDerWaalsContact O-CD 3.31Å; F217-P219 WeakPolarHBondContact O-CD 3.21Å | ||
| 218 | I | 50.6 | Low | 54.3 | Low | 139 Ų | 139 | 120.6 Ų | 120.6 | 71% | 0.713 | 68% | 0.683 | S | S | * | * | trans | -75.3 | 116.1 | 166.4 | -59.5 | 175.5 | 0 | 0 | 0 | 105 | P216 E220 | P216-I218 PolarHBondContact O-N 3.37Å; I218-E220 PolarHBondContact O-N 3.33Å | ||
| 219 | P | 51.7 | Low | 55.1 | Low | 102 Ų | 102 | 128.6 Ų | 128.6 | 66% | 0.662 | 70% | 0.7 | S | S | * | * | trans | -63.9 | 113.8 | 170.9 | -12 | 27.3 | 0 | 0 | 0 | 106.9 | F217 P221 | F217-P219 VanDerWaalsContact O-CD 3.31Å; F217-P219 WeakPolarHBondContact O-CD 3.21Å; P219-P221 VanDerWaalsContact O-CD 3.24Å; P219-P221 WeakPolarHBondContact O-CD 3.48Å; P219-P221 VanDerWaalsContact O-N 3.12Å | ||
| 220 | E | 58.5 | Low | 56.2 | Low | 176 Ų | 176 | 128.3 Ų | 128.3 | 82% | 0.822 | 69% | 0.692 | S | S | * | * | trans | -57 | 115.8 | 168.9 | -74.1 | -175.6 | 159.5 | 0 | 0 | 107.7 | I218 L222 | I218-E220 PolarHBondContact O-N 3.33Å; E220-L222 PolarHBondContact O-N 3.07Å | ||
| 221 | P | 54.5 | Low | 57.3 | Low | 110 Ų | 110 | 127.3 Ų | 127.3 | 71% | 0.714 | 68% | 0.683 | S | S | * | * | trans | -85.3 | 28.2 | -171.3 | 35.8 | -35.1 | 0 | 0 | 0 | 111.9 | P219 | P219-P221 VanDerWaalsContact O-CD 3.24Å; P219-P221 WeakPolarHBondContact O-CD 3.48Å; P219-P221 VanDerWaalsContact O-N 3.12Å | ||
| 222 | L | 57.3 | Low | 58.2 | Low | 101 Ų | 101 | 127.2 Ų | 127.2 | 53% | 0.529 | 68% | 0.682 | S | S | . | * | trans | -122.4 | 80.5 | -176.2 | -69.4 | 159.2 | 0 | 0 | 0 | 108.3 | E220 G224 | E220-L222 PolarHBondContact O-N 3.07Å; L222-G224 PolarHBondContact O-N 3.33Å | ||
| 223 | S | 68 | Low | 59.1 | Low | 69 Ų | 69 | 119.7 Ų | 119.7 | 48% | 0.483 | 66% | 0.663 | S | S | . | * | trans | -46.5 | 130 | 165.5 | 170.9 | 0 | 0 | 0 | 0 | 108.8 | L225 E226 | S223-L225 PolarHBondContact O-N 2.83Å; S223-E226 PolarHBondContact O-N 3.45Å | ||
| 224 | G | 63.4 | Low | 59.9 | Low | 46 Ų | 46 | 123.1 Ų | 123.1 | 47% | 0.474 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -54 | -19.3 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114 | L222 L227 L228 | L222-G224 PolarHBondContact O-N 3.33Å; G224-L227 PolarHBondContact O-N 3.41Å; G224-L228 WeakPolarHBondContact O-CG 3.2Å; G224-L228 PolarHBondContact O-N 2.72Å; G224-L228 VanDerWaalsContact O-N 3.1Å |
| 225 | L | 64.7 | Low | 60.7 | Low | 121 Ų | 121 | 127 Ų | 127 | 63% | 0.634 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -66.3 | -33.1 | 172.3 | -61.7 | -178.1 | 0 | 0 | 0 | 113.6 | S223 L228 R229 | S223-L225 PolarHBondContact O-N 2.83Å; L225-L228 HydrophobicContact CD2-CD1 4.27Å; L225-L228 PolarHBondContact O-N 3.13Å; L225-R229 PolarHBondContact O-N 2.86Å |
| 226 | E | 68 | Low | 61.3 | Low | 95 Ų | 95 | 130.9 Ų | 130.9 | 44% | 0.444 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -72.3 | -38.7 | 175.4 | -62.7 | -157 | 150.7 | 0 | 0 | 111.6 | S223 L228 R229 L230 | S223-E226 PolarHBondContact O-N 3.45Å; E226-L228 VanDerWaalsContact C-N 3.29Å; E226-L228 PolarHBondContact O-N 3.33Å; E226-R229 WeakPolarHBondContact O-CB 2.75Å; E226-R229 PolarHBondContact O-N 2.88Å; E226-R229 VanDerWaalsContact O-N 3.13Å; E226-L230 WeakPolarHBondContact O-CG 3.4Å; E226-L230 PolarHBondContact O-N 3.24Å; E226-L230 VanDerWaalsContact O-N 3.14Å |
| 227 | L | 66 | Low | 62 | Low | 106 Ų | 106 | 131.7 Ų | 131.7 | 56% | 0.555 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -61.5 | -36.6 | 171.9 | -86.7 | 158.7 | 0 | 0 | 0 | 112.2 | G224 R229 L230 R231 | G224-L227 PolarHBondContact O-N 3.41Å; L227-R229 VanDerWaalsContact C-N 3.33Å; L227-L230 PolarHBondContact O-N 2.87Å; L227-R231 PolarHBondContact O-N 2.92Å |
| 228 | L | 64.1 | Low | 62.3 | Low | 109 Ų | 109 | 126.7 Ų | 126.7 | 57% | 0.571 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -68.2 | -30.4 | 175.1 | -71.7 | 171.7 | 0 | 0 | 0 | 112.9 | G224 L225 E226 R231 | G224-L228 WeakPolarHBondContact O-CG 3.2Å; G224-L228 PolarHBondContact O-N 2.72Å; G224-L228 VanDerWaalsContact O-N 3.1Å; L225-L228 HydrophobicContact CD2-CD1 4.27Å; L225-L228 PolarHBondContact O-N 3.13Å; E226-L228 VanDerWaalsContact C-N 3.29Å; E226-L228 PolarHBondContact O-N 3.33Å; L228-R231 WeakPolarHBondContact O-CB 3.36Å; L228-R231 PolarHBondContact O-N 2.9Å |
| 229 | R | 63.1 | Low | 62.8 | Low | 210 Ų | 210 | 128.2 Ų | 128.2 | 79% | 0.792 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -72.1 | -32.8 | 174.5 | -75.3 | 177.2 | 165 | 165.8 | -3.4 | 112.8 | L225 E226 L227 R231 | L225-R229 PolarHBondContact O-N 2.86Å; E226-R229 WeakPolarHBondContact O-CB 2.75Å; E226-R229 PolarHBondContact O-N 2.88Å; E226-R229 VanDerWaalsContact O-N 3.13Å; L227-R229 VanDerWaalsContact C-N 3.33Å; R229-R231 VanDerWaalsContact C-N 3.29Å |
| 230 | L | 67.4 | Low | 63.5 | Low | 136 Ų | 136 | 126 Ų | 126 | 71% | 0.712 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -80.8 | -10.7 | 176.6 | -65.1 | 170 | 0 | 0 | 0 | 112.9 | E226 L227 | E226-L230 WeakPolarHBondContact O-CG 3.4Å; E226-L230 PolarHBondContact O-N 3.24Å; E226-L230 VanDerWaalsContact O-N 3.14Å; L227-L230 PolarHBondContact O-N 2.87Å |
| 231 | R | 66.3 | Low | 63.2 | Low | 177 Ų | 177 | 130.1 Ų | 130.1 | 67% | 0.668 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -62.6 | 131.7 | 175.6 | -172.9 | -179.5 | 177.7 | 178.7 | 0.6 | 109.5 | L227 L228 R229 S233 | L227-R231 PolarHBondContact O-N 2.92Å; L228-R231 WeakPolarHBondContact O-CB 3.36Å; L228-R231 PolarHBondContact O-N 2.9Å; R229-R231 VanDerWaalsContact C-N 3.29Å; R231-S233 PolarHBondContact O-N 3.45Å |
| 232 | P | 65.1 | Low | 62.9 | Low | 111 Ų | 111 | 129.2 Ų | 129.2 | 72% | 0.721 | 67% | 0.667 | S | S | * | * | trans | -56.3 | 105.5 | 169.5 | -23.8 | 33.9 | 0 | 0 | 0 | 109.6 | ||||
| 233 | S | 67.6 | Low | 62.6 | Low | 66 Ų | 66 | 133.7 Ų | 133.7 | 46% | 0.462 | 68% | 0.677 | S | S | . | * | trans | -80.2 | 122.8 | 175.9 | 59.7 | 0 | 0 | 0 | 0 | 108.8 | R231 N235 | R231-S233 PolarHBondContact O-N 3.45Å; S233-N235 PolarHBondContact O-N 3.28Å | ||
| 234 | F | 61.3 | Low | 61.7 | Low | 207 Ų | 207 | 137.2 Ų | 137.2 | 91% | 0.908 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -72.5 | -12.5 | 173.5 | -123.8 | -92.2 | 0 | 0 | 0 | 112.2 | R236 | F234-R236 PolarHBondContact O-N 2.98Š|
| 235 | N | 67.3 | Low | 61 | Low | 157 Ų | 157 | 139 Ų | 139 | 84% | 0.84 | 69% | 0.688 | S | S | * | * | trans | -86.4 | 35.4 | 176.2 | -61.6 | -22.6 | 0 | 0 | 0 | 112.2 | S233 V237 | S233-N235 PolarHBondContact O-N 3.28Å; N235-V237 PolarHBondContact O-N 3.14Å | ||
| 236 | R | 62.3 | Low | 60.5 | Low | 201 Ų | 201 | 138.8 Ų | 138.8 | 76% | 0.758 | 70% | 0.695 | S | S | * | * | trans | -76.8 | 121.1 | 168 | -75.1 | 179.2 | 171.7 | -170 | -3.4 | 107.3 | F234 A238 | F234-R236 PolarHBondContact O-N 2.98Å; R236-A238 PolarHBondContact O-N 3.18Å | ||
| 237 | V | 63.9 | Low | 59.4 | Low | 129 Ų | 129 | 141.9 Ų | 141.9 | 78% | 0.782 | 71% | 0.709 | S | S | * | * | trans | -49.5 | 133.2 | 165.1 | 165.6 | 0 | 0 | 0 | 0 | 107.1 | N235 Q239 | N235-V237 PolarHBondContact O-N 3.14Å; V237-Q239 VanDerWaalsContact C-N 3.31Å; V237-Q239 PolarHBondContact O-N 2.61Å | ||
| 238 | A | 57.9 | Low | 58.9 | Low | 93 Ų | 93 | 142.5 Ų | 142.5 | 77% | 0.769 | 72% | 0.722 | S | S | * | * | trans | -56.4 | 100 | 174.7 | 0 | 0 | 0 | 0 | 0 | 107.9 | R236 G240 | R236-A238 PolarHBondContact O-N 3.18Å; A238-G240 PolarHBondContact O-N 3.41Å; A238-G240 VanDerWaalsContact O-N 3.08Å | ||
| 239 | Q | 60.1 | Low | 58.3 | Low | 171 Ų | 171 | 146.8 Ų | 146.8 | 80% | 0.799 | 74% | 0.739 | S | S | * | * | trans | -64 | 114.2 | 163.7 | -69.2 | -171.6 | -14.4 | 0 | 0 | 103.5 | V237 V242 | V237-Q239 VanDerWaalsContact C-N 3.31Å; V237-Q239 PolarHBondContact O-N 2.61Å; Q239-V242 HydrophobicContact CB-CG2 4.48Å | ||
| 240 | G | 66 | Low | 57.9 | Low | 55 Ų | 55 | 145.2 Ų | 145.2 | 57% | 0.567 | 74% | 0.741 | S | S | * | * | trans | -56.8 | -170.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | A238 V242 | A238-G240 PolarHBondContact O-N 3.41Å; A238-G240 VanDerWaalsContact O-N 3.08Å; G240-V242 VanDerWaalsContact C-N 3.26Å; G240-V242 PolarHBondContact O-N 2.71Å | ||
| 241 | W | 52.6 | Low | 56.6 | Low | 263 Ų | 263 | 150.3 Ų | 150.3 | 100% | 0.996 | 77% | 0.768 | S | S | * | * | trans | -64.6 | 91.6 | 176.6 | -64 | 60.7 | 0 | 0 | 0 | 108.4 | R243 | W241-R243 VanDerWaalsContact C-N 3.34Å; W241-R243 PolarHBondContact O-N 2.96Å | ||
| 242 | V | 47.7 | Very low | 56.2 | Low | 91 Ų | 91 | 149 Ų | 149 | 55% | 0.552 | 77% | 0.773 | S | S | * | * | trans | -66 | 100.2 | 176 | -179.3 | 0 | 0 | 0 | 0 | 105.9 | Q239 G240 N244 | Q239-V242 HydrophobicContact CB-CG2 4.48Å; G240-V242 VanDerWaalsContact C-N 3.26Å; G240-V242 PolarHBondContact O-N 2.71Å; V242-N244 VanDerWaalsContact C-N 3.3Å; V242-N244 WeakPolarHBondContact CG1-OD1 3.46Å; V242-N244 PolarHBondContact O-N 3.31Å | ||
| 243 | R | 51.4 | Low | 55.7 | Low | 195 Ų | 195 | 151 Ų | 151 | 74% | 0.736 | 78% | 0.776 | S | S | * | * | trans | -70.7 | 94.8 | 164.3 | -176.6 | 179.2 | 171 | -159.1 | -10 | 105.3 | W241 L245 | W241-R243 VanDerWaalsContact C-N 3.34Å; W241-R243 PolarHBondContact O-N 2.96Å; R243-L245 HydrophobicContact CG-CD1 4.06Å; R243-L245 PolarHBondContact O-N 3.25Å | ||
| 244 | N | 48.8 | Very low | 55 | Low | 143 Ų | 143 | 155.7 Ų | 155.7 | 77% | 0.765 | 79% | 0.793 | S | S | * | * | trans | -66 | 89 | 165.2 | -65.8 | -43.7 | 0 | 0 | 0 | 106.9 | V242 | V242-N244 VanDerWaalsContact C-N 3.3Å; V242-N244 WeakPolarHBondContact CG1-OD1 3.46Å; V242-N244 PolarHBondContact O-N 3.31Å | ||
| 245 | L | 50.1 | Low | 54.7 | Low | 82 Ų | 82 | 152.7 Ų | 152.7 | 43% | 0.429 | 79% | 0.786 | S | S | . | * | trans | -100.8 | 123.7 | 161.6 | -132 | 72.5 | 0 | 0 | 0 | 106.3 | R243 E247 | R243-L245 HydrophobicContact CG-CD1 4.06Å; R243-L245 PolarHBondContact O-N 3.25Å; L245-E247 VanDerWaalsContact C-N 3.27Å; L245-E247 HydrophobicContact CB-CG 4.49Å; L245-E247 HydrophobicContact CD2-CG 4.05Å; L245-E247 PolarHBondContact O-N 3.12Å; L245-E247 VanDerWaalsContact O-N 3.08Å | ||
| 246 | P | 54.2 | Low | 53.9 | Low | 118 Ų | 118 | 152.4 Ų | 152.4 | 77% | 0.766 | 78% | 0.783 | S | S | * | * | trans | -74.5 | 91.7 | 160.2 | 30 | -27.2 | 0 | 0 | 0 | 106.7 | S248 | P246-S248 PolarHBondContact O-N 2.91Š| ||
| 247 | E | 44.5 | Very low | 53.3 | Low | 160 Ų | 160 | 149.2 Ų | 149.2 | 75% | 0.748 | 79% | 0.785 | S | S | * | * | trans | -80.3 | 103.5 | 158 | -72.3 | -177.9 | -178.6 | 0 | 0 | 106.1 | L245 E249 | L245-E247 VanDerWaalsContact C-N 3.27Å; L245-E247 HydrophobicContact CB-CG 4.49Å; L245-E247 HydrophobicContact CD2-CG 4.05Å; L245-E247 PolarHBondContact O-N 3.12Å; L245-E247 VanDerWaalsContact O-N 3.08Å; E247-E249 PolarHBondContact O-N 3.1Å | ||
| 248 | S | 55.1 | Low | 52.6 | Low | 118 Ų | 118 | 150.6 Ų | 150.6 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | trans | -69.9 | 102.9 | 167.3 | -51.6 | 0 | 0 | 0 | 0 | 108.1 | P246 | P246-S248 PolarHBondContact O-N 2.91Š| ||
| 249 | E | 51.4 | Low | 52.1 | Low | 199 Ų | 199 | 155.1 Ų | 155.1 | 93% | 0.93 | 79% | 0.786 | S | S | * | * | trans | -91.2 | 102.7 | 156.2 | -92.7 | -174.8 | 148.3 | 0 | 0 | 107.9 | E247 | E247-E249 PolarHBondContact O-N 3.1Š| ||
| 250 | E | 54.3 | Low | 51.5 | Low | 177 Ų | 177 | 153.8 Ų | 153.8 | 83% | 0.827 | 79% | 0.785 | S | S | * | * | trans | -143.5 | 104.4 | 160.4 | -150.7 | 167.3 | -152.1 | 0 | 0 | 108.6 | ||||
| 251 | L | 41.7 | Very low | 50.2 | Low | 244 Ų | 244 | 162.7 Ų | 162.7 | 100% | 1.277 | 81% | 0.805 | S | S | * | * | trans | 59.7 | 0 | 154.7 | -65.5 | 164.9 | 0 | 0 | 0 | 120.4 |
Retrieved 251 of 251 residues in 1072 ms
(Link to these results)