| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 48 | Very low | 72.8 | Confident | 241 Ų | 241 | 118.7 Ų | 118.7 | 100% | 1.187 | 68% | 0.679 | S | S | * | * | 0 | 101.9 | 0 | -69.5 | -178.2 | 159.4 | 0 | 0 | 107.3 | P3 | M1-P3 WeakPolarHBondContact O-CD 3.44Š| |||
| 2 | Q | 60.5 | Low | 73.9 | Confident | 195 Ų | 195 | 119.3 Ų | 119.3 | 91% | 0.911 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 117.3 | 177.5 | -80.5 | 174.7 | -42.6 | 0 | 0 | 108.3 | S4 | Q2-S4 PolarHBondContact O-N 3.48Š|
| 3 | P | 64.2 | Low | 74.8 | Confident | 120 Ų | 120 | 118.9 Ų | 118.9 | 78% | 0.779 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 124.9 | 171.4 | 28.1 | -30.9 | 0 | 0 | 0 | 107.7 | M1 L5 | M1-P3 WeakPolarHBondContact O-CD 3.44Å; P3-L5 PolarHBondContact O-N 3.4Å |
| 4 | S | 68.3 | Low | 75.4 | Confident | 89 Ų | 89 | 116.4 Ų | 116.4 | 62% | 0.622 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 130.8 | 176.1 | 40.7 | 0 | 0 | 0 | 0 | 109.3 | Q2 A6 P7 | Q2-S4 PolarHBondContact O-N 3.48Å; S4-A6 VanDerWaalsContact C-N 3.26Å; S4-A6 PolarHBondContact O-N 3.05Å; S4-P7 WeakPolarHBondContact O-CD 3.34Å |
| 5 | L | 73.8 | Confident | 75.7 | Confident | 147 Ų | 147 | 117.4 Ų | 117.4 | 77% | 0.77 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -76.2 | -12.3 | 178.7 | -81.5 | 161.1 | 0 | 0 | 0 | 113.2 | P3 L9 | P3-L5 PolarHBondContact O-N 3.4Å; L5-L9 PolarHBondContact O-N 3.1Å |
| 6 | A | 76.2 | Confident | 75.8 | Confident | 63 Ų | 63 | 113.9 Ų | 113.9 | 52% | 0.521 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -60.5 | -46.2 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | S4 C8 L9 I10 | S4-A6 VanDerWaalsContact C-N 3.26Å; S4-A6 PolarHBondContact O-N 3.05Å; A6-C8 VanDerWaalsContact C-N 3.33Å; A6-C8 PolarHBondContact O-N 3.12Å; A6-L9 PolarHBondContact O-N 2.92Å; A6-I10 WeakPolarHBondContact O-CG1 3.06Å; A6-I10 PolarHBondContact O-N 3.39Å |
| 7 | P | 78.3 | Confident | 75.8 | Confident | 70 Ų | 70 | 110.6 Ų | 110.6 | 46% | 0.455 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -68.3 | -31.8 | -178.4 | 27.9 | -32.6 | 0 | 0 | 0 | 112.5 | S4 I10 C11 | S4-P7 WeakPolarHBondContact O-CD 3.34Å; P7-I10 PolarHBondContact O-N 2.91Å; P7-C11 PolarHBondContact O-N 3.23Å |
| 8 | C | 81.1 | Confident | 75.5 | Confident | 81 Ų | 81 | 112.7 Ų | 112.7 | 55% | 0.547 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -65.7 | -40.4 | 175.9 | -78.7 | 0 | 0 | 0 | 0 | 112.3 | A6 I10 C11 L12 | A6-C8 VanDerWaalsContact C-N 3.33Å; A6-C8 PolarHBondContact O-N 3.12Å; C8-I10 VanDerWaalsContact C-N 3.34Å; C8-C11 PolarHBondContact O-N 3.06Å; C8-L12 WeakPolarHBondContact O-CG 3.48Å; C8-L12 PolarHBondContact O-N 2.72Å; C8-L12 VanDerWaalsContact O-N 3.09Å |
| 9 | L | 83.6 | Confident | 75.1 | Confident | 114 Ų | 114 | 111.2 Ų | 111.2 | 60% | 0.597 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -68.6 | -36.7 | -179.6 | -141.4 | 121.8 | 0 | 0 | 0 | 111.4 | L5 A6 L12 L13 | L5-L9 PolarHBondContact O-N 3.1Å; A6-L9 PolarHBondContact O-N 2.92Å; L9-L12 PolarHBondContact O-N 2.88Å; L9-L13 HydrophobicContact CD2-CD1 4.34Å; L9-L13 WeakPolarHBondContact O-CG 3.06Å; L9-L13 PolarHBondContact O-N 3.26Å; L9-L13 VanDerWaalsContact O-N 3.1Å |
| 10 | I | 83.5 | Confident | 74.5 | Confident | 109 Ų | 109 | 109.1 Ų | 109.1 | 56% | 0.559 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -65.2 | -44.2 | 174.7 | -65 | 165 | 0 | 0 | 0 | 110.6 | A6 P7 C8 L12 L13 V14 | A6-I10 WeakPolarHBondContact O-CG1 3.06Å; A6-I10 PolarHBondContact O-N 3.39Å; P7-I10 PolarHBondContact O-N 2.91Å; C8-I10 VanDerWaalsContact C-N 3.34Å; I10-L12 VanDerWaalsContact C-N 3.34Å; I10-L12 PolarHBondContact O-N 2.95Å; I10-L13 PolarHBondContact O-N 3.34Å; I10-V14 HydrophobicContact CG2-CG2 4.48Å; I10-V14 WeakPolarHBondContact O-CG2 3.05Å; I10-V14 PolarHBondContact O-N 2.03Å |
| 11 | C | 83.8 | Confident | 73.8 | Confident | 77 Ų | 77 | 108.9 Ų | 108.9 | 52% | 0.52 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -59.5 | -42.7 | 175.7 | -80 | 0 | 0 | 0 | 0 | 112.4 | P7 C8 L13 V14 H15 | P7-C11 PolarHBondContact O-N 3.23Å; C8-C11 PolarHBondContact O-N 3.06Å; C11-L13 PolarHBondContact O-N 3.34Å; C11-V14 PolarHBondContact O-N 2.84Å; C11-H15 PolarHBondContact O-CD2 2.86Å; C11-H15 VanDerWaalsContact O-CD2 3.31Å; C11-H15 PolarHBondContact O-N 2.88Å |
| 12 | L | 85.4 | Confident | 74.2 | Confident | 126 Ų | 126 | 104.9 Ų | 104.9 | 66% | 0.66 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -64.3 | -39.9 | 178.3 | -72.3 | 172.2 | 0 | 0 | 0 | 112.4 | C8 L9 I10 H15 A16 | C8-L12 WeakPolarHBondContact O-CG 3.48Å; C8-L12 PolarHBondContact O-N 2.72Å; C8-L12 VanDerWaalsContact O-N 3.09Å; L9-L12 PolarHBondContact O-N 2.88Å; I10-L12 VanDerWaalsContact C-N 3.34Å; I10-L12 PolarHBondContact O-N 2.95Å; L12-H15 PolarHBondContact O-N 2.89Å; L12-A16 WeakPolarHBondContact O-CB 3.45Å; L12-A16 PolarHBondContact O-N 2.74Å |
| 13 | L | 85.8 | Confident | 74 | Confident | 114 Ų | 114 | 98.8 Ų | 98.8 | 60% | 0.597 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66.1 | -39.1 | 176.5 | -72.2 | 171.5 | 0 | 0 | 0 | 112.3 | L9 I10 C11 A16 A17 | L9-L13 HydrophobicContact CD2-CD1 4.34Å; L9-L13 WeakPolarHBondContact O-CG 3.06Å; L9-L13 PolarHBondContact O-N 3.26Å; L9-L13 VanDerWaalsContact O-N 3.1Å; I10-L13 PolarHBondContact O-N 3.34Å; C11-L13 PolarHBondContact O-N 3.34Å; L13-A16 PolarHBondContact O-N 2.82Å; L13-A17 WeakPolarHBondContact O-CB 3.47Å; L13-A17 PolarHBondContact O-N 2.85Å |
| 14 | V | 83 | Confident | 73.5 | Confident | 83 Ų | 83 | 100.6 Ų | 100.6 | 50% | 0.503 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -66.1 | -42 | 176.7 | 174 | 0 | 0 | 0 | 0 | 111.1 | I10 C11 A17 F18 | I10-V14 HydrophobicContact CG2-CG2 4.48Å; I10-V14 WeakPolarHBondContact O-CG2 3.05Å; I10-V14 PolarHBondContact O-N 2.03Å; C11-V14 PolarHBondContact O-N 2.84Å; V14-A17 PolarHBondContact O-N 2.8Å; V14-F18 PolarHBondContact O-N 2.89Å |
| 15 | H | 79.3 | Confident | 72.8 | Confident | 132 Ų | 132 | 99.3 Ų | 99.3 | 61% | 0.611 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -64.4 | -41.9 | 175.5 | -88.8 | -87.3 | 0 | 0 | 0 | 112.3 | C11 L12 A17 F18 C19 | C11-H15 PolarHBondContact O-CD2 2.86Å; C11-H15 VanDerWaalsContact O-CD2 3.31Å; C11-H15 PolarHBondContact O-N 2.88Å; L12-H15 PolarHBondContact O-N 2.89Å; H15-A17 VanDerWaalsContact C-N 3.34Å; H15-A17 PolarHBondContact O-N 2.88Å; H15-F18 PolarHBondContact O-N 2.81Å; H15-C19 PolarHBondContact O-N 2.8Å; H15-C19 PolarHBondContact O-SG 2.95Å; H15-C19 VanDerWaalsContact O-SG 3.35Å |
| 16 | A | 78.5 | Confident | 72 | Confident | 62 Ų | 62 | 104.2 Ų | 104.2 | 51% | 0.512 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -63.9 | -39.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | L12 L13 A20 | L12-A16 WeakPolarHBondContact O-CB 3.45Å; L12-A16 PolarHBondContact O-N 2.74Å; L13-A16 PolarHBondContact O-N 2.82Å; A16-A20 WeakPolarHBondContact O-CB 3.44Å; A16-A20 PolarHBondContact O-N 2.79Å; A16-A20 VanDerWaalsContact O-N 3.08Å |
| 17 | A | 76.1 | Confident | 71.2 | Confident | 58 Ų | 58 | 110.3 Ų | 110.3 | 48% | 0.479 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -66.9 | -38.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L13 V14 H15 A20 V21 | L13-A17 WeakPolarHBondContact O-CB 3.47Å; L13-A17 PolarHBondContact O-N 2.85Å; V14-A17 PolarHBondContact O-N 2.8Å; H15-A17 VanDerWaalsContact C-N 3.34Å; H15-A17 PolarHBondContact O-N 2.88Å; A17-A20 PolarHBondContact O-N 3.48Å; A17-V21 WeakPolarHBondContact O-CG2 3.49Å; A17-V21 PolarHBondContact O-N 2.83Å |
| 18 | F | 68.9 | Low | 70.3 | Confident | 147 Ų | 147 | 111.6 Ų | 111.6 | 65% | 0.645 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -68.2 | -41.4 | 177 | -120.1 | -94.6 | 0 | 0 | 0 | 112.2 | V14 H15 A20 V21 E22 | V14-F18 PolarHBondContact O-N 2.89Å; H15-F18 PolarHBondContact O-N 2.81Å; F18-A20 VanDerWaalsContact C-N 3.3Å; F18-A20 PolarHBondContact O-N 3.01Å; F18-V21 PolarHBondContact O-N 2.81Å; F18-E22 PolarHBondContact O-N 3.3Å |
| 19 | C | 68.5 | Low | 68.9 | Low | 85 Ų | 85 | 116.5 Ų | 116.5 | 57% | 0.574 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -68 | -28.4 | 176.4 | -67.8 | 0 | 0 | 0 | 0 | 113.1 | H15 | H15-C19 PolarHBondContact O-N 2.8Å; H15-C19 PolarHBondContact O-SG 2.95Å; H15-C19 VanDerWaalsContact O-SG 3.35Å |
| 20 | A | 62.7 | Low | 67.3 | Low | 69 Ų | 69 | 121.7 Ų | 121.7 | 57% | 0.57 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -71.5 | -29.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A16 A17 F18 | A16-A20 WeakPolarHBondContact O-CB 3.44Å; A16-A20 PolarHBondContact O-N 2.79Å; A16-A20 VanDerWaalsContact O-N 3.08Å; A17-A20 PolarHBondContact O-N 3.48Å; F18-A20 VanDerWaalsContact C-N 3.3Å; F18-A20 PolarHBondContact O-N 3.01Å |
| 21 | V | 60.1 | Low | 66.3 | Low | 105 Ų | 105 | 122.5 Ų | 122.5 | 64% | 0.636 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -80.8 | -32.3 | -179.7 | 170.1 | 0 | 0 | 0 | 0 | 112.3 | A17 F18 G23 Q24 | A17-V21 WeakPolarHBondContact O-CG2 3.49Å; A17-V21 PolarHBondContact O-N 2.83Å; F18-V21 PolarHBondContact O-N 2.81Å; V21-G23 PolarHBondContact O-N 2.98Å; V21-Q24 PolarHBondContact O-N 2.79Å |
| 22 | E | 57.2 | Low | 65.2 | Low | 157 Ų | 157 | 125.3 Ų | 125.3 | 73% | 0.734 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.7 | -14.8 | 176.4 | -77.1 | -176.3 | 155.4 | 0 | 0 | 113.7 | F18 | F18-E22 PolarHBondContact O-N 3.3Š|
| 23 | G | 56.3 | Low | 63.6 | Low | 67 Ų | 67 | 123.9 Ų | 123.9 | 69% | 0.691 | 69% | 0.687 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -14.1 | 176 | 0 | 0 | 0 | 0 | 0 | 115 | V21 G25 | V21-G23 PolarHBondContact O-N 2.98Å; G23-G25 PolarHBondContact O-N 2.77Å |
| 24 | Q | 52.4 | Low | 62.4 | Low | 157 Ų | 157 | 124.7 Ų | 124.7 | 73% | 0.734 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -94 | 73.5 | 175.7 | -86.7 | 164 | -27 | 0 | 0 | 110 | V21 W26 | V21-Q24 PolarHBondContact O-N 2.79Å; Q24-W26 PolarHBondContact O-N 3.2Å |
| 25 | G | 53.5 | Low | 61.5 | Low | 63 Ų | 63 | 128.9 Ų | 128.9 | 65% | 0.649 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 130.5 | 168.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | G23 Q27 | G23-G25 PolarHBondContact O-N 2.77Å; G25-Q27 PolarHBondContact O-N 2.9Å |
| 26 | W | 57 | Low | 60.7 | Low | 250 Ų | 250 | 128.9 Ų | 128.9 | 95% | 0.947 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 128.6 | 177.9 | -65.4 | 6.5 | 0 | 0 | 0 | 109.1 | Q24 A28 | Q24-W26 PolarHBondContact O-N 3.2Å; W26-A28 PolarHBondContact O-N 3.44Å |
| 27 | Q | 59.6 | Low | 59.9 | Low | 190 Ų | 190 | 132.8 Ų | 132.8 | 89% | 0.888 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 127.4 | -179.7 | -76.1 | -152.8 | -14.9 | 0 | 0 | 110.1 | G25 F29 | G25-Q27 PolarHBondContact O-N 2.9Å; Q27-F29 PolarHBondContact O-N 3.04Å; Q27-F29 VanDerWaalsContact O-N 3.08Å |
| 28 | A | 60.2 | Low | 59.1 | Low | 98 Ų | 98 | 135.2 Ų | 135.2 | 81% | 0.81 | 74% | 0.741 | S | S | * | * | trans | -62.6 | 110.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | W26 R30 | W26-A28 PolarHBondContact O-N 3.44Å; A28-R30 PolarHBondContact O-N 3.45Å | ||
| 29 | F | 52 | Low | 58.4 | Low | 183 Ų | 183 | 131.7 Ų | 131.7 | 80% | 0.803 | 75% | 0.747 | S | S | * | * | trans | -75.4 | 104.9 | 175.7 | -147.7 | -94.3 | 0 | 0 | 0 | 108.2 | Q27 N31 | Q27-F29 PolarHBondContact O-N 3.04Å; Q27-F29 VanDerWaalsContact O-N 3.08Å; F29-N31 WeakPolarHBondContact CD1-OD1 3.4Å; F29-N31 WeakPolarHBondContact CE1-OD1 3.25Å | ||
| 30 | R | 50.5 | Low | 57.8 | Low | 223 Ų | 223 | 135.5 Ų | 135.5 | 84% | 0.842 | 76% | 0.761 | S | S | * | * | trans | -82 | 116 | 171.5 | -82.3 | -168 | -178.2 | -158.9 | 2 | 108.6 | A28 | A28-R30 PolarHBondContact O-N 3.45Š| ||
| 31 | N | 62.5 | Low | 57.1 | Low | 126 Ų | 126 | 134.9 Ų | 134.9 | 67% | 0.674 | 76% | 0.761 | S | S | * | * | trans | -100.2 | 105.7 | 167.6 | -64.6 | -30.7 | 0 | 0 | 0 | 107.4 | F29 A33 | F29-N31 WeakPolarHBondContact CD1-OD1 3.4Å; F29-N31 WeakPolarHBondContact CE1-OD1 3.25Å; N31-A33 PolarHBondContact O-N 2.99Å | ||
| 32 | D | 60 | Low | 56.6 | Low | 136 Ų | 136 | 139.1 Ų | 139.1 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | -74 | 112.4 | 166 | -65.9 | -27.1 | 0 | 0 | 0 | 106.9 | T34 | D32-T34 PolarHBondContact O-N 2.88Å; D32-T34 VanDerWaalsContact O-N 3.09Å | ||
| 33 | A | 51.6 | Low | 56.6 | Low | 97 Ų | 97 | 141.3 Ų | 141.3 | 80% | 0.802 | 78% | 0.777 | S | S | * | * | trans | -67.1 | 106.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | N31 E35 | N31-A33 PolarHBondContact O-N 2.99Å; A33-E35 PolarHBondContact O-N 2.89Å | ||
| 34 | T | 61.2 | Low | 56.5 | Low | 130 Ų | 130 | 143.6 Ų | 143.6 | 80% | 0.798 | 78% | 0.78 | S | S | * | * | trans | -83.4 | 107.1 | 173.6 | 37.2 | 0 | 0 | 0 | 0 | 109.9 | D32 V36 | D32-T34 PolarHBondContact O-N 2.88Å; D32-T34 VanDerWaalsContact O-N 3.09Å; T34-V36 PolarHBondContact O-N 2.84Å | ||
| 35 | E | 63.8 | Low | 56.6 | Low | 171 Ų | 171 | 145.1 Ų | 145.1 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | trans | -77.6 | 115.7 | 167.6 | -60.9 | -172.1 | -176.3 | 0 | 0 | 109 | A33 I37 | A33-E35 PolarHBondContact O-N 2.89Å; E35-I37 PolarHBondContact O-N 3.13Å | ||
| 36 | V | 62.9 | Low | 57 | Low | 133 Ų | 133 | 147.2 Ų | 147.2 | 81% | 0.806 | 79% | 0.789 | S | S | * | * | trans | -84.4 | 100.5 | 171.9 | -178.6 | 0 | 0 | 0 | 0 | 107.9 | T34 P38 | T34-V36 PolarHBondContact O-N 2.84Å; V36-P38 WeakPolarHBondContact O-CD 3.29Å | ||
| 37 | I | 60.6 | Low | 57.1 | Low | 143 Ų | 143 | 140.8 Ų | 140.8 | 73% | 0.733 | 78% | 0.779 | S | S | * | * | trans | -79.3 | 117.4 | 171.4 | -57.3 | 171.9 | 0 | 0 | 0 | 107.5 | E35 G39 | E35-I37 PolarHBondContact O-N 3.13Å; I37-G39 PolarHBondContact O-N 3.3Å | ||
| 38 | P | 59.2 | Low | 56.7 | Low | 109 Ų | 109 | 137.9 Ų | 137.9 | 71% | 0.708 | 78% | 0.777 | S | S | * | * | trans | -67.7 | 122.6 | 177 | -9.2 | 24.1 | 0 | 0 | 0 | 109.1 | V36 L40 | V36-P38 WeakPolarHBondContact O-CD 3.29Å; P38-L40 PolarHBondContact O-N 2.65Å | ||
| 39 | G | 53.8 | Low | 56.3 | Low | 74 Ų | 74 | 142.5 Ų | 142.5 | 76% | 0.763 | 78% | 0.782 | S | S | * | * | trans | -62.2 | 115.4 | 168.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | I37 G41 | I37-G39 PolarHBondContact O-N 3.3Å; G39-G41 PolarHBondContact O-N 3.44Å; G39-G41 VanDerWaalsContact O-N 3.13Å | ||
| 40 | L | 55.8 | Low | 56.4 | Low | 164 Ų | 164 | 140.4 Ų | 140.4 | 86% | 0.859 | 78% | 0.779 | S | S | * | * | trans | -63.3 | 110.4 | 169.2 | -84.2 | 151.8 | 0 | 0 | 0 | 107.8 | P38 | P38-L40 PolarHBondContact O-N 2.65Š| ||
| 41 | G | 48.8 | Very low | 56.5 | Low | 56 Ų | 56 | 136.1 Ų | 136.1 | 58% | 0.577 | 77% | 0.773 | S | S | * | * | trans | -59.7 | 147.6 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | G39 Y43 | G39-G41 PolarHBondContact O-N 3.44Å; G39-G41 VanDerWaalsContact O-N 3.13Å; G41-Y43 PolarHBondContact O-N 3.45Å | ||
| 42 | E | 48.8 | Very low | 56.1 | Low | 195 Ų | 195 | 139.7 Ų | 139.7 | 91% | 0.911 | 79% | 0.785 | S | S | * | * | trans | -41.4 | 124.4 | 178.5 | -94.7 | 128 | 137.5 | 0 | 0 | 113.5 | ||||
| 43 | Y | 57.3 | Low | 55.9 | Low | 202 Ų | 202 | 139.5 Ų | 139.5 | 79% | 0.792 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 142.3 | 160.7 | -83.5 | -91.1 | 0 | 0 | 0 | 109.3 | G41 E45 | G41-Y43 PolarHBondContact O-N 3.45Å; Y43-E45 PolarHBondContact O-N 3.5Å |
| 44 | P | 54.9 | Low | 56.2 | Low | 116 Ų | 116 | 143.4 Ų | 143.4 | 75% | 0.753 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 131.7 | -177.8 | -9.1 | 24 | 0 | 0 | 0 | 111.1 | P46 | P44-P46 WeakPolarHBondContact O-CD 3.32Š|
| 45 | E | 55.5 | Low | 56.1 | Low | 189 Ų | 189 | 145.5 Ų | 145.5 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 123.4 | 175.2 | -159.7 | -175.9 | 154.9 | 0 | 0 | 110.5 | Y43 | Y43-E45 PolarHBondContact O-N 3.5Š|
| 46 | P | 61.9 | Low | 56.3 | Low | 107 Ų | 107 | 148.9 Ų | 148.9 | 70% | 0.695 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 151.8 | 172.9 | 31.3 | -30.9 | 0 | 0 | 0 | 112 | P44 | P44-P46 WeakPolarHBondContact O-CD 3.32Š|
| 47 | P | 58.4 | Low | 56.4 | Low | 114 Ų | 114 | 146.5 Ų | 146.5 | 74% | 0.74 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -74.9 | 164.8 | -168.6 | 31.9 | -36.3 | 0 | 0 | 0 | 113.8 | ||
| 48 | P | 51.5 | Low | 56.4 | Low | 130 Ų | 130 | 149 Ų | 149 | 84% | 0.844 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 125.1 | -166.9 | 31.9 | -32.9 | 0 | 0 | 0 | 112.2 | ||
| 49 | E | 52 | Low | 56.6 | Low | 194 Ų | 194 | 151.3 Ų | 151.3 | 91% | 0.907 | 81% | 0.814 | S | S | * | * | trans | -111 | 98.6 | 173.5 | -80.9 | -169.9 | 155.9 | 0 | 0 | 112.7 | ||||
| 50 | N | 52.9 | Low | 56.9 | Low | 139 Ų | 139 | 151.2 Ų | 151.2 | 74% | 0.743 | 81% | 0.814 | S | S | * | * | trans | 14.5 | 107.6 | 143.3 | -158.8 | 16.2 | 0 | 0 | 0 | 120.5 | Q52 | N50-Q52 PolarHBondContact O-N 3.45Š| ||
| 51 | N | 52 | Low | 56.9 | Low | 134 Ų | 134 | 146.8 Ų | 146.8 | 72% | 0.717 | 81% | 0.807 | S | S | * | * | trans | 27.6 | 83 | 133.6 | -43.6 | -20 | 0 | 0 | 0 | 119.3 | ||||
| 52 | Q | 54.5 | Low | 57.7 | Low | 200 Ų | 200 | 154.6 Ų | 154.6 | 94% | 0.935 | 82% | 0.82 | S | S | * | * | trans | -174.2 | 141.1 | 134.5 | -102.2 | 158.7 | 71.2 | 0 | 0 | 109.8 | N50 | N50-Q52 PolarHBondContact O-N 3.45Š| ||
| 53 | T | 56.6 | Low | 58.5 | Low | 133 Ų | 133 | 150.1 Ų | 150.1 | 82% | 0.816 | 81% | 0.807 | S | S | * | * | trans | -73.3 | 137.5 | -159.7 | 63.3 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 54 | M | 57.1 | Low | 58.8 | Low | 179 Ų | 179 | 145.3 Ų | 145.3 | 88% | 0.882 | 80% | 0.801 | S | S | * | * | trans | -163.3 | 124.2 | 138.7 | -92.6 | -144.9 | -71 | 0 | 0 | 109.4 | R56 | M54-R56 PolarHBondContact O-N 2.79Š| ||
| 55 | N | 60.3 | Low | 58.7 | Low | 174 Ų | 174 | 147 Ų | 147 | 93% | 0.93 | 80% | 0.798 | S | S | * | * | trans | -59 | 102.4 | 179.4 | -52.4 | -37.3 | 0 | 0 | 0 | 109.8 | ||||
| 56 | R | 68.1 | Low | 58.8 | Low | 241 Ų | 241 | 145.4 Ų | 145.4 | 91% | 0.909 | 79% | 0.79 | S | S | * | * | trans | -91.7 | 116.9 | 176.5 | -167.9 | 174.1 | -177.7 | 119.3 | -1.8 | 108.9 | M54 E58 | M54-R56 PolarHBondContact O-N 2.79Å; R56-E58 PolarHBondContact O-N 2.93Å | ||
| 57 | A | 63.4 | Low | 58.5 | Low | 84 Ų | 84 | 144.5 Ų | 144.5 | 69% | 0.694 | 79% | 0.785 | S | S | * | * | trans | -66.4 | 122.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | N59 | A57-N59 PolarHBondContact O-N 3.09Š| ||
| 58 | E | 62 | Low | 58 | Low | 194 Ų | 194 | 149.7 Ų | 149.7 | 91% | 0.907 | 79% | 0.791 | S | S | * | * | trans | -76.9 | 106.6 | 174.7 | -144.5 | 178 | -174.1 | 0 | 0 | 108.1 | R56 G60 | R56-E58 PolarHBondContact O-N 2.93Å; E58-G60 PolarHBondContact O-N 2.84Å | ||
| 59 | N | 63.5 | Low | 58 | Low | 158 Ų | 158 | 149.9 Ų | 149.9 | 85% | 0.845 | 79% | 0.785 | S | S | * | * | trans | -69.9 | 96.3 | 172.1 | -82.8 | -2.9 | 0 | 0 | 0 | 108.1 | A57 G61 | A57-N59 PolarHBondContact O-N 3.09Å; N59-G61 PolarHBondContact O-N 3.4Å | ||
| 60 | G | 59.1 | Low | 58 | Low | 73 Ų | 73 | 144.1 Ų | 144.1 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | trans | -59.8 | 98 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | E58 R62 | E58-G60 PolarHBondContact O-N 2.84Å; G60-R62 PolarHBondContact O-N 2.88Å | ||
| 61 | G | 57.1 | Low | 58.1 | Low | 70 Ų | 70 | 145.7 Ų | 145.7 | 72% | 0.722 | 77% | 0.771 | S | S | * | * | trans | -63.1 | 103.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.2 | N59 P63 | N59-G61 PolarHBondContact O-N 3.4Å; G61-P63 VanDerWaalsContact O-CD 3.31Å; G61-P63 WeakPolarHBondContact O-CD 3.38Å | ||
| 62 | R | 63.9 | Low | 57.9 | Low | 221 Ų | 221 | 147.1 Ų | 147.1 | 83% | 0.834 | 78% | 0.778 | S | S | * | * | trans | -65.3 | 117.5 | 172.5 | -165.4 | 178.7 | -158 | -174.6 | 5.1 | 107.7 | G60 | G60-R62 PolarHBondContact O-N 2.88Š| ||
| 63 | P | 67.2 | Low | 58 | Low | 101 Ų | 101 | 140.5 Ų | 140.5 | 66% | 0.656 | 75% | 0.751 | S | S | * | * | trans | -59.5 | 147.9 | 173.8 | 24.4 | -31.6 | 0 | 0 | 0 | 109 | G61 H65 | G61-P63 VanDerWaalsContact O-CD 3.31Å; G61-P63 WeakPolarHBondContact O-CD 3.38Å; P63-H65 PolarHBondContact O-N 2.01Å | ||
| 64 | P | 62.4 | Low | 58.3 | Low | 101 Ų | 101 | 137.5 Ų | 137.5 | 66% | 0.656 | 74% | 0.736 | S | S | * | * | trans | -56.8 | 115.2 | -179.7 | 22.3 | -30.8 | 0 | 0 | 0 | 108.8 | H66 | P64-H66 VanDerWaalsContact C-N 3.28Å; P64-H66 PolarHBondContact O-N 3.24Å | ||
| 65 | H | 53.8 | Low | 58.6 | Low | 151 Ų | 151 | 135.9 Ų | 135.9 | 70% | 0.699 | 73% | 0.726 | S | S | * | * | trans | -68.6 | 93.7 | 171.1 | -173.9 | -77 | 0 | 0 | 0 | 106.4 | P63 P67 | P63-H65 PolarHBondContact O-N 2.01Å; H65-P67 WeakPolarHBondContact O-CD 3.4Å | ||
| 66 | H | 57.1 | Low | 59.3 | Low | 155 Ų | 155 | 133.7 Ų | 133.7 | 72% | 0.718 | 71% | 0.706 | S | S | * | * | trans | -69.3 | 108 | 166.5 | -70.2 | -62.7 | 0 | 0 | 0 | 106.5 | P64 Y68 | P64-H66 VanDerWaalsContact C-N 3.28Å; P64-H66 PolarHBondContact O-N 3.24Å; H66-Y68 PolarHBondContact O-N 2.75Å | ||
| 67 | P | 55 | Low | 59.9 | Low | 88 Ų | 88 | 123.5 Ų | 123.5 | 57% | 0.571 | 67% | 0.672 | S | S | * | * | trans | -61.7 | 114.4 | 170.7 | 27.8 | -29.3 | 0 | 0 | 0 | 105.6 | H65 D69 | H65-P67 WeakPolarHBondContact O-CD 3.4Å; P67-D69 PolarHBondContact O-N 2.81Å | ||
| 68 | Y | 49.1 | Very low | 61 | Low | 224 Ų | 224 | 120.9 Ų | 120.9 | 88% | 0.878 | 65% | 0.648 | S | S | * | * | trans | -65.5 | 94 | 162.3 | -138 | -90.5 | 0 | 0 | 0 | 104.1 | H66 A70 | H66-Y68 PolarHBondContact O-N 2.75Å; Y68-A70 PolarHBondContact O-N 2.74Å | ||
| 69 | D | 50.4 | Low | 62.3 | Low | 134 Ų | 134 | 116.3 Ų | 116.3 | 72% | 0.717 | 62% | 0.622 | S | S | * | * | trans | -65 | 80.9 | 164.7 | -88.6 | -25.3 | 0 | 0 | 0 | 105.7 | P67 K71 | P67-D69 PolarHBondContact O-N 2.81Å; D69-K71 PolarHBondContact O-N 2.8Å | ||
| 70 | A | 52.2 | Low | 63.7 | Low | 73 Ų | 73 | 112.7 Ų | 112.7 | 60% | 0.603 | 60% | 0.6 | S | S | * | * | trans | -62.1 | 77.7 | 151.1 | 0 | 0 | 0 | 0 | 0 | 104.8 | Y68 D72 | Y68-A70 PolarHBondContact O-N 2.74Å; A70-D72 VanDerWaalsContact C-N 3.3Å; A70-D72 PolarHBondContact O-N 3.23Å | ||
| 71 | K | 54.5 | Low | 65.3 | Low | 172 Ų | 172 | 113.5 Ų | 113.5 | 75% | 0.748 | 59% | 0.587 | S | S | * | * | trans | -50.5 | 109.2 | 161.3 | -89 | -176.3 | 176.3 | 178.2 | 0 | 103.6 | D69 V73 | D69-K71 PolarHBondContact O-N 2.8Å; K71-V73 VanDerWaalsContact O-CG2 3.25Å; K71-V73 WeakPolarHBondContact O-CG2 3.35Å; K71-V73 PolarHBondContact O-N 2.8Å | ||
| 72 | D | 49.4 | Very low | 67 | Low | 163 Ų | 163 | 116 Ų | 116 | 87% | 0.872 | 58% | 0.58 | S | S | * | * | trans | -54.4 | 84 | 178.2 | -79.8 | -44.3 | 0 | 0 | 0 | 108.5 | A70 S74 | A70-D72 VanDerWaalsContact C-N 3.3Å; A70-D72 PolarHBondContact O-N 3.23Å; D72-S74 VanDerWaalsContact C-N 3.34Å; D72-S74 PolarHBondContact O-N 3.21Å | ||
| 73 | V | 55.3 | Low | 68.4 | Low | 61 Ų | 61 | 112.2 Ų | 112.2 | 37% | 0.37 | 57% | 0.566 | S | S | . | * | trans | -89.4 | 94.8 | -177.6 | 178.1 | 0 | 0 | 0 | 0 | 104.9 | K71 E75 S77 R79 | K71-V73 VanDerWaalsContact O-CG2 3.25Å; K71-V73 WeakPolarHBondContact O-CG2 3.35Å; K71-V73 PolarHBondContact O-N 2.8Å; V73-E75 PolarHBondContact O-N 3.38Å; V73-S77 WeakPolarHBondContact CG1-OG 3.32Å; V73-R79 HydrophobicContact CG1-CG 3.79Å; V73-R79 VanDerWaalsContact CG1-NH2 3.3Å; V73-R79 PolarHBondContact O-NH2 3.25Å | ||
| 74 | S | 62.5 | Low | 69.7 | Low | 70 Ų | 70 | 111.6 Ų | 111.6 | 49% | 0.49 | 56% | 0.561 | S | S | . | * | trans | -28.3 | 124.9 | 172.3 | 55.5 | 0 | 0 | 0 | 0 | 110.7 | D72 Y76 S77 | D72-S74 VanDerWaalsContact C-N 3.34Å; D72-S74 PolarHBondContact O-N 3.21Å; S74-Y76 PolarHBondContact O-N 3.35Å; S74-S77 PolarHBondContact O-N 3.4Å; S74-S77 PolarHBondContact O-OG 3.06Å; S74-S77 VanDerWaalsContact OG-CB 3.28Å; S74-S77 WeakPolarHBondContact OG-CB 3.28Å; S74-S77 PolarHBondContact OG-OG 3.49Å | ||
| 75 | E | 65.2 | Low | 71.2 | Confident | 145 Ų | 145 | 111.2 Ų | 111.2 | 68% | 0.678 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.4 | -30.4 | -179 | -65.7 | 177.6 | 169.9 | 0 | 0 | 111.2 | V73 | V73-E75 PolarHBondContact O-N 3.38Š|
| 76 | Y | 73.5 | Confident | 73.1 | Confident | 128 Ų | 128 | 108 Ų | 108 | 50% | 0.502 | 53% | 0.531 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.8 | 58.7 | 179 | -60.2 | -82.3 | 0 | 0 | 0 | 113.5 | S74 Q106 | S74-Y76 PolarHBondContact O-N 3.35Å; Y76-Q106 CarbonylContact C-O 3.54Å; Y76-Q106 WeakPolarHBondContact CA-O 3.38Å; Y76-Q106 HydrophobicContact CD1-CB 4.44Å |
| 77 | S | 80.5 | Confident | 74.9 | Confident | 28 Ų | 28 | 101.1 Ų | 101.1 | 20% | 0.196 | 50% | 0.499 | C | S | . | . | trans | -133.6 | 145 | 168.7 | 57.5 | 0 | 0 | 0 | 0 | 112.6 | V73 S74 R79 G105 Q106 | V73-S77 WeakPolarHBondContact CG1-OG 3.32Å; S74-S77 PolarHBondContact O-N 3.4Å; S74-S77 PolarHBondContact O-OG 3.06Å; S74-S77 VanDerWaalsContact OG-CB 3.28Å; S74-S77 WeakPolarHBondContact OG-CB 3.28Å; S74-S77 PolarHBondContact OG-OG 3.49Å; S77-R79 PolarHBondContact O-N 3.42Å; S77-G105 WeakPolarHBondContact O-CA 3.14Å; S77-Q106 CarbonylContact C-O 3.58Å; S77-Q106 PolarHBondContact N-O 2.99Å; S77-Q106 PolarHBondContact O-N 3.38Å | ||
| 78 | C | 88.2 | Confident | 76.7 | Confident | 28 Ų | 28 | 101.2 Ų | 101.2 | 19% | 0.189 | 50% | 0.498 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 107.1 | 170.2 | -179 | 0 | 0 | 0 | 0 | 108.3 | C132 C163 C165 | C78-C132 VanDerWaalsContact CA-SG 3.55Å; C78-C132 HydrophobicContact CB-CB 3.74Å; C78-C132 WeakPolarHBondContact CB-SG 3.42Å; C78-C132 VanDerWaalsContact SG-CA 3.53Å; C78-C132 WeakPolarHBondContact SG-CB 3.47Å; C78-C132 CovalentContact SG-SG 2.03Å; C78-C132 PolarHBondContact SG-SG 3.47Å; C78-C163 VanDerWaalsContact SG-CB 3.57Å; C78-C165 VanDerWaalsContact CB-SG 3.55Å |
| 79 | R | 89.2 | Confident | 78.7 | Confident | 99 Ų | 99 | 93.9 Ų | 93.9 | 37% | 0.374 | 47% | 0.474 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.4 | 146.5 | -177.2 | -54.5 | 179.9 | -169.8 | -167.3 | -8.6 | 111 | V73 S77 S104 | V73-R79 HydrophobicContact CG1-CG 3.79Å; V73-R79 VanDerWaalsContact CG1-NH2 3.3Å; V73-R79 PolarHBondContact O-NH2 3.25Å; S77-R79 PolarHBondContact O-N 3.42Å; R79-S104 WeakPolarHBondContact CA-O 3.3Å; R79-S104 WeakPolarHBondContact CB-O 3.39Å; R79-S104 PolarHBondContact N-O 3.43Å; R79-S104 PolarHBondContact O-N 3.02Å; R79-S104 VanDerWaalsContact O-O 3.07Å |
| 80 | E | 92.5 | Very high | 80.7 | Confident | 81 Ų | 81 | 90.9 Ų | 90.9 | 38% | 0.379 | 47% | 0.474 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 103.3 | 174.9 | -62.5 | -173.3 | 164.3 | 0 | 0 | 109.1 | H82 L101 S162 C163 | E80-H82 PolarHBondContact O-ND1 3.29Å; E80-L101 HydrophobicContact CB-CD1 4.03Å; E80-L101 HydrophobicContact CB-CD2 3.97Å; E80-L101 HydrophobicContact CB-CG 4.12Å; E80-L101 HydrophobicContact CG-CD1 4.3Å; E80-L101 HydrophobicContact CG-CD2 4.09Å; E80-S162 WeakPolarHBondContact OE1-CA 3.42Å; E80-C163 HydrophobicContact CG-CB 3.96Å; E80-C163 PolarHBondContact OE1-N 3.37Å |
| 81 | L | 92 | Very high | 82.6 | Confident | 91 Ų | 91 | 92.2 Ų | 92.2 | 48% | 0.476 | 48% | 0.477 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.1 | 120.5 | 176.1 | -63.8 | -179.6 | 0 | 0 | 0 | 109.6 | L101 V102 S104 | L81-L101 CarbonylContact O-C 3.14Å; L81-L101 WeakPolarHBondContact O-CA 3.04Å; L81-V102 HydrophobicContact CB-CB 4.4Å; L81-V102 PolarHBondContact N-O 3.49Å; L81-V102 PolarHBondContact O-N 3.31Å; L81-S104 WeakPolarHBondContact CD1-OG 3.42Å; L81-S104 WeakPolarHBondContact CG-OG 3.48Å |
| 82 | H | 93 | Very high | 84.4 | Confident | 123 Ų | 123 | 84.2 Ų | 84.2 | 57% | 0.569 | 44% | 0.442 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 122.9 | 178.6 | -67.2 | 86.3 | 0 | 0 | 0 | 109.8 | E80 E100 | E80-H82 PolarHBondContact O-ND1 3.29Å; H82-E100 WeakPolarHBondContact CA-O 3.39Å |
| 83 | Y | 92.8 | Very high | 86.5 | Confident | 141 Ų | 141 | 83.1 Ų | 83.1 | 55% | 0.553 | 43% | 0.426 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 129.4 | 177 | -178.7 | -111.5 | 0 | 0 | 0 | 110.3 | R85 T99 E100 | Y83-R85 HydrophobicContact CD1-CB 4.17Å; Y83-R85 HydrophobicContact CD1-CG 4.3Å; Y83-R85 HydrophobicContact CE1-CB 3.58Å; Y83-R85 HydrophobicContact CE1-CG 4.02Å; Y83-T99 CarbonylContact O-C 3.42Å; Y83-E100 PolarHBondContact N-O 3.45Å; Y83-E100 PolarHBondContact O-N 2.93Å |
| 84 | T | 94.8 | Very high | 88.4 | Confident | 88 Ų | 88 | 80.4 Ų | 80.4 | 54% | 0.54 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 122.6 | 179.3 | 56.6 | 0 | 0 | 0 | 0 | 110.7 | V98 T99 | T84-V98 WeakPolarHBondContact CA-O 3.46Å; T84-T99 HydrophobicContact CG2-CG2 3.59Å |
| 85 | R | 94.4 | Very high | 89.8 | Confident | 92 Ų | 92 | 79.8 Ų | 79.8 | 35% | 0.347 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.4 | 156.7 | 176.2 | 70 | -179.8 | -168.1 | 103.2 | 3.8 | 113.2 | Y83 P97 V98 E100 | Y83-R85 HydrophobicContact CD1-CB 4.17Å; Y83-R85 HydrophobicContact CD1-CG 4.3Å; Y83-R85 HydrophobicContact CE1-CB 3.58Å; Y83-R85 HydrophobicContact CE1-CG 4.02Å; R85-P97 WeakPolarHBondContact O-CA 3.5Å; R85-V98 PolarHBondContact N-O 2.74Å; R85-V98 PolarHBondContact O-N 3.43Å; R85-E100 HydrophobicContact CG-CG 4.48Å; R85-E100 IonicContact CZ-OE1 2.84Å; R85-E100 VanDerWaalsContact CZ-OE1 3.25Å; R85-E100 IonicContact CZ-OE2 2.88Å; R85-E100 IonicContact NE-OE1 2.65Å; R85-E100 PolarHBondContact NE-OE1 3.07Å; R85-E100 IonicContact NE-OE2 3.25Å; R85-E100 PolarHBondContact NE-OE2 2.9Å; R85-E100 IonicContact NH2-OE1 3.5Å; R85-E100 PolarHBondContact NH2-OE1 3.42Å; R85-E100 IonicContact NH2-OE2 3.94Å |
| 86 | F | 94.6 | Very high | 91.1 | Very high | 85 Ų | 85 | 80.6 Ų | 80.6 | 37% | 0.373 | 41% | 0.41 | S | S | . | . | trans | -79.1 | 140.8 | 168.5 | -68.7 | -90.2 | 0 | 0 | 0 | 109.9 | R93 P97 | F86-R93 HydrophobicContact CB-CG 4.47Å; F86-R93 VanDerWaalsContact CD2-NH2 3.31Å; F86-P97 HydrophobicContact CD1-CB 4.46Å; F86-P97 HydrophobicContact CD2-CB 4.43Å; F86-P97 HydrophobicContact CE1-CB 4.24Å; F86-P97 HydrophobicContact CE1-CG 4.49Å; F86-P97 HydrophobicContact CE2-CB 4.2Å; F86-P97 HydrophobicContact CZ-CB 4.1Å; F86-P97 HydrophobicContact CZ-CG 4.28Å | ||
| 87 | L | 93.7 | Very high | 92.1 | Very high | 10 Ų | 10 | 77.8 Ų | 77.8 | 5% | 0.052 | 41% | 0.408 | C | S | . | . | trans | -92 | 131 | 174 | -71.3 | 167.8 | 0 | 0 | 0 | 109.1 | R93 S94 V98 V142 L144 V157 | L87-R93 CarbonylContact O-C 3.57Å; L87-S94 PolarHBondContact N-OG 2.93Å; L87-S94 PolarHBondContact O-N 2.87Å; L87-V98 HydrophobicContact CD1-CB 4.17Å; L87-V98 HydrophobicContact CD1-CG1 4.45Å; L87-V98 HydrophobicContact CD1-CG2 3.61Å; L87-V98 HydrophobicContact CG-CB 4.42Å; L87-V98 HydrophobicContact CG-CG2 4.15Å; L87-V142 HydrophobicContact CD1-CB 4.18Å; L87-V142 HydrophobicContact CD1-CG1 4.17Å; L87-V142 HydrophobicContact CD1-CG2 3.84Å; L87-L144 HydrophobicContact CB-CD2 4.49Å; L87-V157 HydrophobicContact CD1-CG1 3.8Å; L87-V157 HydrophobicContact CD1-CG2 4.06Å | ||
| 88 | T | 93.4 | Very high | 92.8 | Very high | 90 Ų | 90 | 76.5 Ų | 76.5 | 55% | 0.552 | 40% | 0.399 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -114.1 | 143.5 | 173.6 | 51.2 | 0 | 0 | 0 | 0 | 109.7 | C92 R93 | T88-C92 WeakPolarHBondContact CA-O 3.29Å; T88-R93 HydrophobicContact CG2-CB 4.43Å; T88-R93 HydrophobicContact CG2-CG 4.24Å |
| 89 | D | 91.5 | Very high | 93.1 | Very high | 70 Ų | 70 | 78.1 Ų | 78.1 | 37% | 0.374 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.7 | 93.9 | 177.5 | -161.4 | 8.8 | 0 | 0 | 0 | 108.7 | C92 L144 R155 | D89-C92 PolarHBondContact N-O 3.43Å; D89-C92 WeakPolarHBondContact O-CB 3.36Å; D89-C92 PolarHBondContact O-N 3.02Å; D89-L144 HydrophobicContact CB-CD1 3.66Å; D89-R155 IonicContact OD1-NH1 3.8Å; D89-R155 WeakPolarHBondContact OD2-CD 3.01Å; D89-R155 IonicContact OD2-CZ 3.54Å; D89-R155 IonicContact OD2-NE 2.81Å; D89-R155 IonicContact OD2-NH1 3.84Å |
| 90 | G | 91 | Very high | 93.2 | Very high | 70 Ų | 70 | 75.3 Ų | 75.3 | 72% | 0.722 | 40% | 0.399 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.8 | -125 | -169.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | C92 | G90-C92 PolarHBondContact O-N 2.85Š|
| 91 | P | 91.6 | Very high | 93.3 | Very high | 101 Ų | 101 | 71.8 Ų | 71.8 | 66% | 0.656 | 38% | 0.383 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -8.6 | 179.4 | 32.8 | -35.6 | 0 | 0 | 0 | 113.4 | P147 | P91-P147 HydrophobicContact CB-CG 3.93Å; P91-P147 WeakPolarHBondContact O-CD 3.47Å |
| 92 | C | 93.2 | Very high | 93.4 | Very high | 4 Ų | 4 | 71.2 Ų | 71.2 | 3% | 0.027 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 144.9 | -173.9 | -46.8 | 0 | 0 | 0 | 0 | 112 | T88 D89 G90 L144 L145 C146 | T88-C92 WeakPolarHBondContact CA-O 3.29Å; D89-C92 PolarHBondContact N-O 3.43Å; D89-C92 WeakPolarHBondContact O-CB 3.36Å; D89-C92 PolarHBondContact O-N 3.02Å; G90-C92 PolarHBondContact O-N 2.85Å; C92-L144 HydrophobicContact CB-CB 4.08Å; C92-L145 CarbonylContact C-O 3.56Å; C92-L145 VanDerWaalsContact CA-O 3.25Å; C92-L145 WeakPolarHBondContact CA-O 3.42Å; C92-C146 HydrophobicContact CB-CB 4Å; C92-C146 WeakPolarHBondContact CB-SG 3.11Å; C92-C146 WeakPolarHBondContact SG-CB 3.44Å; C92-C146 CovalentContact SG-SG 2.03Å; C92-C146 PolarHBondContact SG-SG 3.43Å |
| 93 | R | 94.6 | Very high | 93.5 | Very high | 140 Ų | 140 | 66.7 Ų | 66.7 | 53% | 0.528 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.5 | 144.7 | 177.8 | -178.1 | 175.8 | 172.2 | 171.8 | -1.4 | 111.2 | F86 L87 T88 L145 | F86-R93 HydrophobicContact CB-CG 4.47Å; F86-R93 VanDerWaalsContact CD2-NH2 3.31Å; L87-R93 CarbonylContact O-C 3.57Å; T88-R93 HydrophobicContact CG2-CB 4.43Å; T88-R93 HydrophobicContact CG2-CG 4.24Å; R93-L145 PolarHBondContact N-O 3.26Å; R93-L145 PolarHBondContact O-N 3.28Å |
| 94 | S | 94.9 | Very high | 93.3 | Very high | 5 Ų | 5 | 61.9 Ų | 61.9 | 4% | 0.035 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.5 | 138.9 | 176.9 | 68.3 | 0 | 0 | 0 | 0 | 112 | L87 K96 Q143 | L87-S94 PolarHBondContact N-OG 2.93Å; L87-S94 PolarHBondContact O-N 2.87Å; S94-K96 VanDerWaalsContact C-N 3.28Å; S94-K96 WeakPolarHBondContact CB-O 3.2Å; S94-K96 PolarHBondContact O-N 2.03Å; S94-K96 PolarHBondContact OG-O 3.42Å; S94-Q143 WeakPolarHBondContact CA-O 3.4Å |
| 95 | A | 90.6 | Very high | 93 | Very high | 57 Ų | 57 | 59.6 Ų | 59.6 | 47% | 0.471 | 35% | 0.346 | S | S | . | . | S | Bend | trans | -67.4 | -32.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q143 L145 | A95-Q143 PolarHBondContact N-O 3.36Å; A95-L145 HydrophobicContact CB-CD1 3.68Å; A95-L145 HydrophobicContact CB-CG 4.08Å |
| 96 | K | 93.7 | Very high | 92.5 | Very high | 162 Ų | 162 | 60.9 Ų | 60.9 | 70% | 0.704 | 36% | 0.356 | S | S | * | . | S | Bend | trans | -119.9 | 145.9 | 179.9 | -65.4 | -176.1 | 179 | -177.6 | 0 | 110.5 | S94 | S94-K96 VanDerWaalsContact C-N 3.28Å; S94-K96 WeakPolarHBondContact CB-O 3.2Å; S94-K96 PolarHBondContact O-N 2.03Å; S94-K96 PolarHBondContact OG-O 3.42Å |
| 97 | P | 94.7 | Very high | 92 | Very high | 68 Ų | 68 | 57.7 Ų | 57.7 | 44% | 0.442 | 34% | 0.344 | S | S | . | . | trans | -67.6 | 152.3 | 169.2 | 30.8 | -34.2 | 0 | 0 | 0 | 109.8 | R85 F86 | R85-P97 WeakPolarHBondContact O-CA 3.5Å; F86-P97 HydrophobicContact CD1-CB 4.46Å; F86-P97 HydrophobicContact CD2-CB 4.43Å; F86-P97 HydrophobicContact CE1-CB 4.24Å; F86-P97 HydrophobicContact CE1-CG 4.49Å; F86-P97 HydrophobicContact CE2-CB 4.2Å; F86-P97 HydrophobicContact CZ-CB 4.1Å; F86-P97 HydrophobicContact CZ-CG 4.28Å | ||
| 98 | V | 93.7 | Very high | 91.2 | Very high | 2 Ų | 2 | 58.3 Ų | 58.3 | 1% | 0.012 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.9 | 133.4 | 179.1 | 177.2 | 0 | 0 | 0 | 0 | 108.6 | T84 R85 L87 V142 L159 | T84-V98 WeakPolarHBondContact CA-O 3.46Å; R85-V98 PolarHBondContact N-O 2.74Å; R85-V98 PolarHBondContact O-N 3.43Å; L87-V98 HydrophobicContact CD1-CB 4.17Å; L87-V98 HydrophobicContact CD1-CG1 4.45Å; L87-V98 HydrophobicContact CD1-CG2 3.61Å; L87-V98 HydrophobicContact CG-CB 4.42Å; L87-V98 HydrophobicContact CG-CG2 4.15Å; V98-V142 HydrophobicContact CG2-CG1 4.05Å; V98-V142 HydrophobicContact CG2-CG2 3.65Å; V98-L159 HydrophobicContact CG1-CD1 3.32Å; V98-L159 HydrophobicContact CG1-CD2 4.43Å; V98-L159 HydrophobicContact CG1-CG 4.46Å |
| 99 | T | 94.6 | Very high | 90 | Very high | 61 Ų | 61 | 56.1 Ų | 56.1 | 37% | 0.374 | 34% | 0.339 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.6 | 112 | 174.8 | 50.9 | 0 | 0 | 0 | 0 | 108.9 | Y83 T84 R138 | Y83-T99 CarbonylContact O-C 3.42Å; T84-T99 HydrophobicContact CG2-CG2 3.59Å; T99-R138 PolarHBondContact O-NH2 3.29Å; T99-R138 PolarHBondContact OG1-NH2 3.26Å |
| 100 | E | 92.8 | Very high | 88.6 | Confident | 41 Ų | 41 | 57.3 Ų | 57.3 | 19% | 0.192 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.7 | 147.8 | 170 | -52.6 | -167 | 153.3 | 0 | 0 | 109 | H82 Y83 R85 L159 | H82-E100 WeakPolarHBondContact CA-O 3.39Å; Y83-E100 PolarHBondContact N-O 3.45Å; Y83-E100 PolarHBondContact O-N 2.93Å; R85-E100 HydrophobicContact CG-CG 4.48Å; R85-E100 IonicContact CZ-OE1 2.84Å; R85-E100 VanDerWaalsContact CZ-OE1 3.25Å; R85-E100 IonicContact CZ-OE2 2.88Å; R85-E100 IonicContact NE-OE1 2.65Å; R85-E100 PolarHBondContact NE-OE1 3.07Å; R85-E100 IonicContact NE-OE2 3.25Å; R85-E100 PolarHBondContact NE-OE2 2.9Å; R85-E100 IonicContact NH2-OE1 3.5Å; R85-E100 PolarHBondContact NH2-OE1 3.42Å; R85-E100 IonicContact NH2-OE2 3.94Å; E100-L159 HydrophobicContact CG-CD2 3.85Å |
| 101 | L | 94.2 | Very high | 87.1 | Confident | 7 Ų | 7 | 64.9 Ų | 64.9 | 4% | 0.037 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 130.8 | 177.9 | -166.4 | 159.8 | 0 | 0 | 0 | 108.3 | E80 L81 V160 C163 | E80-L101 HydrophobicContact CB-CD1 4.03Å; E80-L101 HydrophobicContact CB-CD2 3.97Å; E80-L101 HydrophobicContact CB-CG 4.12Å; E80-L101 HydrophobicContact CG-CD1 4.3Å; E80-L101 HydrophobicContact CG-CD2 4.09Å; L81-L101 CarbonylContact O-C 3.14Å; L81-L101 WeakPolarHBondContact O-CA 3.04Å; L101-V160 HydrophobicContact CB-CB 4.2Å; L101-V160 VanDerWaalsContact CB-O 3.3Å; L101-V160 WeakPolarHBondContact CB-O 3.36Å; L101-V160 HydrophobicContact CD2-CB 4.38Å; L101-V160 HydrophobicContact CD2-CG1 3.9Å; L101-V160 WeakPolarHBondContact O-CB 3.03Å; L101-C163 WeakPolarHBondContact CD2-SG 3.41Å |
| 102 | V | 94.5 | Very high | 85.4 | Confident | 79 Ų | 79 | 65.1 Ų | 65.1 | 48% | 0.479 | 36% | 0.361 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.7 | 127.3 | 177 | -178.1 | 0 | 0 | 0 | 0 | 108.7 | L81 | L81-V102 HydrophobicContact CB-CB 4.4Å; L81-V102 PolarHBondContact N-O 3.49Å; L81-V102 PolarHBondContact O-N 3.31Å |
| 103 | C | 93.2 | Very high | 83.7 | Confident | 28 Ų | 28 | 70.8 Ų | 70.8 | 19% | 0.189 | 39% | 0.391 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.7 | 119.9 | 176.5 | -56 | 0 | 0 | 0 | 0 | 109.6 | C163 | C103-C163 WeakPolarHBondContact CA-SG 3.21Å; C103-C163 HydrophobicContact CB-CB 3.72Å; C103-C163 WeakPolarHBondContact CB-SG 3.06Å; C103-C163 WeakPolarHBondContact SG-CB 3.16Å; C103-C163 CovalentContact SG-SG 2.01Å; C103-C163 PolarHBondContact SG-SG 3.35Å |
| 104 | S | 90.6 | Very high | 81.7 | Confident | 40 Ų | 40 | 69.5 Ų | 69.5 | 28% | 0.28 | 40% | 0.4 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141 | 156.6 | 175.5 | 72 | 0 | 0 | 0 | 0 | 110.7 | R79 L81 | R79-S104 WeakPolarHBondContact CA-O 3.3Å; R79-S104 WeakPolarHBondContact CB-O 3.39Å; R79-S104 PolarHBondContact N-O 3.43Å; R79-S104 PolarHBondContact O-N 3.02Å; R79-S104 VanDerWaalsContact O-O 3.07Å; L81-S104 WeakPolarHBondContact CD1-OG 3.42Å; L81-S104 WeakPolarHBondContact CG-OG 3.48Å |
| 105 | G | 87.1 | Confident | 79.8 | Confident | 40 Ų | 40 | 76.5 Ų | 76.5 | 41% | 0.412 | 44% | 0.437 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 123.3 | 170.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113 | S77 | S77-G105 WeakPolarHBondContact O-CA 3.14Å |
| 106 | Q | 83.6 | Confident | 78.2 | Confident | 119 Ų | 119 | 76.3 Ų | 76.3 | 56% | 0.556 | 44% | 0.435 | S | S | * | . | trans | -100.6 | 136.7 | -174.4 | -56 | -178.5 | 7.5 | 0 | 0 | 109.7 | Y76 S77 | Y76-Q106 CarbonylContact C-O 3.54Å; Y76-Q106 WeakPolarHBondContact CA-O 3.38Å; Y76-Q106 HydrophobicContact CD1-CB 4.44Å; S77-Q106 CarbonylContact C-O 3.58Å; S77-Q106 PolarHBondContact N-O 2.99Å; S77-Q106 PolarHBondContact O-N 3.38Å | ||
| 107 | C | 85.2 | Confident | 76.4 | Confident | 18 Ų | 18 | 75.5 Ų | 75.5 | 12% | 0.122 | 44% | 0.438 | C | S | . | . | trans | -115 | 127.4 | 174.7 | -66.4 | 0 | 0 | 0 | 0 | 108.3 | F130 C132 C165 | C107-F130 HydrophobicContact CB-CB 3.55Å; C107-C132 PolarHBondContact SG-N 3.33Å; C107-C165 HydrophobicContact CB-CB 3.65Å; C107-C165 WeakPolarHBondContact CB-SG 3.25Å; C107-C165 WeakPolarHBondContact SG-CA 3.28Å; C107-C165 WeakPolarHBondContact SG-CB 3.44Å; C107-C165 CovalentContact SG-SG 2.04Å; C107-C165 PolarHBondContact SG-SG 3.47Å | ||
| 108 | G | 75.7 | Confident | 74.7 | Confident | 23 Ų | 23 | 75.4 Ų | 75.4 | 24% | 0.237 | 45% | 0.449 | C | S | . | . | trans | -110.7 | 163.4 | 172 | 0 | 0 | 0 | 0 | 0 | 111.6 | A110 | G108-A110 PolarHBondContact O-N 3.09Š| ||
| 109 | P | 69.6 | Low | 73 | Confident | 43 Ų | 43 | 85.7 Ų | 85.7 | 28% | 0.279 | 49% | 0.488 | S | S | . | . | trans | -55.7 | 125.7 | 159.5 | 23 | -29.8 | 0 | 0 | 0 | 108.5 | R111 L112 F130 | P109-R111 PolarHBondContact O-N 3.1Å; P109-L112 HydrophobicContact CB-CG 4.49Å; P109-L112 HydrophobicContact CG-CB 4.08Å; P109-L112 HydrophobicContact CG-CD1 3.54Å; P109-L112 HydrophobicContact CG-CG 3.76Å; P109-L112 PolarHBondContact O-N 3.33Å; P109-F130 HydrophobicContact CB-CD2 4.16Å; P109-F130 HydrophobicContact CB-CE2 3.66Å; P109-F130 HydrophobicContact CB-CZ 4.49Å | ||
| 110 | A | 61.2 | Low | 71.1 | Confident | 95 Ų | 95 | 88.7 Ų | 88.7 | 79% | 0.785 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.1 | -1.1 | -175.9 | 0 | 0 | 0 | 0 | 0 | 115.8 | G108 | G108-A110 PolarHBondContact O-N 3.09Š|
| 111 | R | 59.6 | Low | 69.4 | Low | 230 Ų | 230 | 92.7 Ų | 92.7 | 87% | 0.868 | 52% | 0.522 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -116.7 | -0.2 | -177.9 | -59.8 | -171.1 | -178.5 | -156.9 | 0 | 114.4 | P109 | P109-R111 PolarHBondContact O-N 3.1Š|
| 112 | L | 56.8 | Low | 68 | Low | 106 Ų | 106 | 102.6 Ų | 102.6 | 56% | 0.555 | 56% | 0.559 | S | S | * | * | trans | -107.6 | 72.9 | 173 | -55.7 | -179.6 | 0 | 0 | 0 | 108.9 | P109 A116 | P109-L112 HydrophobicContact CB-CG 4.49Å; P109-L112 HydrophobicContact CG-CB 4.08Å; P109-L112 HydrophobicContact CG-CD1 3.54Å; P109-L112 HydrophobicContact CG-CG 3.76Å; P109-L112 PolarHBondContact O-N 3.33Å; L112-A116 HydrophobicContact CB-CB 3.93Å; L112-A116 HydrophobicContact CD2-CB 3.61Å; L112-A116 HydrophobicContact CG-CB 4.31Å | ||
| 113 | L | 55.9 | Low | 66.5 | Low | 123 Ų | 123 | 105.5 Ų | 105.5 | 64% | 0.644 | 56% | 0.562 | S | S | * | * | trans | -66.4 | 160.9 | 167.5 | -82.8 | 72.1 | 0 | 0 | 0 | 109.2 | N115 A116 | L113-N115 PolarHBondContact O-N 2.97Å; L113-A116 PolarHBondContact O-N 3.4Å | ||
| 114 | P | 54.3 | Low | 64.8 | Low | 112 Ų | 112 | 112.5 Ų | 112.5 | 73% | 0.727 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -54.5 | 4.7 | -168.7 | 14.5 | -30.2 | 0 | 0 | 0 | 118.6 | ||
| 115 | N | 54.9 | Low | 63.2 | Low | 152 Ų | 152 | 115.9 Ų | 115.9 | 81% | 0.813 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -120.2 | 22.8 | 174.6 | -66.8 | -33.8 | 0 | 0 | 0 | 113.6 | L113 I117 | L113-N115 PolarHBondContact O-N 2.97Å; N115-I117 PolarHBondContact O-N 2.97Å |
| 116 | A | 57 | Low | 61.8 | Low | 53 Ų | 53 | 121 Ų | 121 | 44% | 0.438 | 62% | 0.623 | S | S | . | * | trans | -70.9 | 100.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | L112 L113 G118 | L112-A116 HydrophobicContact CB-CB 3.93Å; L112-A116 HydrophobicContact CD2-CB 3.61Å; L112-A116 HydrophobicContact CG-CB 4.31Å; L113-A116 PolarHBondContact O-N 3.4Å; A116-G118 PolarHBondContact O-N 3.42Å | ||
| 117 | I | 56.1 | Low | 60.5 | Low | 146 Ų | 146 | 117.7 Ų | 117.7 | 75% | 0.749 | 62% | 0.621 | S | S | * | * | trans | -69.1 | 78.4 | 166.7 | -58.6 | 168.4 | 0 | 0 | 0 | 107.9 | N115 R119 | N115-I117 PolarHBondContact O-N 2.97Å; I117-R119 VanDerWaalsContact C-N 3.27Å; I117-R119 HydrophobicContact CG2-CG 3.93Å; I117-R119 PolarHBondContact O-N 3.43Å | ||
| 118 | G | 58.7 | Low | 59.4 | Low | 66 Ų | 66 | 119.1 Ų | 119.1 | 68% | 0.68 | 63% | 0.63 | S | S | * | * | trans | -78.4 | 71.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111 | A116 V120 | A116-G118 PolarHBondContact O-N 3.42Å; G118-V120 VanDerWaalsContact C-N 3.31Å; G118-V120 PolarHBondContact O-N 2.04Å | ||
| 119 | R | 57.1 | Low | 59.5 | Low | 218 Ų | 218 | 122.5 Ų | 122.5 | 82% | 0.823 | 64% | 0.643 | S | S | * | * | trans | -62.4 | 93.4 | 172 | -69.3 | -157.2 | -170.8 | -120.8 | 4.6 | 110.5 | I117 K121 | I117-R119 VanDerWaalsContact C-N 3.27Å; I117-R119 HydrophobicContact CG2-CG 3.93Å; I117-R119 PolarHBondContact O-N 3.43Å; R119-K121 PolarHBondContact O-N 2.96Å | ||
| 120 | V | 54.5 | Low | 60.2 | Low | 123 Ų | 123 | 123.4 Ų | 123.4 | 75% | 0.745 | 64% | 0.643 | S | S | * | * | 35.8 | 73.9 | 128.7 | -165.9 | 0 | 0 | 0 | 0 | 114.7 | G118 | G118-V120 VanDerWaalsContact C-N 3.31Å; G118-V120 PolarHBondContact O-N 2.04Å | |||
| 121 | K | 58.3 | Low | 61.4 | Low | 126 Ų | 126 | 123.2 Ų | 123.2 | 55% | 0.548 | 62% | 0.621 | S | S | . | * | trans | -104.1 | 84.7 | 149.9 | -74.6 | -173.4 | 169.6 | -177.5 | 0 | 107.5 | R119 W123 R124 | R119-K121 PolarHBondContact O-N 2.96Å; K121-W123 HydrophobicContact CB-CD2 4.05Å; K121-W123 HydrophobicContact CB-CE3 4.31Å; K121-W123 HydrophobicContact CB-CH2 4.12Å; K121-W123 HydrophobicContact CB-CZ2 3.83Å; K121-W123 HydrophobicContact CB-CZ3 4.33Å; K121-W123 HydrophobicContact CD-CH2 3.96Å; K121-W123 HydrophobicContact CD-CZ2 3.33Å; K121-W123 HydrophobicContact CG-CH2 3.6Å; K121-W123 HydrophobicContact CG-CZ2 3.43Å; K121-W123 VanDerWaalsContact CG-CZ2 3.43Å; K121-W123 HydrophobicContact CG-CZ3 4.21Å; K121-W123 PolarHBondContact O-N 3.2Å; K121-R124 HydrophobicContact CB-CG 4.48Å; K121-R124 PolarHBondContact O-N 3.05Å; K121-R124 VanDerWaalsContact O-N 3.07Å | ||
| 122 | W | 64.1 | Low | 62.9 | Low | 214 Ų | 214 | 113.5 Ų | 113.5 | 81% | 0.811 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.2 | -17.1 | -176.3 | 61.4 | -87.7 | 0 | 0 | 0 | 114.8 | ||
| 123 | W | 63.6 | Low | 64.6 | Low | 141 Ų | 141 | 110 Ų | 110 | 53% | 0.534 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.8 | -6.3 | 178.7 | 61.5 | 85.4 | 0 | 0 | 0 | 114.9 | K121 | K121-W123 HydrophobicContact CB-CD2 4.05Å; K121-W123 HydrophobicContact CB-CE3 4.31Å; K121-W123 HydrophobicContact CB-CH2 4.12Å; K121-W123 HydrophobicContact CB-CZ2 3.83Å; K121-W123 HydrophobicContact CB-CZ3 4.33Å; K121-W123 HydrophobicContact CD-CH2 3.96Å; K121-W123 HydrophobicContact CD-CZ2 3.33Å; K121-W123 HydrophobicContact CG-CH2 3.6Å; K121-W123 HydrophobicContact CG-CZ2 3.43Å; K121-W123 VanDerWaalsContact CG-CZ2 3.43Å; K121-W123 HydrophobicContact CG-CZ3 4.21Å; K121-W123 PolarHBondContact O-N 3.2Å |
| 124 | R | 57 | Low | 66.5 | Low | 174 Ų | 174 | 106.3 Ų | 106.3 | 66% | 0.657 | 55% | 0.554 | S | S | * | * | S | Bend | trans | -93.4 | 124.3 | 175.2 | -69.6 | -109.8 | -171.5 | -103.1 | 3 | 107.9 | K121 N126 | K121-R124 HydrophobicContact CB-CG 4.48Å; K121-R124 PolarHBondContact O-N 3.05Å; K121-R124 VanDerWaalsContact O-N 3.07Å; R124-N126 PolarHBondContact O-N 3.43Å |
| 125 | P | 57.2 | Low | 68.3 | Low | 112 Ų | 112 | 103.7 Ų | 103.7 | 73% | 0.727 | 53% | 0.533 | S | S | * | . | trans | -55.7 | 137.6 | 170.2 | 25.5 | -31.8 | 0 | 0 | 0 | 107.4 | G127 | P125-G127 PolarHBondContact O-N 3.44Š| ||
| 126 | N | 56.9 | Low | 70.2 | Confident | 146 Ų | 146 | 104.6 Ų | 104.6 | 78% | 0.781 | 53% | 0.526 | S | S | * | . | trans | -35.1 | 133.6 | -177.2 | -69.5 | -25.9 | 0 | 0 | 0 | 110.9 | R124 | R124-N126 PolarHBondContact O-N 3.43Š| ||
| 127 | G | 56.3 | Low | 72 | Confident | 51 Ų | 51 | 109 Ų | 109 | 53% | 0.526 | 53% | 0.532 | S | S | . | . | S | Bend | trans | -46.5 | 153.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | P125 D129 | P125-G127 PolarHBondContact O-N 3.44Å; G127-D129 PolarHBondContact O-N 3.07Å |
| 128 | P | 63.2 | Low | 73.9 | Confident | 48 Ų | 48 | 105.7 Ų | 105.7 | 31% | 0.312 | 51% | 0.51 | S | S | . | . | trans | -50.1 | 115.8 | -168.2 | 21.7 | -33.7 | 0 | 0 | 0 | 112.2 | F130 R167 | P128-F130 HydrophobicContact CB-CE2 4.26Å; P128-F130 HydrophobicContact CG-CE2 3.95Å; P128-F130 WeakPolarHBondContact O-CD2 3.34Å; P128-F130 WeakPolarHBondContact O-CE2 3.41Å; P128-F130 PolarHBondContact O-N 2.69Å; P128-R167 HydrophobicContact CB-CG 3.82Å | ||
| 129 | D | 77.1 | Confident | 75.6 | Confident | 94 Ų | 94 | 105.3 Ų | 105.3 | 50% | 0.503 | 50% | 0.5 | S | S | . | . | trans | -63.3 | 121.4 | 179.5 | -59.6 | -38.9 | 0 | 0 | 0 | 108.3 | G127 L168 | G127-D129 PolarHBondContact O-N 3.07Å; D129-L168 HydrophobicContact CB-CB 4.02Å; D129-L168 HydrophobicContact CB-CD2 3.92Å; D129-L168 WeakPolarHBondContact O-CA 3.45Å; D129-L168 WeakPolarHBondContact O-CB 3.09Å; D129-L168 PolarHBondContact O-N 3.2Å | ||
| 130 | F | 84.1 | Confident | 77.3 | Confident | 62 Ų | 62 | 98 Ų | 98 | 27% | 0.272 | 48% | 0.475 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 141.4 | 171.8 | -72.4 | -101.2 | 0 | 0 | 0 | 108.6 | C107 P109 P128 R167 | C107-F130 HydrophobicContact CB-CB 3.55Å; P109-F130 HydrophobicContact CB-CD2 4.16Å; P109-F130 HydrophobicContact CB-CE2 3.66Å; P109-F130 HydrophobicContact CB-CZ 4.49Å; P128-F130 HydrophobicContact CB-CE2 4.26Å; P128-F130 HydrophobicContact CG-CE2 3.95Å; P128-F130 WeakPolarHBondContact O-CD2 3.34Å; P128-F130 WeakPolarHBondContact O-CE2 3.41Å; P128-F130 PolarHBondContact O-N 2.69Å; F130-R167 HydrophobicContact CD1-CB 4.13Å; F130-R167 HydrophobicContact CE1-CB 3.85Å; F130-R167 HydrophobicContact CZ-CB 4.24Å |
| 131 | R | 87.5 | Confident | 79.2 | Confident | 90 Ų | 90 | 101 Ų | 101 | 34% | 0.34 | 47% | 0.473 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133 | 144.8 | 176.9 | 57.1 | 174.9 | -168.8 | -165 | 12.1 | 111.8 | I133 K166 L168 H172 | R131-I133 HydrophobicContact CG-CG2 3.87Å; R131-K166 PolarHBondContact N-O 3.2Å; R131-K166 PolarHBondContact O-N 3.09Å; R131-L168 VanDerWaalsContact CZ-CD1 3.4Å; R131-H172 PolarHBondContact NH2-CD2 3.25Å; R131-H172 VanDerWaalsContact NH2-CG 3.3Å |
| 132 | C | 90.6 | Very high | 81 | Confident | 27 Ų | 27 | 95.4 Ų | 95.4 | 18% | 0.182 | 45% | 0.45 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.1 | 120.2 | 173.5 | -177.4 | 0 | 0 | 0 | 0 | 108.6 | C78 C107 | C78-C132 VanDerWaalsContact CA-SG 3.55Å; C78-C132 HydrophobicContact CB-CB 3.74Å; C78-C132 WeakPolarHBondContact CB-SG 3.42Å; C78-C132 VanDerWaalsContact SG-CA 3.53Å; C78-C132 WeakPolarHBondContact SG-CB 3.47Å; C78-C132 CovalentContact SG-SG 2.03Å; C78-C132 PolarHBondContact SG-SG 3.47Å; C107-C132 PolarHBondContact SG-N 3.33Å |
| 133 | I | 92.1 | Very high | 82.4 | Confident | 32 Ų | 32 | 91.8 Ų | 91.8 | 16% | 0.164 | 44% | 0.442 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.1 | 159.2 | -177.9 | 60.1 | 156.6 | 0 | 0 | 0 | 111.5 | R131 D135 C163 K164 K166 | R131-I133 HydrophobicContact CG-CG2 3.87Å; I133-D135 PolarHBondContact O-N 3.35Å; I133-C163 WeakPolarHBondContact O-CA 3.1Å; I133-K164 HydrophobicContact CG1-CG 4.29Å; I133-K164 WeakPolarHBondContact CG1-O 3.27Å; I133-K164 PolarHBondContact N-O 3.3Å; I133-K164 PolarHBondContact O-N 3.39Å; I133-K166 HydrophobicContact CD1-CB 3.46Å; I133-K166 VanDerWaalsContact CD1-CB 3.46Å; I133-K166 HydrophobicContact CD1-CD 3.36Å; I133-K166 HydrophobicContact CD1-CG 4.01Å; I133-K166 HydrophobicContact CG1-CB 3.69Å; I133-K166 HydrophobicContact CG1-CD 4.5Å |
| 134 | P | 95 | Very high | 83.9 | Confident | 46 Ų | 46 | 85.2 Ų | 85.2 | 30% | 0.299 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -58.5 | 129.4 | 167.1 | -25.1 | 36.3 | 0 | 0 | 0 | 111.5 | Y137 V160 | P134-Y137 HydrophobicContact CB-CE1 4.28Å; P134-Y137 HydrophobicContact CB-CE2 3.96Å; P134-Y137 WeakPolarHBondContact CB-OH 3.46Å; P134-V160 HydrophobicContact CB-CG1 3.86Å; P134-V160 HydrophobicContact CB-CG2 4.1Å; P134-V160 HydrophobicContact CG-CG1 4.4Å; P134-V160 HydrophobicContact CG-CG2 4.1Å |
| 135 | D | 93.5 | Very high | 85.7 | Confident | 56 Ų | 56 | 81.7 Ų | 81.7 | 30% | 0.299 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93 | -58 | 174.5 | 178.3 | 40.5 | 0 | 0 | 0 | 110.9 | I133 S162 K164 | I133-D135 PolarHBondContact O-N 3.35Å; D135-S162 PolarHBondContact N-O 2.74Å; D135-S162 PolarHBondContact OD2-OG 3.26Å; D135-K164 HydrophobicContact CB-CB 4.11Å; D135-K164 HydrophobicContact CB-CD 3.79Å; D135-K164 HydrophobicContact CB-CG 3.81Å; D135-K164 VanDerWaalsContact OD1-CD 3.29Å; D135-K164 WeakPolarHBondContact OD1-CD 2.97Å; D135-K164 WeakPolarHBondContact OD1-CE 3.46Å; D135-K164 IonicContact OD1-NZ 3.93Å; D135-K164 PolarHBondContact OD1-NZ 3.44Å |
| 136 | R | 94.2 | Very high | 87.4 | Confident | 172 Ų | 172 | 77.4 Ų | 77.4 | 65% | 0.649 | 38% | 0.383 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 149 | -177.7 | -61.6 | 177.5 | -172.5 | -161.9 | -1.7 | 110.6 | A161 S162 | R136-A161 HydrophobicContact CB-CB 4.23Å; R136-A161 PolarHBondContact O-N 3.26Å; R136-S162 WeakPolarHBondContact CB-OG 3.35Å; R136-S162 PolarHBondContact N-O 3.48Å; R136-S162 PolarHBondContact N-OG 3Å; R136-S162 PolarHBondContact O-N 3.01Å |
| 137 | Y | 95.8 | Very high | 89.1 | Confident | 146 Ų | 146 | 74.6 Ų | 74.6 | 57% | 0.573 | 37% | 0.373 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 136.7 | 172.1 | -66.6 | -93.6 | 0 | 0 | 0 | 109.4 | P134 L159 V160 | P134-Y137 HydrophobicContact CB-CE1 4.28Å; P134-Y137 HydrophobicContact CB-CE2 3.96Å; P134-Y137 WeakPolarHBondContact CB-OH 3.46Å; Y137-L159 CarbonylContact C-O 3.56Å; Y137-L159 VanDerWaalsContact CA-O 3.28Å; Y137-L159 WeakPolarHBondContact CA-O 3.03Å; Y137-V160 HydrophobicContact CD1-CG2 4.13Å; Y137-V160 HydrophobicContact CE1-CG2 3.71Å |
| 138 | R | 94.6 | Very high | 90.5 | Very high | 76 Ų | 76 | 76.2 Ų | 76.2 | 29% | 0.287 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.1 | 140.5 | 168.7 | 64.6 | 177.1 | -178.1 | -108.5 | -0.4 | 109.4 | T99 L159 A161 | T99-R138 PolarHBondContact O-NH2 3.29Å; T99-R138 PolarHBondContact OG1-NH2 3.26Å; R138-L159 HydrophobicContact CG-CB 4.09Å; R138-L159 PolarHBondContact N-O 3Å; R138-L159 PolarHBondContact O-N 3.42Å; R138-A161 HydrophobicContact CB-CB 3.97Å; R138-A161 HydrophobicContact CG-CB 4.05Å |
| 139 | A | 94.6 | Very high | 91.2 | Very high | 57 Ų | 57 | 78 Ų | 78 | 47% | 0.471 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 128.5 | 170.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | K156 V157 | A139-K156 VanDerWaalsContact CB-CE 3.45Å; A139-K156 HydrophobicContact CB-CG 4.35Å; A139-V157 CarbonylContact C-O 3.49Å; A139-V157 WeakPolarHBondContact CA-O 3.05Å |
| 140 | Q | 93.7 | Very high | 91.5 | Very high | 65 Ų | 65 | 75.8 Ų | 75.8 | 30% | 0.304 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121 | 133.8 | -180 | -174.3 | 170.5 | -23 | 0 | 0 | 109.6 | V142 K156 V157 L159 | Q140-V142 HydrophobicContact CG-CG2 4.17Å; Q140-K156 WeakPolarHBondContact O-CA 3.11Å; Q140-V157 HydrophobicContact CB-CG2 4.22Å; Q140-V157 PolarHBondContact N-O 3.35Å; Q140-V157 WeakPolarHBondContact O-CG2 3.35Å; Q140-V157 PolarHBondContact O-N 3.27Å; Q140-L159 HydrophobicContact CB-CD1 4.29Å |
| 141 | R | 94.5 | Very high | 91.6 | Very high | 186 Ų | 186 | 76.5 Ų | 76.5 | 70% | 0.702 | 43% | 0.429 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.8 | 127 | 170.7 | -68.9 | -174.8 | 75.6 | 149.5 | 1.1 | 108.9 | S154 R155 K156 | R141-S154 PolarHBondContact NH2-OG 3.15Å; R141-R155 CarbonylContact C-O 3.57Å; R141-R155 WeakPolarHBondContact CA-O 3.46Å; R141-K156 HydrophobicContact CG-CB 4.31Å; R141-K156 HydrophobicContact CG-CG 4.36Å |
| 142 | V | 94.6 | Very high | 91.7 | Very high | 9 Ų | 9 | 76.3 Ų | 76.3 | 6% | 0.055 | 44% | 0.439 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 133.4 | -175.3 | -175.8 | 0 | 0 | 0 | 0 | 108.5 | L87 V98 Q140 S154 R155 V157 | L87-V142 HydrophobicContact CD1-CB 4.18Å; L87-V142 HydrophobicContact CD1-CG1 4.17Å; L87-V142 HydrophobicContact CD1-CG2 3.84Å; V98-V142 HydrophobicContact CG2-CG1 4.05Å; V98-V142 HydrophobicContact CG2-CG2 3.65Å; Q140-V142 HydrophobicContact CG-CG2 4.17Å; V142-S154 WeakPolarHBondContact O-CA 3.02Å; V142-R155 PolarHBondContact N-O 3.33Å; V142-R155 PolarHBondContact O-N 2.9Å; V142-V157 HydrophobicContact CG2-CG2 3.95Å |
| 143 | Q | 94.5 | Very high | 91.7 | Very high | 137 Ų | 137 | 82.5 Ų | 82.5 | 64% | 0.64 | 46% | 0.459 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 130.1 | 175.1 | -61.5 | -178.3 | 18.3 | 0 | 0 | 109.7 | S94 A95 R153 | S94-Q143 WeakPolarHBondContact CA-O 3.4Å; A95-Q143 PolarHBondContact N-O 3.36Å; Q143-R153 CarbonylContact C-O 3.58Å; Q143-R153 WeakPolarHBondContact CA-O 3.44Å |
| 144 | L | 95 | Very high | 91.7 | Very high | 4 Ų | 4 | 84.2 Ų | 84.2 | 2% | 0.021 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110 | 131.7 | -179.8 | -56.8 | 174.9 | 0 | 0 | 0 | 108.7 | L87 D89 C92 P152 R153 R155 | L87-L144 HydrophobicContact CB-CD2 4.49Å; D89-L144 HydrophobicContact CB-CD1 3.66Å; C92-L144 HydrophobicContact CB-CB 4.08Å; L144-P152 CarbonylContact O-C 3.59Å; L144-P152 WeakPolarHBondContact O-CA 3.37Å; L144-R153 HydrophobicContact CB-CB 4.35Å; L144-R153 PolarHBondContact N-O 3.02Å; L144-R153 PolarHBondContact O-N 2.71Å; L144-R155 HydrophobicContact CD1-CB 3.93Å |
| 145 | L | 94.7 | Very high | 91.5 | Very high | 100 Ų | 100 | 87 Ų | 87 | 52% | 0.524 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.9 | 126.7 | 174.2 | -60.7 | 171.6 | 0 | 0 | 0 | 108 | C92 R93 A95 P152 | C92-L145 CarbonylContact C-O 3.56Å; C92-L145 VanDerWaalsContact CA-O 3.25Å; C92-L145 WeakPolarHBondContact CA-O 3.42Å; R93-L145 PolarHBondContact N-O 3.26Å; R93-L145 PolarHBondContact O-N 3.28Å; A95-L145 HydrophobicContact CB-CD1 3.68Å; A95-L145 HydrophobicContact CB-CG 4.08Å; L145-P152 HydrophobicContact CD2-CB 4.43Å |
| 146 | C | 92.6 | Very high | 91.6 | Very high | 21 Ų | 21 | 91.2 Ų | 91.2 | 14% | 0.142 | 49% | 0.494 | C | S | . | . | trans | -109 | 144.7 | -179.6 | -56.6 | 0 | 0 | 0 | 0 | 109.6 | C92 A150 | C92-C146 HydrophobicContact CB-CB 4Å; C92-C146 WeakPolarHBondContact CB-SG 3.11Å; C92-C146 WeakPolarHBondContact SG-CB 3.44Å; C92-C146 CovalentContact SG-SG 2.03Å; C92-C146 PolarHBondContact SG-SG 3.43Å; C146-A150 HydrophobicContact CB-CB 4.06Å | ||
| 147 | P | 92.1 | Very high | 91.5 | Very high | 88 Ų | 88 | 83.9 Ų | 83.9 | 57% | 0.571 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -66.2 | 157.7 | 173.6 | 28.3 | -34.4 | 0 | 0 | 0 | 111.2 | P91 | P91-P147 HydrophobicContact CB-CG 3.93Å; P91-P147 WeakPolarHBondContact O-CD 3.47Å |
| 148 | G | 86.6 | Confident | 91.5 | Very high | 84 Ų | 84 | 86.9 Ų | 86.9 | 87% | 0.866 | 48% | 0.478 | S | S | * | . | S | Bend | trans | 87.2 | 25.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | A150 | G148-A150 PolarHBondContact O-N 3.08Å; G148-A150 VanDerWaalsContact O-N 3.12Å |
| 149 | G | 78.4 | Confident | 91.5 | Very high | 85 Ų | 85 | 83.8 Ų | 83.8 | 88% | 0.876 | 47% | 0.468 | S | S | * | . | S | Bend | trans | 69.6 | 7.2 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||
| 150 | A | 82 | Confident | 91.6 | Very high | 49 Ų | 49 | 82.2 Ų | 82.2 | 41% | 0.405 | 45% | 0.452 | S | S | . | . | P | Polyproline II helix | trans | -63.7 | 139.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | C146 G148 | C146-A150 HydrophobicContact CB-CB 4.06Å; G148-A150 PolarHBondContact O-N 3.08Å; G148-A150 VanDerWaalsContact O-N 3.12Å |
| 151 | A | 86.8 | Confident | 91.6 | Very high | 77 Ų | 77 | 80.6 Ų | 80.6 | 64% | 0.636 | 45% | 0.45 | S | S | * | . | P | Polyproline II helix | trans | -55.8 | 146 | 179 | 0 | 0 | 0 | 0 | 0 | 111.8 | R153 | A151-R153 PolarHBondContact O-N 3.24Š|
| 152 | P | 89.3 | Confident | 91.6 | Very high | 86 Ų | 86 | 72.9 Ų | 72.9 | 56% | 0.558 | 42% | 0.424 | S | S | * | . | P | Polyproline II helix | trans | -60.9 | 131.2 | 179.3 | 25.3 | -33.8 | 0 | 0 | 0 | 110.6 | L144 L145 | L144-P152 CarbonylContact O-C 3.59Å; L144-P152 WeakPolarHBondContact O-CA 3.37Å; L145-P152 HydrophobicContact CD2-CB 4.43Å |
| 153 | R | 91.1 | Very high | 91.5 | Very high | 157 Ų | 157 | 73.3 Ų | 73.3 | 59% | 0.592 | 43% | 0.428 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -92.6 | 145.9 | 177.5 | -65.1 | -177.2 | -179.7 | -176.3 | -0.7 | 109.8 | Q143 L144 A151 | Q143-R153 CarbonylContact C-O 3.58Å; Q143-R153 WeakPolarHBondContact CA-O 3.44Å; L144-R153 HydrophobicContact CB-CB 4.35Å; L144-R153 PolarHBondContact N-O 3.02Å; L144-R153 PolarHBondContact O-N 2.71Å; A151-R153 PolarHBondContact O-N 3.24Å |
| 154 | S | 91.5 | Very high | 91.4 | Very high | 68 Ų | 68 | 71.2 Ų | 71.2 | 48% | 0.476 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 129 | 173.7 | 79.1 | 0 | 0 | 0 | 0 | 110.7 | R141 V142 | R141-S154 PolarHBondContact NH2-OG 3.15Å; V142-S154 WeakPolarHBondContact O-CA 3.02Å |
| 155 | R | 92 | Very high | 91.1 | Very high | 103 Ų | 103 | 73.9 Ų | 73.9 | 39% | 0.389 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.7 | 135.8 | 178.8 | -173.3 | 174.4 | 178.7 | -175.7 | 0.7 | 110.9 | D89 R141 V142 L144 V157 | D89-R155 IonicContact OD1-NH1 3.8Å; D89-R155 WeakPolarHBondContact OD2-CD 3.01Å; D89-R155 IonicContact OD2-CZ 3.54Å; D89-R155 IonicContact OD2-NE 2.81Å; D89-R155 IonicContact OD2-NH1 3.84Å; R141-R155 CarbonylContact C-O 3.57Å; R141-R155 WeakPolarHBondContact CA-O 3.46Å; V142-R155 PolarHBondContact N-O 3.33Å; V142-R155 PolarHBondContact O-N 2.9Å; L144-R155 HydrophobicContact CD1-CB 3.93Å; R155-V157 HydrophobicContact CG-CG1 4.46Å |
| 156 | K | 94.4 | Very high | 90.8 | Very high | 145 Ų | 145 | 73 Ų | 73 | 63% | 0.63 | 43% | 0.426 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93.8 | 118.6 | 174.3 | -171.5 | 176 | -178.7 | 176.1 | 0 | 109.3 | A139 Q140 R141 | A139-K156 VanDerWaalsContact CB-CE 3.45Å; A139-K156 HydrophobicContact CB-CG 4.35Å; Q140-K156 WeakPolarHBondContact O-CA 3.11Å; R141-K156 HydrophobicContact CG-CB 4.31Å; R141-K156 HydrophobicContact CG-CG 4.36Å |
| 157 | V | 93.5 | Very high | 90.4 | Very high | 18 Ų | 18 | 79 Ų | 79 | 11% | 0.109 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.2 | 143.9 | 175.1 | -67.3 | 0 | 0 | 0 | 0 | 110.2 | L87 A139 Q140 V142 R155 L159 | L87-V157 HydrophobicContact CD1-CG1 3.8Å; L87-V157 HydrophobicContact CD1-CG2 4.06Å; A139-V157 CarbonylContact C-O 3.49Å; A139-V157 WeakPolarHBondContact CA-O 3.05Å; Q140-V157 HydrophobicContact CB-CG2 4.22Å; Q140-V157 PolarHBondContact N-O 3.35Å; Q140-V157 WeakPolarHBondContact O-CG2 3.35Å; Q140-V157 PolarHBondContact O-N 3.27Å; V142-V157 HydrophobicContact CG2-CG2 3.95Å; R155-V157 HydrophobicContact CG-CG1 4.46Å; V157-L159 HydrophobicContact CG2-CD1 4.21Å; V157-L159 HydrophobicContact CG2-CD2 4.33Å; V157-L159 HydrophobicContact CG2-CG 4.16Å |
| 158 | R | 95.2 | Very high | 89.7 | Confident | 209 Ų | 209 | 76.3 Ų | 76.3 | 79% | 0.789 | 43% | 0.427 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -102.3 | 120.8 | 173.3 | -69.8 | -176.4 | 177.4 | -176.2 | -0.7 | 108.2 | ||
| 159 | L | 94.6 | Very high | 89.1 | Confident | 12 Ų | 12 | 75.1 Ų | 75.1 | 6% | 0.063 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 148.3 | -176.3 | -56.2 | 173 | 0 | 0 | 0 | 108.8 | V98 E100 Y137 R138 Q140 V157 | V98-L159 HydrophobicContact CG1-CD1 3.32Å; V98-L159 HydrophobicContact CG1-CD2 4.43Å; V98-L159 HydrophobicContact CG1-CG 4.46Å; E100-L159 HydrophobicContact CG-CD2 3.85Å; Y137-L159 CarbonylContact C-O 3.56Å; Y137-L159 VanDerWaalsContact CA-O 3.28Å; Y137-L159 WeakPolarHBondContact CA-O 3.03Å; R138-L159 HydrophobicContact CG-CB 4.09Å; R138-L159 PolarHBondContact N-O 3Å; R138-L159 PolarHBondContact O-N 3.42Å; Q140-L159 HydrophobicContact CB-CD1 4.29Å; V157-L159 HydrophobicContact CG2-CD1 4.21Å; V157-L159 HydrophobicContact CG2-CD2 4.33Å; V157-L159 HydrophobicContact CG2-CG 4.16Å |
| 160 | V | 95.9 | Very high | 88.9 | Confident | 23 Ų | 23 | 81.8 Ų | 81.8 | 14% | 0.139 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -66.6 | 137.4 | 171.5 | -175.4 | 0 | 0 | 0 | 0 | 108.5 | L101 P134 Y137 S162 | L101-V160 HydrophobicContact CB-CB 4.2Å; L101-V160 VanDerWaalsContact CB-O 3.3Å; L101-V160 WeakPolarHBondContact CB-O 3.36Å; L101-V160 HydrophobicContact CD2-CB 4.38Å; L101-V160 HydrophobicContact CD2-CG1 3.9Å; L101-V160 WeakPolarHBondContact O-CB 3.03Å; P134-V160 HydrophobicContact CB-CG1 3.86Å; P134-V160 HydrophobicContact CB-CG2 4.1Å; P134-V160 HydrophobicContact CG-CG1 4.4Å; P134-V160 HydrophobicContact CG-CG2 4.1Å; Y137-V160 HydrophobicContact CD1-CG2 4.13Å; Y137-V160 HydrophobicContact CE1-CG2 3.71Å; V160-S162 WeakPolarHBondContact CG1-O 3.4Å |
| 161 | A | 94.1 | Very high | 88.3 | Confident | 32 Ų | 32 | 86.7 Ų | 86.7 | 26% | 0.264 | 41% | 0.414 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.4 | -30.8 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | R136 R138 | R136-A161 HydrophobicContact CB-CB 4.23Å; R136-A161 PolarHBondContact O-N 3.26Å; R138-A161 HydrophobicContact CB-CB 3.97Å; R138-A161 HydrophobicContact CG-CB 4.05Å |
| 162 | S | 94 | Very high | 87.7 | Confident | 24 Ų | 24 | 85.9 Ų | 85.9 | 17% | 0.168 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.1 | 157.9 | 176.1 | 59 | 0 | 0 | 0 | 0 | 111.3 | E80 D135 R136 V160 | E80-S162 WeakPolarHBondContact OE1-CA 3.42Å; D135-S162 PolarHBondContact N-O 2.74Å; D135-S162 PolarHBondContact OD2-OG 3.26Å; R136-S162 WeakPolarHBondContact CB-OG 3.35Å; R136-S162 PolarHBondContact N-O 3.48Å; R136-S162 PolarHBondContact N-OG 3Å; R136-S162 PolarHBondContact O-N 3.01Å; V160-S162 WeakPolarHBondContact CG1-O 3.4Å |
| 163 | C | 93.6 | Very high | 86.6 | Confident | 18 Ų | 18 | 86.8 Ų | 86.8 | 12% | 0.122 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.9 | 152.6 | 177.3 | -56.7 | 0 | 0 | 0 | 0 | 111.4 | C78 E80 L101 C103 I133 | C78-C163 VanDerWaalsContact SG-CB 3.57Å; E80-C163 HydrophobicContact CG-CB 3.96Å; E80-C163 PolarHBondContact OE1-N 3.37Å; L101-C163 WeakPolarHBondContact CD2-SG 3.41Å; C103-C163 WeakPolarHBondContact CA-SG 3.21Å; C103-C163 HydrophobicContact CB-CB 3.72Å; C103-C163 WeakPolarHBondContact CB-SG 3.06Å; C103-C163 WeakPolarHBondContact SG-CB 3.16Å; C103-C163 CovalentContact SG-SG 2.01Å; C103-C163 PolarHBondContact SG-SG 3.35Å; I133-C163 WeakPolarHBondContact O-CA 3.1Å |
| 164 | K | 91.7 | Very high | 85.4 | Confident | 93 Ų | 93 | 86 Ų | 86 | 40% | 0.404 | 40% | 0.4 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.7 | 154.9 | 173.2 | 72.3 | -178.2 | 171.5 | -164.6 | 0 | 112.7 | I133 D135 K166 | I133-K164 HydrophobicContact CG1-CG 4.29Å; I133-K164 WeakPolarHBondContact CG1-O 3.27Å; I133-K164 PolarHBondContact N-O 3.3Å; I133-K164 PolarHBondContact O-N 3.39Å; D135-K164 HydrophobicContact CB-CB 4.11Å; D135-K164 HydrophobicContact CB-CD 3.79Å; D135-K164 HydrophobicContact CB-CG 3.81Å; D135-K164 VanDerWaalsContact OD1-CD 3.29Å; D135-K164 WeakPolarHBondContact OD1-CD 2.97Å; D135-K164 WeakPolarHBondContact OD1-CE 3.46Å; D135-K164 IonicContact OD1-NZ 3.93Å; D135-K164 PolarHBondContact OD1-NZ 3.44Å; K164-K166 PolarHBondContact O-N 3.13Å |
| 165 | C | 89.3 | Confident | 84.4 | Confident | 59 Ų | 59 | 87.6 Ų | 87.6 | 40% | 0.399 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.7 | 117 | 165.5 | -68.9 | 0 | 0 | 0 | 0 | 110 | C78 C107 | C78-C165 VanDerWaalsContact CB-SG 3.55Å; C107-C165 HydrophobicContact CB-CB 3.65Å; C107-C165 WeakPolarHBondContact CB-SG 3.25Å; C107-C165 WeakPolarHBondContact SG-CA 3.28Å; C107-C165 WeakPolarHBondContact SG-CB 3.44Å; C107-C165 CovalentContact SG-SG 2.04Å; C107-C165 PolarHBondContact SG-SG 3.47Å |
| 166 | K | 87.9 | Confident | 83.2 | Confident | 81 Ų | 81 | 90.3 Ų | 90.3 | 35% | 0.352 | 43% | 0.428 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.8 | 135.3 | 173.1 | -170.7 | -177.8 | -179.8 | -173.9 | 0 | 110 | R131 I133 K164 L168 H172 | R131-K166 PolarHBondContact N-O 3.2Å; R131-K166 PolarHBondContact O-N 3.09Å; I133-K166 HydrophobicContact CD1-CB 3.46Å; I133-K166 VanDerWaalsContact CD1-CB 3.46Å; I133-K166 HydrophobicContact CD1-CD 3.36Å; I133-K166 HydrophobicContact CD1-CG 4.01Å; I133-K166 HydrophobicContact CG1-CB 3.69Å; I133-K166 HydrophobicContact CG1-CD 4.5Å; K164-K166 PolarHBondContact O-N 3.13Å; K166-L168 PolarHBondContact O-N 3.07Å; K166-H172 PolarHBondContact NZ-NE2 2.98Å |
| 167 | R | 84.3 | Confident | 81.8 | Confident | 148 Ų | 148 | 90 Ų | 90 | 56% | 0.558 | 43% | 0.433 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -63.5 | 126.7 | 168.4 | 179 | 169.6 | 177.3 | 178.9 | 8.4 | 110.3 | P128 F130 T169 | P128-R167 HydrophobicContact CB-CG 3.82Å; F130-R167 HydrophobicContact CD1-CB 4.13Å; F130-R167 HydrophobicContact CE1-CB 3.85Å; F130-R167 HydrophobicContact CZ-CB 4.24Å; R167-T169 PolarHBondContact O-N 3.08Å |
| 168 | L | 77.7 | Confident | 80.2 | Confident | 31 Ų | 31 | 95.6 Ų | 95.6 | 16% | 0.162 | 46% | 0.456 | C | S | . | . | trans | -65.9 | 127.1 | 171.9 | -168.6 | 66.3 | 0 | 0 | 0 | 109 | D129 R131 K166 H172 | D129-L168 HydrophobicContact CB-CB 4.02Å; D129-L168 HydrophobicContact CB-CD2 3.92Å; D129-L168 WeakPolarHBondContact O-CA 3.45Å; D129-L168 WeakPolarHBondContact O-CB 3.09Å; D129-L168 PolarHBondContact O-N 3.2Å; R131-L168 VanDerWaalsContact CZ-CD1 3.4Å; K166-L168 PolarHBondContact O-N 3.07Å; L168-H172 HydrophobicContact CD1-CB 3.53Å | ||
| 169 | T | 74.4 | Confident | 78.5 | Confident | 59 Ų | 59 | 92 Ų | 92 | 36% | 0.362 | 45% | 0.452 | S | S | . | . | trans | -109.3 | 154.6 | 169 | 69.6 | 0 | 0 | 0 | 0 | 108.5 | R167 F171 H172 | R167-T169 PolarHBondContact O-N 3.08Å; T169-F171 PolarHBondContact O-N 2.84Å; T169-H172 PolarHBondContact N-ND1 2.99Å; T169-H172 WeakPolarHBondContact O-CB 3.31Å; T169-H172 PolarHBondContact O-N 2.85Å; T169-H172 PolarHBondContact O-ND1 2.66Å; T169-H172 PolarHBondContact OG1-CE1 2.81Å; T169-H172 PolarHBondContact OG1-ND1 2.62Å | ||
| 170 | R | 72.9 | Confident | 76.7 | Confident | 225 Ų | 225 | 100.4 Ų | 100.4 | 85% | 0.849 | 49% | 0.488 | S | S | * | . | G | 310 helix | trans | -51.6 | -32.8 | -178.6 | -70 | -174.1 | -177 | -179.6 | 0.6 | 113.7 | H172 N173 | R170-H172 PolarHBondContact O-N 2.95Å; R170-N173 PolarHBondContact O-N 3.18Å; R170-N173 VanDerWaalsContact O-N 3.13Å |
| 171 | F | 71.4 | Confident | 75.2 | Confident | 152 Ų | 152 | 101.6 Ų | 101.6 | 67% | 0.667 | 51% | 0.506 | S | S | * | . | G | 310 helix | trans | -58 | -28.4 | 176.2 | -67.7 | -75.2 | 0 | 0 | 0 | 113.9 | T169 N173 Q174 | T169-F171 PolarHBondContact O-N 2.84Å; F171-N173 VanDerWaalsContact C-N 3.29Å; F171-N173 PolarHBondContact O-N 2.74Å; F171-Q174 PolarHBondContact O-N 2.74Å |
| 172 | H | 73.1 | Confident | 73.6 | Confident | 61 Ų | 61 | 105.6 Ų | 105.6 | 28% | 0.282 | 53% | 0.529 | S | S | . | . | G | 310 helix | trans | -79.8 | -10.1 | -179.2 | -60.6 | 98.5 | 0 | 0 | 0 | 114.1 | R131 K166 L168 T169 R170 | R131-H172 PolarHBondContact NH2-CD2 3.25Å; R131-H172 VanDerWaalsContact NH2-CG 3.3Å; K166-H172 PolarHBondContact NZ-NE2 2.98Å; L168-H172 HydrophobicContact CD1-CB 3.53Å; T169-H172 PolarHBondContact N-ND1 2.99Å; T169-H172 WeakPolarHBondContact O-CB 3.31Å; T169-H172 PolarHBondContact O-N 2.85Å; T169-H172 PolarHBondContact O-ND1 2.66Å; T169-H172 PolarHBondContact OG1-CE1 2.81Å; T169-H172 PolarHBondContact OG1-ND1 2.62Å; R170-H172 PolarHBondContact O-N 2.95Å |
| 173 | N | 67 | Low | 71.7 | Confident | 105 Ų | 105 | 113.8 Ų | 113.8 | 56% | 0.561 | 56% | 0.564 | S | S | * | * | G | 310 helix | trans | -100.4 | 8.6 | 175.3 | -68.6 | -7.5 | 0 | 0 | 0 | 111.7 | R170 F171 S175 | R170-N173 PolarHBondContact O-N 3.18Å; R170-N173 VanDerWaalsContact O-N 3.13Å; F171-N173 VanDerWaalsContact C-N 3.29Å; F171-N173 PolarHBondContact O-N 2.74Å; N173-S175 PolarHBondContact O-N 3.34Å |
| 174 | Q | 66.2 | Low | 69.9 | Low | 139 Ų | 139 | 118.5 Ų | 118.5 | 65% | 0.65 | 59% | 0.593 | S | S | * | * | trans | -71.7 | 87 | 170.7 | -67.6 | 178.7 | -8.1 | 0 | 0 | 107.8 | F171 E176 | F171-Q174 PolarHBondContact O-N 2.74Å; Q174-E176 PolarHBondContact O-N 3.26Å | ||
| 175 | S | 69.6 | Low | 68.2 | Low | 102 Ų | 102 | 118.6 Ų | 118.6 | 71% | 0.713 | 61% | 0.611 | S | S | * | * | trans | -73.8 | 108.1 | 162.4 | 55.3 | 0 | 0 | 0 | 0 | 107 | N173 L177 | N173-S175 PolarHBondContact O-N 3.34Å; S175-L177 PolarHBondContact O-N 3.38Å | ||
| 176 | E | 67.2 | Low | 66.7 | Low | 161 Ų | 161 | 126.8 Ų | 126.8 | 75% | 0.752 | 63% | 0.633 | S | S | * | * | trans | -64.1 | 93.6 | 149.5 | -68.3 | 179.7 | -170.8 | 0 | 0 | 105.4 | Q174 K178 | Q174-E176 PolarHBondContact O-N 3.26Å; E176-K178 PolarHBondContact O-N 2.98Å | ||
| 177 | L | 65 | Low | 65.2 | Low | 137 Ų | 137 | 128.6 Ų | 128.6 | 72% | 0.717 | 65% | 0.654 | S | S | * | * | trans | -64.4 | 92.7 | 162.9 | -170.6 | 73 | 0 | 0 | 0 | 104.5 | S175 D179 | S175-L177 PolarHBondContact O-N 3.38Å; L177-D179 PolarHBondContact O-N 3.47Å | ||
| 178 | K | 59.1 | Low | 63.8 | Low | 136 Ų | 136 | 131 Ų | 131 | 59% | 0.591 | 67% | 0.671 | S | S | * | * | trans | -67 | 95.1 | 169.7 | -80.2 | -176.7 | 175.2 | 179.6 | 0 | 105.5 | E176 F180 | E176-K178 PolarHBondContact O-N 2.98Å; K178-F180 HydrophobicContact CB-CD2 4.28Å; K178-F180 HydrophobicContact CB-CE1 4.44Å; K178-F180 HydrophobicContact CB-CE2 3.88Å; K178-F180 HydrophobicContact CB-CZ 3.97Å; K178-F180 HydrophobicContact CD-CE1 4.46Å; K178-F180 HydrophobicContact CD-CZ 4.12Å; K178-F180 VanDerWaalsContact O-CD2 3.29Å; K178-F180 WeakPolarHBondContact O-CD2 3.47Å; K178-F180 PolarHBondContact O-N 2.9Å | ||
| 179 | D | 59.5 | Low | 62.7 | Low | 134 Ų | 134 | 139.3 Ų | 139.3 | 72% | 0.717 | 71% | 0.706 | S | S | * | * | trans | -61.8 | 95.2 | 162.1 | -67.7 | -36.9 | 0 | 0 | 0 | 106.1 | L177 G181 | L177-D179 PolarHBondContact O-N 3.47Å; D179-G181 PolarHBondContact O-N 2.96Å | ||
| 180 | F | 58 | Low | 61.6 | Low | 188 Ų | 188 | 140 Ų | 140 | 83% | 0.825 | 73% | 0.725 | S | S | * | * | trans | -71.8 | 43.5 | 166.8 | -63.3 | -79 | 0 | 0 | 0 | 110.1 | K178 | K178-F180 HydrophobicContact CB-CD2 4.28Å; K178-F180 HydrophobicContact CB-CE1 4.44Å; K178-F180 HydrophobicContact CB-CE2 3.88Å; K178-F180 HydrophobicContact CB-CZ 3.97Å; K178-F180 HydrophobicContact CD-CE1 4.46Å; K178-F180 HydrophobicContact CD-CZ 4.12Å; K178-F180 VanDerWaalsContact O-CD2 3.29Å; K178-F180 WeakPolarHBondContact O-CD2 3.47Å; K178-F180 PolarHBondContact O-N 2.9Å | ||
| 181 | G | 64.1 | Low | 60.6 | Low | 49 Ų | 49 | 141.1 Ų | 141.1 | 51% | 0.505 | 73% | 0.729 | S | S | . | * | trans | -65.6 | 140.2 | 168.6 | 0 | 0 | 0 | 0 | 0 | 108.5 | D179 E183 | D179-G181 PolarHBondContact O-N 2.96Å; G181-E183 PolarHBondContact O-N 2.81Å; G181-E183 VanDerWaalsContact O-N 3.1Å | ||
| 182 | P | 59.3 | Low | 60.1 | Low | 115 Ų | 115 | 143.3 Ų | 143.3 | 75% | 0.747 | 74% | 0.738 | S | S | * | * | trans | -55.6 | 124.3 | 174.6 | 23.7 | -31.5 | 0 | 0 | 0 | 108 | T184 | P182-T184 PolarHBondContact O-N 3.01Š| ||
| 183 | E | 53.8 | Low | 59.4 | Low | 196 Ų | 196 | 146.3 Ų | 146.3 | 92% | 0.916 | 76% | 0.764 | S | S | * | * | trans | -58.1 | 88.6 | 175.5 | -174.3 | 172.6 | 173.8 | 0 | 0 | 108.4 | G181 A185 | G181-E183 PolarHBondContact O-N 2.81Å; G181-E183 VanDerWaalsContact O-N 3.1Å; E183-A185 PolarHBondContact O-N 2.91Å | ||
| 184 | T | 57.3 | Low | 59 | Low | 118 Ų | 118 | 153.1 Ų | 153.1 | 72% | 0.724 | 78% | 0.781 | S | S | * | * | trans | -74.5 | 112 | 171.5 | 43.9 | 0 | 0 | 0 | 0 | 106.3 | P182 R186 | P182-T184 PolarHBondContact O-N 3.01Å; T184-R186 PolarHBondContact O-N 2.95Å | ||
| 185 | A | 55.1 | Low | 58.6 | Low | 94 Ų | 94 | 152.4 Ų | 152.4 | 78% | 0.777 | 79% | 0.789 | S | S | * | * | trans | -49.5 | 106.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | E183 | E183-A185 PolarHBondContact O-N 2.91Š| ||
| 186 | R | 58.6 | Low | 57.5 | Low | 231 Ų | 231 | 151.5 Ų | 151.5 | 87% | 0.872 | 80% | 0.795 | S | S | * | * | trans | -68 | 126.7 | 170.7 | -90 | -178 | 173.5 | 179.3 | -0.2 | 108.4 | T184 Q188 | T184-R186 PolarHBondContact O-N 2.95Å; R186-Q188 PolarHBondContact O-N 3.29Å | ||
| 187 | P | 56.3 | Low | 56.8 | Low | 120 Ų | 120 | 148.9 Ų | 148.9 | 78% | 0.779 | 80% | 0.801 | S | S | * | * | trans | -67.2 | 129.7 | 174.5 | 25.8 | -30.9 | 0 | 0 | 0 | 110 | K189 | P187-K189 PolarHBondContact O-N 3.32Š| ||
| 188 | Q | 54.8 | Low | 56.1 | Low | 199 Ų | 199 | 154.5 Ų | 154.5 | 93% | 0.93 | 81% | 0.813 | S | S | * | * | trans | -64.1 | 104.3 | 172 | -73.3 | -173.5 | -0.6 | 0 | 0 | 109.7 | R186 G190 | R186-Q188 PolarHBondContact O-N 3.29Å; Q188-G190 PolarHBondContact O-N 3.45Å | ||
| 189 | K | 54.9 | Low | 55.6 | Low | 204 Ų | 204 | 151.9 Ų | 151.9 | 89% | 0.887 | 83% | 0.825 | S | S | * | * | trans | -81.7 | 107.4 | 164.9 | -109.2 | 178.1 | 178.4 | 177 | 0 | 108.7 | P187 R191 | P187-K189 PolarHBondContact O-N 3.32Å; K189-R191 PolarHBondContact O-N 2.99Å | ||
| 190 | G | 50.1 | Low | 55.2 | Low | 74 Ų | 74 | 150.3 Ų | 150.3 | 76% | 0.763 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 131.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q188 | Q188-G190 PolarHBondContact O-N 3.45Š|
| 191 | R | 52.1 | Low | 54.8 | Low | 248 Ų | 248 | 151.6 Ų | 151.6 | 94% | 0.936 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 122.4 | 168.8 | -74.6 | -176.8 | 173.4 | -169.8 | -1.6 | 108.8 | K189 | K189-R191 PolarHBondContact O-N 2.99Š|
| 192 | K | 60.7 | Low | 54.4 | Low | 198 Ų | 198 | 153.4 Ų | 153.4 | 86% | 0.861 | 85% | 0.845 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 137.2 | 165.4 | -74.9 | -177.3 | 175.9 | -177.1 | 0 | 109.4 | ||
| 193 | P | 58.1 | Low | 54.3 | Low | 125 Ų | 125 | 155.2 Ų | 155.2 | 81% | 0.812 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -74.3 | 132.8 | 173 | 20.9 | -14.2 | 0 | 0 | 0 | 110 | ||
| 194 | R | 59.4 | Low | 54.5 | Low | 247 Ų | 247 | 154.1 Ų | 154.1 | 93% | 0.932 | 84% | 0.844 | S | S | * | * | P | Polyproline II helix | trans | -88 | 128.9 | 169.2 | -101 | -178.9 | 159.9 | 177.8 | -5.6 | 108.8 | ||
| 195 | P | 58.2 | Low | 54.6 | Low | 124 Ų | 124 | 152.2 Ų | 152.2 | 81% | 0.805 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 142 | 175.5 | 30.2 | -29.2 | 0 | 0 | 0 | 110.5 | ||
| 196 | G | 46.1 | Very low | 54.6 | Low | 83 Ų | 83 | 156 Ų | 156 | 86% | 0.856 | 84% | 0.842 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 144.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 197 | A | 52.6 | Low | 54.6 | Low | 106 Ų | 106 | 151.2 Ų | 151.2 | 88% | 0.876 | 83% | 0.832 | S | S | * | * | trans | -132.7 | 130 | 165.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 198 | R | 50.6 | Low | 54.4 | Low | 256 Ų | 256 | 153.6 Ų | 153.6 | 97% | 0.966 | 83% | 0.833 | S | S | * | * | trans | -72.1 | 145.5 | 179.9 | -67.7 | 170.7 | 174 | -180 | -3.2 | 110.5 | ||||
| 199 | G | 48.4 | Very low | 54.3 | Low | 81 Ų | 81 | 151.8 Ų | 151.8 | 84% | 0.835 | 83% | 0.83 | S | S | * | * | trans | -158.7 | 93.2 | 166.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 200 | A | 49.9 | Very low | 54.2 | Low | 100 Ų | 100 | 146.8 Ų | 146.8 | 83% | 0.826 | 83% | 0.827 | S | S | * | * | trans | -81.4 | 142.4 | 178 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 201 | K | 51.5 | Low | 54.5 | Low | 215 Ų | 215 | 158 Ų | 158 | 94% | 0.935 | 85% | 0.848 | S | S | * | * | trans | -165.8 | 137 | 132.1 | -110.7 | 171.1 | -178.8 | -179.4 | 0 | 111 | ||||
| 202 | A | 53.8 | Low | 54.6 | Low | 87 Ų | 87 | 153.5 Ų | 153.5 | 72% | 0.719 | 84% | 0.844 | S | S | * | * | trans | -86.9 | 164.4 | -172.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 203 | N | 58.6 | Low | 54.3 | Low | 153 Ų | 153 | 151.2 Ų | 151.2 | 82% | 0.818 | 84% | 0.843 | S | S | * | * | trans | 153.5 | 135.3 | 147 | -80.6 | -12.3 | 0 | 0 | 0 | 106.9 | ||||
| 204 | Q | 58.5 | Low | 54.1 | Low | 173 Ų | 173 | 152.6 Ų | 152.6 | 81% | 0.808 | 85% | 0.845 | S | S | * | * | cis | -169.7 | 148.5 | -3.6 | -179.8 | 171.8 | 13.9 | 0 | 0 | 106.7 | ||||
| 205 | A | 57.5 | Low | 53.8 | Low | 78 Ų | 78 | 147.1 Ų | 147.1 | 65% | 0.645 | 84% | 0.839 | S | S | * | * | trans | 33.6 | 124.2 | 155.8 | 0 | 0 | 0 | 0 | 0 | 121 | ||||
| 206 | E | 55.3 | Low | 53.5 | Low | 175 Ų | 175 | 148.5 Ų | 148.5 | 82% | 0.818 | 84% | 0.842 | S | S | * | * | 66.3 | 109.6 | 75 | -148.5 | -169.7 | 155.4 | 0 | 0 | 110.9 | |||||
| 207 | L | 59 | Low | 54 | Low | 129 Ų | 129 | 152.9 Ų | 152.9 | 68% | 0.675 | 84% | 0.841 | S | S | * | * | 179.4 | 147.5 | 87.9 | -146 | 73.3 | 0 | 0 | 0 | 103.3 | |||||
| 208 | E | 52.9 | Low | 54.1 | Low | 171 Ų | 171 | 156.2 Ų | 156.2 | 80% | 0.799 | 84% | 0.838 | S | S | * | * | 179.9 | 133.9 | 56.3 | -159.5 | 168.2 | 154.2 | 0 | 0 | 107.3 | |||||
| 209 | N | 51.4 | Low | 54.3 | Low | 160 Ų | 160 | 148.5 Ų | 148.5 | 86% | 0.856 | 83% | 0.828 | S | S | * | * | trans | -75.2 | 150.8 | 171.5 | -72.1 | -41.3 | 0 | 0 | 0 | 110.3 | ||||
| 210 | A | 54.1 | Low | 54.8 | Low | 99 Ų | 99 | 154.2 Ų | 154.2 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | trans | -165.8 | 119.3 | 138 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 211 | Y | 55.5 | Low | 55.3 | Low | 310 Ų | 310 | 159.1 Ų | 159.1 | 100% | 1.216 | 83% | 0.828 | S | S | * | * | trans | 64.3 | 0 | 163.8 | -107.8 | -92 | 0 | 0 | 0 | 120.9 |
Retrieved 211 of 211 residues in 316.8 ms
(Link to these results)