| 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 | 38.2 | Very low | 41.6 | Very low | 249 Ų | 249 | 160.6 Ų | 160.6 | 100% | 1.227 | 81% | 0.811 | S | S | * | * | 0 | 115.6 | 0 | -68.6 | 167.5 | 179.1 | 0 | 0 | 107.2 | |||||
| 2 | K | 39 | Very low | 42.2 | Very low | 208 Ų | 208 | 154.8 Ų | 154.8 | 90% | 0.904 | 79% | 0.792 | S | S | * | * | trans | -88.7 | 124 | -178.8 | -75.5 | -176.6 | 176.8 | 178.4 | 0 | 108.7 | ||||
| 3 | Y | 39.5 | Very low | 42.6 | Very low | 218 Ų | 218 | 155 Ų | 155 | 86% | 0.855 | 79% | 0.787 | S | S | * | * | trans | -74.4 | 124.8 | 176 | -151.3 | -95.4 | 0 | 0 | 0 | 108.8 | ||||
| 4 | V | 45.6 | Very low | 42.8 | Very low | 117 Ų | 117 | 155.5 Ų | 155.5 | 71% | 0.709 | 79% | 0.792 | S | S | * | * | trans | -98.7 | 114.9 | 174 | 175.9 | 0 | 0 | 0 | 0 | 107.2 | E6 | V4-E6 PolarHBondContact O-N 3.48Š| ||
| 5 | P | 47.5 | Very low | 43 | Very low | 99 Ų | 99 | 156.7 Ų | 156.7 | 64% | 0.643 | 80% | 0.799 | S | S | * | * | trans | -79.3 | 109.3 | 171.4 | -8.9 | 26.4 | 0 | 0 | 0 | 109.2 | V7 | P5-V7 PolarHBondContact O-N 3Š| ||
| 6 | E | 41.9 | Very low | 42.9 | Very low | 158 Ų | 158 | 157.4 Ų | 157.4 | 74% | 0.738 | 80% | 0.795 | S | S | * | * | trans | -67.6 | 116.6 | 163.7 | -67.3 | -149.6 | 132.9 | 0 | 0 | 109.6 | V4 | V4-E6 PolarHBondContact O-N 3.48Š| ||
| 7 | V | 41 | Very low | 43.2 | Very low | 140 Ų | 140 | 157.2 Ų | 157.2 | 85% | 0.848 | 79% | 0.791 | S | S | * | * | trans | -94.6 | 98.4 | 171.9 | -178.1 | 0 | 0 | 0 | 0 | 108.8 | P5 | P5-V7 PolarHBondContact O-N 3Š| ||
| 8 | K | 39 | Very low | 43.1 | Very low | 171 Ų | 171 | 158.6 Ų | 158.6 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | trans | -82.5 | 130.2 | 171.2 | -78.6 | -178.5 | 176 | 176.2 | 0 | 111.7 | ||||
| 9 | K | 41.6 | Very low | 43.3 | Very low | 205 Ų | 205 | 155.8 Ų | 155.8 | 89% | 0.891 | 78% | 0.784 | S | S | * | * | trans | 66.8 | 142.8 | 155.6 | -83 | 169.8 | 173.1 | 174.1 | 0 | 117.6 | ||||
| 10 | S | 38.5 | Very low | 43.6 | Very low | 101 Ų | 101 | 153.1 Ų | 153.1 | 71% | 0.706 | 78% | 0.775 | S | S | * | * | cis | -148.7 | 166.3 | 37.3 | 56.5 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 11 | P | 46.1 | Very low | 44.1 | Very low | 101 Ų | 101 | 148.9 Ų | 148.9 | 66% | 0.656 | 76% | 0.759 | S | S | * | * | trans | -70.2 | 128.5 | -175.5 | -12.3 | 27.5 | 0 | 0 | 0 | 112.7 | H13 | P11-H13 PolarHBondContact O-N 2.77Š| ||
| 12 | P | 49 | Very low | 44.4 | Very low | 90 Ų | 90 | 141.4 Ų | 141.4 | 58% | 0.584 | 72% | 0.724 | S | S | * | * | trans | -96.6 | 44 | -171.2 | 39.1 | -35.5 | 0 | 0 | 0 | 112.5 | ||||
| 13 | H | 46.9 | Very low | 45.4 | Very low | 158 Ų | 158 | 135.7 Ų | 135.7 | 73% | 0.731 | 70% | 0.703 | S | S | * | * | trans | -89 | -2.3 | -164.6 | -73.7 | -76.2 | 0 | 0 | 0 | 116.8 | P11 | P11-H13 PolarHBondContact O-N 2.77Š| ||
| 14 | L | 46 | Very low | 46.1 | Very low | 162 Ų | 162 | 129.8 Ų | 129.8 | 85% | 0.848 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -128.4 | -3.2 | -169.4 | -69.8 | 178.3 | 0 | 0 | 0 | 118 | ||
| 15 | L | 45.8 | Very low | 46.2 | Very low | 173 Ų | 173 | 130.3 Ų | 130.3 | 91% | 0.906 | 69% | 0.689 | S | S | * | * | S | Bend | trans | -134.6 | 27.6 | 175.9 | -73.7 | 169.2 | 0 | 0 | 0 | 113 | Q17 | L15-Q17 VanDerWaalsContact C-N 3.26Å; L15-Q17 PolarHBondContact O-N 2.89Å |
| 16 | K | 40.8 | Very low | 46.3 | Very low | 169 Ų | 169 | 133.8 Ų | 133.8 | 74% | 0.735 | 70% | 0.697 | S | S | * | * | trans | -96.1 | 39.1 | 171.3 | -151.2 | -179.5 | -174.2 | -175.5 | 0 | 109.8 | F18 | K16-F18 VanDerWaalsContact C-N 3.28Å; K16-F18 PolarHBondContact O-N 3.41Å | ||
| 17 | Q | 47.6 | Very low | 46.8 | Very low | 154 Ų | 154 | 131.8 Ų | 131.8 | 72% | 0.72 | 69% | 0.691 | S | S | * | * | trans | -73.4 | 92.2 | 173.9 | -95.3 | -176.8 | -26.4 | 0 | 0 | 108.3 | L15 T19 | L15-Q17 VanDerWaalsContact C-N 3.26Å; L15-Q17 PolarHBondContact O-N 2.89Å; Q17-T19 PolarHBondContact O-N 3.44Å | ||
| 18 | F | 42.5 | Very low | 47.7 | Very low | 182 Ų | 182 | 128.3 Ų | 128.3 | 80% | 0.798 | 67% | 0.667 | S | S | * | * | S | Bend | trans | 63.5 | 31.5 | 152.1 | -46.5 | -71.3 | 0 | 0 | 0 | 118.2 | K16 V20 | K16-F18 VanDerWaalsContact C-N 3.28Å; K16-F18 PolarHBondContact O-N 3.41Å; F18-V20 PolarHBondContact O-N 2.93Å |
| 19 | T | 46.7 | Very low | 48.7 | Very low | 105 Ų | 105 | 122.2 Ų | 122.2 | 64% | 0.644 | 65% | 0.645 | S | S | * | * | trans | -96.1 | 81 | 159.5 | 48 | 0 | 0 | 0 | 0 | 108.8 | Q17 | Q17-T19 PolarHBondContact O-N 3.44Š| ||
| 20 | V | 49.3 | Very low | 49.5 | Very low | 102 Ų | 102 | 115.5 Ų | 115.5 | 62% | 0.618 | 62% | 0.619 | S | S | * | * | trans | -75.2 | 128.7 | 159.4 | -179.7 | 0 | 0 | 0 | 0 | 105.2 | F18 D22 | F18-V20 PolarHBondContact O-N 2.93Å; V20-D22 HydrophobicContact CG1-CB 4.44Å; V20-D22 PolarHBondContact O-N 2.9Å | ||
| 21 | C | 52.8 | Low | 50.5 | Low | 65 Ų | 65 | 117.7 Ų | 117.7 | 44% | 0.439 | 61% | 0.613 | S | S | . | * | trans | -71.8 | 72.5 | 167 | -50.1 | 0 | 0 | 0 | 0 | 106.3 | I23 C44 | C21-I23 PolarHBondContact O-N 3.46Å; C21-C44 HydrophobicContact CB-CB 3.75Å; C21-C44 WeakPolarHBondContact CB-SG 3.5Å; C21-C44 WeakPolarHBondContact SG-CB 3.35Å; C21-C44 CovalentContact SG-SG 2.05Å; C21-C44 PolarHBondContact SG-SG 2.95Å | ||
| 22 | D | 45.8 | Very low | 51.1 | Low | 91 Ų | 91 | 120.8 Ų | 120.8 | 49% | 0.487 | 62% | 0.624 | S | S | . | * | trans | -72.6 | 100.5 | 173.3 | -90.3 | -41.6 | 0 | 0 | 0 | 106.8 | V20 | V20-D22 HydrophobicContact CG1-CB 4.44Å; V20-D22 PolarHBondContact O-N 2.9Å | ||
| 23 | I | 58.8 | Low | 52 | Low | 88 Ų | 88 | 117 Ų | 117 | 45% | 0.451 | 60% | 0.599 | S | S | . | * | trans | -63 | 106.5 | 164.1 | -57.3 | 111.9 | 0 | 0 | 0 | 105.6 | C21 Y46 | C21-I23 PolarHBondContact O-N 3.46Å; I23-Y46 HydrophobicContact CD1-CD1 3.68Å; I23-Y46 HydrophobicContact CD1-CD2 4.18Å; I23-Y46 HydrophobicContact CD1-CE1 3.73Å; I23-Y46 HydrophobicContact CD1-CE2 4.26Å; I23-Y46 HydrophobicContact CD1-CG 3.89Å; I23-Y46 HydrophobicContact CG1-CD1 4.27Å | ||
| 24 | P | 54.7 | Low | 53.3 | Low | 94 Ų | 94 | 113 Ų | 113 | 61% | 0.61 | 59% | 0.589 | S | S | * | * | -151.7 | 164.7 | 93.4 | 36.7 | -17 | 0 | 0 | 0 | 114.5 | |||||
| 25 | L | 47.6 | Very low | 54.3 | Low | 128 Ų | 128 | 113.9 Ų | 113.9 | 67% | 0.67 | 58% | 0.581 | S | S | * | * | S | Bend | trans | 97.2 | 83 | 178.7 | -67.6 | 82.6 | 0 | 0 | 0 | 116.5 | D27 | L25-D27 PolarHBondContact O-N 2.86Š|
| 26 | H | 49.3 | Very low | 55.6 | Low | 173 Ų | 173 | 111.5 Ų | 111.5 | 80% | 0.801 | 57% | 0.569 | S | S | * | * | trans | 37 | 67.7 | 134.7 | -53.3 | 92.3 | 0 | 0 | 0 | 119.3 | ||||
| 27 | D | 53.7 | Low | 57.1 | Low | 115 Ų | 115 | 110.4 Ų | 110.4 | 62% | 0.615 | 56% | 0.56 | S | S | * | * | trans | -151.9 | 119.2 | 137.4 | -89.6 | -37.5 | 0 | 0 | 0 | 109.6 | L25 E52 | L25-D27 PolarHBondContact O-N 2.86Å; D27-E52 PolarHBondContact O-N 2.96Å | ||
| 28 | I | 59.3 | Low | 58.3 | Low | 67 Ų | 67 | 103.1 Ų | 103.1 | 34% | 0.344 | 53% | 0.526 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.4 | 122.6 | 175.3 | -62.5 | 96.3 | 0 | 0 | 0 | 107.2 | Y31 V49 | I28-Y31 HydrophobicContact CB-CD2 4.47Å; I28-Y31 HydrophobicContact CB-CE1 4.44Å; I28-Y31 HydrophobicContact CB-CE2 3.82Å; I28-Y31 HydrophobicContact CD1-CE2 4.29Å; I28-Y31 WeakPolarHBondContact CD1-OH 3.22Å; I28-Y31 HydrophobicContact CG1-CE1 4Å; I28-Y31 HydrophobicContact CG1-CE2 4.04Å; I28-Y31 VanDerWaalsContact CG1-OH 3.28Å; I28-Y31 WeakPolarHBondContact CG1-OH 3.41Å; I28-Y31 HydrophobicContact CG2-CD1 4.05Å; I28-Y31 HydrophobicContact CG2-CD2 3.68Å; I28-Y31 HydrophobicContact CG2-CE1 3.87Å; I28-Y31 HydrophobicContact CG2-CE2 3.5Å; I28-Y31 VanDerWaalsContact CG2-CE2 3.5Å; I28-Y31 HydrophobicContact CG2-CG 3.98Å; I28-V49 HydrophobicContact CG2-CG1 4.22Å |
| 29 | C | 61.2 | Low | 59.7 | Low | 43 Ų | 43 | 102.4 Ų | 102.4 | 29% | 0.291 | 52% | 0.523 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.9 | -52.1 | 174.7 | -74.1 | 0 | 0 | 0 | 0 | 111.1 | C43 C50 E52 | C29-C43 HydrophobicContact CB-CB 3.94Å; C29-C43 WeakPolarHBondContact CB-SG 3.32Å; C29-C43 WeakPolarHBondContact SG-CB 3.41Å; C29-C43 CovalentContact SG-SG 2.06Å; C29-C43 PolarHBondContact SG-SG 3.34Å; C29-C50 PolarHBondContact N-O 3.29Å; C29-C50 VanDerWaalsContact N-O 3.1Å; C29-E52 WeakPolarHBondContact SG-CA 3.32Å; C29-E52 VanDerWaalsContact SG-CB 3.51Å; C29-E52 PolarHBondContact SG-N 2.93Å; C29-E52 VanDerWaalsContact SG-N 3.44Å |
| 30 | D | 57.6 | Low | 61.2 | Low | 65 Ų | 65 | 105.5 Ų | 105.5 | 35% | 0.348 | 53% | 0.53 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -164.8 | 143.6 | 179.9 | -154.2 | -11.5 | 0 | 0 | 0 | 110.7 | V33 C50 | D30-V33 HydrophobicContact CB-CG1 3.87Å; D30-V33 HydrophobicContact CB-CG2 4.2Å; D30-V33 WeakPolarHBondContact OD2-CG1 3.25Å; D30-C50 VanDerWaalsContact O-CB 3.31Å; D30-C50 WeakPolarHBondContact O-CB 3.37Å |
| 31 | Y | 58.3 | Low | 62.1 | Low | 146 Ų | 146 | 105.1 Ų | 105.1 | 57% | 0.573 | 52% | 0.524 | S | S | * | . | S | Bend | trans | -96 | 145.4 | 176.9 | -67.7 | -84.7 | 0 | 0 | 0 | 109.8 | I28 V33 V49 | I28-Y31 HydrophobicContact CB-CD2 4.47Å; I28-Y31 HydrophobicContact CB-CE1 4.44Å; I28-Y31 HydrophobicContact CB-CE2 3.82Å; I28-Y31 HydrophobicContact CD1-CE2 4.29Å; I28-Y31 WeakPolarHBondContact CD1-OH 3.22Å; I28-Y31 HydrophobicContact CG1-CE1 4Å; I28-Y31 HydrophobicContact CG1-CE2 4.04Å; I28-Y31 VanDerWaalsContact CG1-OH 3.28Å; I28-Y31 WeakPolarHBondContact CG1-OH 3.41Å; I28-Y31 HydrophobicContact CG2-CD1 4.05Å; I28-Y31 HydrophobicContact CG2-CD2 3.68Å; I28-Y31 HydrophobicContact CG2-CE1 3.87Å; I28-Y31 HydrophobicContact CG2-CE2 3.5Å; I28-Y31 VanDerWaalsContact CG2-CE2 3.5Å; I28-Y31 HydrophobicContact CG2-CG 3.98Å; Y31-V33 PolarHBondContact O-N 3.11Å; Y31-V49 HydrophobicContact CD1-CG1 4.36Å; Y31-V49 HydrophobicContact CE1-CG1 4.35Å |
| 32 | N | 59.2 | Low | 62.9 | Low | 166 Ų | 166 | 103.7 Ų | 103.7 | 89% | 0.888 | 52% | 0.52 | S | S | * | . | S | Bend | trans | 62.8 | 29.5 | 177.6 | -68.4 | -26.9 | 0 | 0 | 0 | 116.4 | ||
| 33 | V | 68.9 | Low | 64.3 | Low | 12 Ų | 12 | 100.1 Ų | 100.1 | 7% | 0.073 | 50% | 0.502 | C | S | . | . | trans | -90.8 | 143.5 | 169.8 | -69.9 | 0 | 0 | 0 | 0 | 111.9 | D30 Y31 R37 C38 C50 | D30-V33 HydrophobicContact CB-CG1 3.87Å; D30-V33 HydrophobicContact CB-CG2 4.2Å; D30-V33 WeakPolarHBondContact OD2-CG1 3.25Å; Y31-V33 PolarHBondContact O-N 3.11Å; V33-R37 HydrophobicContact CB-CB 4.38Å; V33-C38 HydrophobicContact CG2-CB 4.02Å; V33-C50 HydrophobicContact CG2-CB 3.56Å | ||
| 34 | S | 72.9 | Confident | 65 | Low | 72 Ų | 72 | 96.6 Ų | 96.6 | 50% | 0.503 | 49% | 0.485 | S | S | . | . | trans | -63.2 | 154.2 | 171.9 | 67.5 | 0 | 0 | 0 | 0 | 110.5 | D36 R37 C38 | S34-D36 PolarHBondContact O-N 3.44Å; S34-D36 VanDerWaalsContact O-N 3.14Å; S34-R37 PolarHBondContact O-N 2.98Å; S34-R37 VanDerWaalsContact O-N 3.11Å; S34-C38 PolarHBondContact O-N 3.39Å | ||
| 35 | R | 67.3 | Low | 65.8 | Low | 181 Ų | 181 | 96.2 Ų | 96.2 | 68% | 0.683 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -53.7 | -36.6 | -179.4 | -178.2 | 178.3 | 168.2 | 164.4 | -1.5 | 112.5 | K39 F45 | R35-K39 WeakPolarHBondContact O-CB 3.32Å; R35-K39 PolarHBondContact O-N 3Å; R35-K39 VanDerWaalsContact O-N 3.09Å; R35-F45 HydrophobicContact CB-CD1 4.35Å; R35-F45 HydrophobicContact CB-CG 4.34Å; R35-F45 HydrophobicContact CG-CB 4.31Å; R35-F45 HydrophobicContact CG-CD1 4.25Å; R35-F45 HydrophobicContact CG-CG 4.27Å |
| 36 | D | 74.3 | Confident | 66.9 | Low | 123 Ų | 123 | 95.3 Ų | 95.3 | 66% | 0.658 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -69.8 | -42.1 | -179.2 | -59.2 | -57.9 | 0 | 0 | 0 | 112.2 | S34 K39 E40 | S34-D36 PolarHBondContact O-N 3.44Å; S34-D36 VanDerWaalsContact O-N 3.14Å; D36-K39 WeakPolarHBondContact O-CB 3.48Å; D36-K39 PolarHBondContact O-N 3.46Å; D36-E40 PolarHBondContact O-N 3.4Å |
| 37 | R | 71.3 | Confident | 67.8 | Low | 147 Ų | 147 | 95.5 Ų | 95.5 | 56% | 0.555 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -67.5 | -38.8 | 176.3 | -166 | 178 | -171.7 | -163.6 | 0.1 | 111.7 | V33 S34 K39 E40 L41 | V33-R37 HydrophobicContact CB-CB 4.38Å; S34-R37 PolarHBondContact O-N 2.98Å; S34-R37 VanDerWaalsContact O-N 3.11Å; R37-K39 VanDerWaalsContact C-N 3.28Å; R37-K39 PolarHBondContact O-N 3.38Å; R37-E40 PolarHBondContact O-N 2.92Å; R37-L41 WeakPolarHBondContact O-CG 3.26Å; R37-L41 PolarHBondContact O-N 3.49Å; R37-L41 VanDerWaalsContact O-N 3.08Å |
| 38 | C | 73.1 | Confident | 68.4 | Low | 1 Ų | 1 | 92 Ų | 92 | 1% | 0.007 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -61.9 | -37.3 | 174 | -175.8 | 0 | 0 | 0 | 0 | 112.2 | V33 S34 L41 G42 C43 F45 C50 | V33-C38 HydrophobicContact CG2-CB 4.02Å; S34-C38 PolarHBondContact O-N 3.39Å; C38-L41 PolarHBondContact O-N 3.28Å; C38-G42 PolarHBondContact O-N 2.84Å; C38-C43 PolarHBondContact O-N 3.29Å; C38-C43 VanDerWaalsContact O-N 3.17Å; C38-F45 HydrophobicContact CB-CB 4.42Å; C38-F45 HydrophobicContact CB-CD2 4.31Å; C38-C50 WeakPolarHBondContact CA-SG 3.19Å; C38-C50 HydrophobicContact CB-CB 3.91Å; C38-C50 WeakPolarHBondContact CB-SG 3.34Å; C38-C50 VanDerWaalsContact SG-CA 3.53Å; C38-C50 WeakPolarHBondContact SG-CB 3.25Å; C38-C50 CovalentContact SG-SG 2.03Å; C38-C50 PolarHBondContact SG-SG 3.4Å |
| 39 | K | 72.4 | Confident | 68.8 | Low | 166 Ų | 166 | 90.3 Ų | 90.3 | 72% | 0.722 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -68.6 | -37.1 | 176.5 | -172.4 | -177.1 | 177.4 | -171.2 | 0 | 112.2 | R35 D36 R37 L41 G42 | R35-K39 WeakPolarHBondContact O-CB 3.32Å; R35-K39 PolarHBondContact O-N 3Å; R35-K39 VanDerWaalsContact O-N 3.09Å; D36-K39 WeakPolarHBondContact O-CB 3.48Å; D36-K39 PolarHBondContact O-N 3.46Å; R37-K39 VanDerWaalsContact C-N 3.28Å; R37-K39 PolarHBondContact O-N 3.38Å; K39-L41 VanDerWaalsContact C-N 3.33Å; K39-G42 PolarHBondContact O-N 2.83Å; K39-G42 VanDerWaalsContact O-N 3.15Å |
| 40 | E | 77.6 | Confident | 69.4 | Low | 170 Ų | 170 | 88.3 Ų | 88.3 | 79% | 0.794 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -67 | -35 | 176.3 | -167.2 | 170 | -157.8 | 0 | 0 | 112.1 | D36 R37 G42 | D36-E40 PolarHBondContact O-N 3.4Å; R37-E40 PolarHBondContact O-N 2.92Å; E40-G42 PolarHBondContact O-N 3.25Å |
| 41 | L | 68.9 | Low | 70.1 | Confident | 95 Ų | 95 | 88.8 Ų | 88.8 | 50% | 0.497 | 43% | 0.429 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -71.4 | -2.4 | 172.4 | -67.7 | 169.9 | 0 | 0 | 0 | 113.7 | R37 C38 K39 C43 | R37-L41 WeakPolarHBondContact O-CG 3.26Å; R37-L41 PolarHBondContact O-N 3.49Å; R37-L41 VanDerWaalsContact O-N 3.08Å; C38-L41 PolarHBondContact O-N 3.28Å; K39-L41 VanDerWaalsContact C-N 3.33Å; L41-C43 PolarHBondContact O-N 3.44Å |
| 42 | G | 69.3 | Low | 70.6 | Confident | 34 Ų | 34 | 87.3 Ų | 87.3 | 35% | 0.351 | 43% | 0.427 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 75.4 | 4.1 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | C38 K39 E40 K53 | C38-G42 PolarHBondContact O-N 2.84Å; K39-G42 PolarHBondContact O-N 2.83Å; K39-G42 VanDerWaalsContact O-N 3.15Å; E40-G42 PolarHBondContact O-N 3.25Å; G42-K53 WeakPolarHBondContact O-CD 3.32Å; G42-K53 WeakPolarHBondContact O-CE 3.32Å; G42-K53 WeakPolarHBondContact O-CG 3.35Å; G42-K53 PolarHBondContact O-NZ 3.18Å |
| 43 | C | 74.6 | Confident | 70.9 | Confident | 16 Ų | 16 | 84.9 Ų | 84.9 | 11% | 0.108 | 41% | 0.409 | C | S | . | . | P | Polyproline II helix | trans | -87.9 | 167.7 | -177.6 | -59.6 | 0 | 0 | 0 | 0 | 112.1 | C29 C38 L41 C50 Y51 | C29-C43 HydrophobicContact CB-CB 3.94Å; C29-C43 WeakPolarHBondContact CB-SG 3.32Å; C29-C43 WeakPolarHBondContact SG-CB 3.41Å; C29-C43 CovalentContact SG-SG 2.06Å; C29-C43 PolarHBondContact SG-SG 3.34Å; C38-C43 PolarHBondContact O-N 3.29Å; C38-C43 VanDerWaalsContact O-N 3.17Å; L41-C43 PolarHBondContact O-N 3.44Å; C43-C50 WeakPolarHBondContact CB-SG 3.47Å; C43-Y51 CarbonylContact C-O 3.53Å; C43-Y51 WeakPolarHBondContact CA-O 3.26Å; C43-Y51 WeakPolarHBondContact CB-O 3.43Å |
| 44 | C | 72.9 | Confident | 70.7 | Confident | 15 Ų | 15 | 87.8 Ų | 87.8 | 10% | 0.101 | 43% | 0.434 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 131.6 | 177.4 | -78.4 | 0 | 0 | 0 | 0 | 111.2 | C21 C50 Y51 | C21-C44 HydrophobicContact CB-CB 3.75Å; C21-C44 WeakPolarHBondContact CB-SG 3.5Å; C21-C44 WeakPolarHBondContact SG-CB 3.35Å; C21-C44 CovalentContact SG-SG 2.05Å; C21-C44 PolarHBondContact SG-SG 2.95Å; C44-C50 CarbonylContact O-C 3.56Å; C44-C50 WeakPolarHBondContact O-CA 3.41Å; C44-Y51 PolarHBondContact N-O 2.85Å; C44-Y51 PolarHBondContact O-N 2.81Å |
| 45 | F | 72.3 | Confident | 70.4 | Confident | 86 Ų | 86 | 88.3 Ų | 88.3 | 38% | 0.377 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.5 | 118.9 | 174.3 | -172.9 | -96.1 | 0 | 0 | 0 | 111.2 | R35 C38 G48 V49 | R35-F45 HydrophobicContact CB-CD1 4.35Å; R35-F45 HydrophobicContact CB-CG 4.34Å; R35-F45 HydrophobicContact CG-CB 4.31Å; R35-F45 HydrophobicContact CG-CD1 4.25Å; R35-F45 HydrophobicContact CG-CG 4.27Å; C38-F45 HydrophobicContact CB-CB 4.42Å; C38-F45 HydrophobicContact CB-CD2 4.31Å; F45-G48 VanDerWaalsContact CZ-CA 3.45Å; F45-V49 WeakPolarHBondContact CA-O 3.14Å |
| 46 | Y | 70.5 | Confident | 70.7 | Confident | 108 Ų | 108 | 81.3 Ų | 81.3 | 42% | 0.424 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.7 | 133 | 177.6 | -175.8 | -103.9 | 0 | 0 | 0 | 111.1 | I23 G48 V49 Y51 | I23-Y46 HydrophobicContact CD1-CD1 3.68Å; I23-Y46 HydrophobicContact CD1-CD2 4.18Å; I23-Y46 HydrophobicContact CD1-CE1 3.73Å; I23-Y46 HydrophobicContact CD1-CE2 4.26Å; I23-Y46 HydrophobicContact CD1-CG 3.89Å; I23-Y46 HydrophobicContact CG1-CD1 4.27Å; Y46-G48 PolarHBondContact O-N 3.28Å; Y46-V49 PolarHBondContact N-O 3.45Å; Y46-V49 PolarHBondContact O-N 2.94Å; Y46-Y51 HydrophobicContact CD1-CE2 4.2Å |
| 47 | K | 69 | Low | 70.9 | Confident | 178 Ų | 178 | 81.4 Ų | 81.4 | 77% | 0.774 | 41% | 0.411 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.4 | 37.4 | -179.8 | -72.2 | -170 | 175.7 | -179.9 | 0 | 115.5 | ||
| 48 | G | 65.8 | Low | 71.4 | Confident | 41 Ų | 41 | 81.3 Ų | 81.3 | 42% | 0.423 | 41% | 0.412 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.9 | 1.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | F45 Y46 | F45-G48 VanDerWaalsContact CZ-CA 3.45Å; Y46-G48 PolarHBondContact O-N 3.28Å |
| 49 | V | 67.9 | Low | 71.9 | Confident | 32 Ų | 32 | 84.1 Ų | 84.1 | 19% | 0.194 | 43% | 0.428 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.7 | 143.9 | -178.4 | -178 | 0 | 0 | 0 | 0 | 110.1 | I28 Y31 F45 Y46 Y51 | I28-V49 HydrophobicContact CG2-CG1 4.22Å; Y31-V49 HydrophobicContact CD1-CG1 4.36Å; Y31-V49 HydrophobicContact CE1-CG1 4.35Å; F45-V49 WeakPolarHBondContact CA-O 3.14Å; Y46-V49 PolarHBondContact N-O 3.45Å; Y46-V49 PolarHBondContact O-N 2.94Å; V49-Y51 HydrophobicContact CB-CD2 4.37Å; V49-Y51 HydrophobicContact CB-CE2 3.68Å; V49-Y51 HydrophobicContact CG1-CD2 4.34Å; V49-Y51 HydrophobicContact CG1-CE1 4.2Å; V49-Y51 HydrophobicContact CG1-CE2 3.87Å |
| 50 | C | 73.9 | Confident | 72.4 | Confident | 1 Ų | 1 | 81.9 Ų | 81.9 | 1% | 0.007 | 42% | 0.42 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.7 | 109.5 | 176.8 | -165.8 | 0 | 0 | 0 | 0 | 110 | C29 D30 V33 C38 C43 C44 | C29-C50 PolarHBondContact N-O 3.29Å; C29-C50 VanDerWaalsContact N-O 3.1Å; D30-C50 VanDerWaalsContact O-CB 3.31Å; D30-C50 WeakPolarHBondContact O-CB 3.37Å; V33-C50 HydrophobicContact CG2-CB 3.56Å; C38-C50 WeakPolarHBondContact CA-SG 3.19Å; C38-C50 HydrophobicContact CB-CB 3.91Å; C38-C50 WeakPolarHBondContact CB-SG 3.34Å; C38-C50 VanDerWaalsContact SG-CA 3.53Å; C38-C50 WeakPolarHBondContact SG-CB 3.25Å; C38-C50 CovalentContact SG-SG 2.03Å; C38-C50 PolarHBondContact SG-SG 3.4Å; C43-C50 WeakPolarHBondContact CB-SG 3.47Å; C44-C50 CarbonylContact O-C 3.56Å; C44-C50 WeakPolarHBondContact O-CA 3.41Å |
| 51 | Y | 70.8 | Confident | 73 | Confident | 75 Ų | 75 | 77.6 Ų | 77.6 | 29% | 0.294 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 142.4 | -178.9 | -66.5 | -83 | 0 | 0 | 0 | 111.2 | C43 C44 Y46 V49 | C43-Y51 CarbonylContact C-O 3.53Å; C43-Y51 WeakPolarHBondContact CA-O 3.26Å; C43-Y51 WeakPolarHBondContact CB-O 3.43Å; C44-Y51 PolarHBondContact N-O 2.85Å; C44-Y51 PolarHBondContact O-N 2.81Å; Y46-Y51 HydrophobicContact CD1-CE2 4.2Å; V49-Y51 HydrophobicContact CB-CD2 4.37Å; V49-Y51 HydrophobicContact CB-CE2 3.68Å; V49-Y51 HydrophobicContact CG1-CD2 4.34Å; V49-Y51 HydrophobicContact CG1-CE1 4.2Å; V49-Y51 HydrophobicContact CG1-CE2 3.87Å |
| 52 | E | 69.5 | Low | 74 | Confident | 114 Ų | 114 | 79.4 Ų | 79.4 | 53% | 0.533 | 41% | 0.41 | S | S | . | . | trans | -67.5 | 145.9 | 173.1 | -163.5 | 162.1 | 173.7 | 0 | 0 | 111.3 | D27 C29 A54 | D27-E52 PolarHBondContact O-N 2.96Å; C29-E52 WeakPolarHBondContact SG-CA 3.32Å; C29-E52 VanDerWaalsContact SG-CB 3.51Å; C29-E52 PolarHBondContact SG-N 2.93Å; C29-E52 VanDerWaalsContact SG-N 3.44Å; E52-A54 VanDerWaalsContact C-N 3.33Å; E52-A54 PolarHBondContact O-N 2.97Å | ||
| 53 | K | 65.8 | Low | 75.1 | Confident | 116 Ų | 116 | 80.9 Ų | 80.9 | 50% | 0.504 | 42% | 0.415 | S | S | . | . | trans | -74.3 | 91.6 | 171.7 | -76.7 | -175.8 | -173.9 | 146.4 | 0 | 108.6 | G42 | G42-K53 WeakPolarHBondContact O-CD 3.32Å; G42-K53 WeakPolarHBondContact O-CE 3.32Å; G42-K53 WeakPolarHBondContact O-CG 3.35Å; G42-K53 PolarHBondContact O-NZ 3.18Å | ||
| 54 | A | 63.6 | Low | 76.1 | Confident | 73 Ų | 73 | 82.5 Ų | 82.5 | 60% | 0.603 | 43% | 0.429 | S | S | * | . | P | Polyproline II helix | trans | -84.6 | 133.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | E52 | E52-A54 VanDerWaalsContact C-N 3.33Å; E52-A54 PolarHBondContact O-N 2.97Å |
| 55 | V | 66.8 | Low | 77.2 | Confident | 82 Ų | 82 | 86.3 Ų | 86.3 | 50% | 0.497 | 45% | 0.448 | S | S | . | . | P | Polyproline II helix | trans | -84 | 119.6 | 160.1 | 176.8 | 0 | 0 | 0 | 0 | 106.1 | I57 V59 | V55-I57 PolarHBondContact O-N 3.29Å; V55-V59 HydrophobicContact CG1-CB 3.78Å; V55-V59 HydrophobicContact CG1-CG1 3.91Å; V55-V59 HydrophobicContact CG1-CG2 4.23Å |
| 56 | P | 73.4 | Confident | 78.4 | Confident | 35 Ų | 35 | 86.4 Ų | 86.4 | 23% | 0.227 | 45% | 0.451 | C | S | . | . | P | Polyproline II helix | trans | -59.3 | 143.2 | -175.5 | -27.4 | 36.6 | 0 | 0 | 0 | 112.4 | Y58 V59 | P56-Y58 HydrophobicContact CB-CD1 3.3Å; P56-Y58 HydrophobicContact CB-CD2 4.4Å; P56-Y58 HydrophobicContact CB-CE1 2.97Å; P56-Y58 HydrophobicContact CB-CE2 4.12Å; P56-Y58 HydrophobicContact CB-CG 4.02Å; P56-Y58 VanDerWaalsContact CB-CZ 3.41Å; P56-Y58 HydrophobicContact CG-CD1 4.35Å; P56-Y58 HydrophobicContact CG-CE1 3.55Å; P56-Y58 HydrophobicContact CG-CE2 4.49Å; P56-Y58 WeakPolarHBondContact CG-OH 3.15Å; P56-Y58 PolarHBondContact O-N 2.71Å; P56-Y58 VanDerWaalsContact O-N 3.08Å; P56-V59 HydrophobicContact CB-CG2 4.31Å; P56-V59 HydrophobicContact CG-CG2 4.5Å; P56-V59 WeakPolarHBondContact O-CB 3.37Å; P56-V59 PolarHBondContact O-N 2.91Å |
| 57 | I | 78.9 | Confident | 79.6 | Confident | 124 Ų | 124 | 85.8 Ų | 85.8 | 64% | 0.636 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -55 | -34.6 | -177.2 | -60.9 | 169.8 | 0 | 0 | 0 | 111.3 | V55 V59 H60 V61 | V55-I57 PolarHBondContact O-N 3.29Å; I57-V59 PolarHBondContact O-N 2.8Å; I57-H60 WeakPolarHBondContact O-CB 3.49Å; I57-H60 PolarHBondContact O-N 3.36Å; I57-H60 VanDerWaalsContact O-N 3.12Å; I57-V61 HydrophobicContact CG2-CG2 4.34Å; I57-V61 WeakPolarHBondContact O-CG2 3.25Å; I57-V61 PolarHBondContact O-N 3.49Å |
| 58 | Y | 81.6 | Confident | 81 | Confident | 146 Ų | 146 | 82.7 Ų | 82.7 | 57% | 0.573 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -59.5 | -32.6 | 177.3 | 66.6 | -107.2 | 0 | 0 | 0 | 112.8 | P56 V61 F62 | P56-Y58 HydrophobicContact CB-CD1 3.3Å; P56-Y58 HydrophobicContact CB-CD2 4.4Å; P56-Y58 HydrophobicContact CB-CE1 2.97Å; P56-Y58 HydrophobicContact CB-CE2 4.12Å; P56-Y58 HydrophobicContact CB-CG 4.02Å; P56-Y58 VanDerWaalsContact CB-CZ 3.41Å; P56-Y58 HydrophobicContact CG-CD1 4.35Å; P56-Y58 HydrophobicContact CG-CE1 3.55Å; P56-Y58 HydrophobicContact CG-CE2 4.49Å; P56-Y58 WeakPolarHBondContact CG-OH 3.15Å; P56-Y58 PolarHBondContact O-N 2.71Å; P56-Y58 VanDerWaalsContact O-N 3.08Å; Y58-V61 PolarHBondContact O-N 2.91Å; Y58-F62 WeakPolarHBondContact O-CB 3.23Å; Y58-F62 PolarHBondContact O-N 3.28Å |
| 59 | V | 83.3 | Confident | 82.5 | Confident | 59 Ų | 59 | 85.6 Ų | 85.6 | 36% | 0.358 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -68.3 | -40.6 | 177.5 | -178.7 | 0 | 0 | 0 | 0 | 110.3 | V55 P56 I57 F62 S63 | V55-V59 HydrophobicContact CG1-CB 3.78Å; V55-V59 HydrophobicContact CG1-CG1 3.91Å; V55-V59 HydrophobicContact CG1-CG2 4.23Å; P56-V59 HydrophobicContact CB-CG2 4.31Å; P56-V59 HydrophobicContact CG-CG2 4.5Å; P56-V59 WeakPolarHBondContact O-CB 3.37Å; P56-V59 PolarHBondContact O-N 2.91Å; I57-V59 PolarHBondContact O-N 2.8Å; V59-F62 PolarHBondContact O-N 3.32Å; V59-S63 VanDerWaalsContact O-CB 3.27Å; V59-S63 WeakPolarHBondContact O-CB 3.46Å; V59-S63 PolarHBondContact O-N 2.83Å |
| 60 | H | 83.8 | Confident | 83.9 | Confident | 119 Ų | 119 | 86.5 Ų | 86.5 | 55% | 0.551 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.5 | -44.6 | 176 | -70.9 | -70 | 0 | 0 | 0 | 111.7 | I57 S63 A64 | I57-H60 WeakPolarHBondContact O-CB 3.49Å; I57-H60 PolarHBondContact O-N 3.36Å; I57-H60 VanDerWaalsContact O-N 3.12Å; H60-S63 PolarHBondContact O-N 3.24Å; H60-A64 WeakPolarHBondContact O-CB 3.35Å; H60-A64 PolarHBondContact O-N 3.35Å |
| 61 | V | 89.6 | Confident | 85 | Confident | 80 Ų | 80 | 87.9 Ų | 87.9 | 49% | 0.485 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.6 | -46.3 | 176.4 | 176.9 | 0 | 0 | 0 | 0 | 110.8 | I57 Y58 S63 A64 L65 | I57-V61 HydrophobicContact CG2-CG2 4.34Å; I57-V61 WeakPolarHBondContact O-CG2 3.25Å; I57-V61 PolarHBondContact O-N 3.49Å; Y58-V61 PolarHBondContact O-N 2.91Å; V61-S63 PolarHBondContact O-N 3.44Å; V61-A64 PolarHBondContact O-N 3.41Å; V61-L65 HydrophobicContact CG1-CD1 4.14Å; V61-L65 HydrophobicContact CG1-CG 4.5Å; V61-L65 WeakPolarHBondContact O-CG 3.37Å; V61-L65 PolarHBondContact O-N 3.42Å |
| 62 | F | 90.3 | Very high | 86.3 | Confident | 133 Ų | 133 | 86.8 Ų | 86.8 | 58% | 0.583 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.6 | -43.7 | 178.7 | -174.8 | -109.5 | 0 | 0 | 0 | 112.1 | Y58 V59 A64 L65 I66 | Y58-F62 WeakPolarHBondContact O-CB 3.23Å; Y58-F62 PolarHBondContact O-N 3.28Å; V59-F62 PolarHBondContact O-N 3.32Å; F62-A64 VanDerWaalsContact C-N 3.33Å; F62-A64 PolarHBondContact O-N 3.38Å; F62-L65 PolarHBondContact O-N 3.35Å; F62-I66 HydrophobicContact CD1-CD1 3.61Å; F62-I66 HydrophobicContact CE1-CD1 3.3Å; F62-I66 HydrophobicContact CE1-CG1 4.31Å; F62-I66 HydrophobicContact CE2-CD1 4.43Å; F62-I66 HydrophobicContact CG-CD1 4.32Å; F62-I66 HydrophobicContact CZ-CD1 3.75Å; F62-I66 HydrophobicContact CZ-CG1 4.37Å; F62-I66 WeakPolarHBondContact O-CG1 3.34Å; F62-I66 PolarHBondContact O-N 2.97Å |
| 63 | S | 92.8 | Very high | 87.6 | Confident | 65 Ų | 65 | 87.8 Ų | 87.8 | 46% | 0.455 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.2 | -42.9 | 174.3 | -175.3 | 0 | 0 | 0 | 0 | 111.8 | V59 H60 V61 I66 V67 | V59-S63 VanDerWaalsContact O-CB 3.27Å; V59-S63 WeakPolarHBondContact O-CB 3.46Å; V59-S63 PolarHBondContact O-N 2.83Å; H60-S63 PolarHBondContact O-N 3.24Å; V61-S63 PolarHBondContact O-N 3.44Å; S63-I66 PolarHBondContact O-N 3.15Å; S63-V67 WeakPolarHBondContact O-CG2 3.27Å; S63-V67 PolarHBondContact O-N 2.9Å; S63-V67 VanDerWaalsContact O-N 3.15Å |
| 64 | A | 94.9 | Very high | 89.1 | Confident | 50 Ų | 50 | 86.3 Ų | 86.3 | 41% | 0.413 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64 | -43.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | H60 V61 F62 I66 V67 I68 | H60-A64 WeakPolarHBondContact O-CB 3.35Å; H60-A64 PolarHBondContact O-N 3.35Å; V61-A64 PolarHBondContact O-N 3.41Å; F62-A64 VanDerWaalsContact C-N 3.33Å; F62-A64 PolarHBondContact O-N 3.38Å; A64-I66 VanDerWaalsContact C-N 3.35Å; A64-I66 PolarHBondContact O-N 2.87Å; A64-V67 PolarHBondContact O-N 2.93Å; A64-I68 VanDerWaalsContact O-CG1 3.28Å; A64-I68 WeakPolarHBondContact O-CG1 3.36Å; A64-I68 PolarHBondContact O-N 2.86Å |
| 65 | L | 96.8 | Very high | 90.7 | Very high | 96 Ų | 96 | 88.4 Ų | 88.4 | 50% | 0.503 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.9 | -43.6 | 176.6 | -72.8 | 172.2 | 0 | 0 | 0 | 112.1 | V61 F62 V67 I68 V69 | V61-L65 HydrophobicContact CG1-CD1 4.14Å; V61-L65 HydrophobicContact CG1-CG 4.5Å; V61-L65 WeakPolarHBondContact O-CG 3.37Å; V61-L65 PolarHBondContact O-N 3.42Å; F62-L65 PolarHBondContact O-N 3.35Å; L65-V67 VanDerWaalsContact C-N 3.33Å; L65-V67 PolarHBondContact O-N 2.8Å; L65-I68 PolarHBondContact O-N 3.44Å; L65-V69 WeakPolarHBondContact O-CG2 3.44Å; L65-V69 PolarHBondContact O-N 3.46Å |
| 66 | I | 96.6 | Very high | 92.1 | Very high | 87 Ų | 87 | 88.1 Ų | 88.1 | 45% | 0.446 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.1 | -46.6 | 176.6 | -70.2 | 165.8 | 0 | 0 | 0 | 110.7 | F62 S63 A64 I68 V69 A70 | F62-I66 HydrophobicContact CD1-CD1 3.61Å; F62-I66 HydrophobicContact CE1-CD1 3.3Å; F62-I66 HydrophobicContact CE1-CG1 4.31Å; F62-I66 HydrophobicContact CE2-CD1 4.43Å; F62-I66 HydrophobicContact CG-CD1 4.32Å; F62-I66 HydrophobicContact CZ-CD1 3.75Å; F62-I66 HydrophobicContact CZ-CG1 4.37Å; F62-I66 WeakPolarHBondContact O-CG1 3.34Å; F62-I66 PolarHBondContact O-N 2.97Å; S63-I66 PolarHBondContact O-N 3.15Å; A64-I66 VanDerWaalsContact C-N 3.35Å; A64-I66 PolarHBondContact O-N 2.87Å; I66-I68 VanDerWaalsContact C-N 3.32Å; I66-I68 PolarHBondContact O-N 3.49Å; I66-V69 PolarHBondContact O-N 2.95Å; I66-A70 VanDerWaalsContact O-CB 3.25Å; I66-A70 WeakPolarHBondContact O-CB 3.28Å; I66-A70 PolarHBondContact O-N 3.23Å |
| 67 | V | 97.3 | Very high | 93.1 | Very high | 96 Ų | 96 | 90.4 Ų | 90.4 | 58% | 0.582 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.9 | -40 | 179.9 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | S63 A64 L65 G71 | S63-V67 WeakPolarHBondContact O-CG2 3.27Å; S63-V67 PolarHBondContact O-N 2.9Å; S63-V67 VanDerWaalsContact O-N 3.15Å; A64-V67 PolarHBondContact O-N 2.93Å; L65-V67 VanDerWaalsContact C-N 3.33Å; L65-V67 PolarHBondContact O-N 2.8Å; V67-G71 PolarHBondContact O-N 3.46Å |
| 68 | I | 97.4 | Very high | 93.9 | Very high | 113 Ų | 113 | 89.2 Ų | 89.2 | 58% | 0.579 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.3 | -49 | 177.3 | -68.3 | 164.1 | 0 | 0 | 0 | 110.7 | A64 L65 I66 G71 A72 | A64-I68 VanDerWaalsContact O-CG1 3.28Å; A64-I68 WeakPolarHBondContact O-CG1 3.36Å; A64-I68 PolarHBondContact O-N 2.86Å; L65-I68 PolarHBondContact O-N 3.44Å; I66-I68 VanDerWaalsContact C-N 3.32Å; I66-I68 PolarHBondContact O-N 3.49Å; I68-G71 PolarHBondContact O-N 3.27Å; I68-A72 WeakPolarHBondContact O-CB 3.46Å; I68-A72 PolarHBondContact O-N 2.87Å |
| 69 | V | 97.3 | Very high | 94.5 | Very high | 101 Ų | 101 | 89.3 Ų | 89.3 | 61% | 0.612 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.4 | -45.2 | -179.7 | 174.3 | 0 | 0 | 0 | 0 | 110.8 | L65 I66 A72 F73 | L65-V69 WeakPolarHBondContact O-CG2 3.44Å; L65-V69 PolarHBondContact O-N 3.46Å; I66-V69 PolarHBondContact O-N 2.95Å; V69-A72 PolarHBondContact O-N 3.45Å; V69-F73 WeakPolarHBondContact O-CB 3.44Å; V69-F73 PolarHBondContact O-N 2.93Å |
| 70 | A | 97.7 | Very high | 94.9 | Very high | 52 Ų | 52 | 94 Ų | 94 | 43% | 0.43 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.4 | -44.4 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | I66 F73 V74 | I66-A70 VanDerWaalsContact O-CB 3.25Å; I66-A70 WeakPolarHBondContact O-CB 3.28Å; I66-A70 PolarHBondContact O-N 3.23Å; A70-F73 PolarHBondContact O-N 3.43Å; A70-V74 WeakPolarHBondContact O-CG2 3.43Å; A70-V74 PolarHBondContact O-N 2.99Å |
| 71 | G | 97.6 | Very high | 95.3 | Very high | 30 Ų | 30 | 92.6 Ų | 92.6 | 31% | 0.309 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.8 | -46.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | V67 I68 F73 V74 I75 | V67-G71 PolarHBondContact O-N 3.46Å; I68-G71 PolarHBondContact O-N 3.27Å; G71-F73 VanDerWaalsContact C-N 3.3Å; G71-F73 PolarHBondContact O-N 3.43Å; G71-V74 PolarHBondContact O-N 3.45Å; G71-I75 WeakPolarHBondContact O-CB 3.21Å; G71-I75 WeakPolarHBondContact O-CD1 3.49Å; G71-I75 VanDerWaalsContact O-CG1 3.23Å; G71-I75 WeakPolarHBondContact O-CG1 3.36Å; G71-I75 PolarHBondContact O-N 3.26Å |
| 72 | A | 97.3 | Very high | 95.3 | Very high | 52 Ų | 52 | 91.9 Ų | 91.9 | 43% | 0.43 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -61.1 | -39.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | I68 V69 T76 | I68-A72 WeakPolarHBondContact O-CB 3.46Å; I68-A72 PolarHBondContact O-N 2.87Å; V69-A72 PolarHBondContact O-N 3.45Å; A72-T76 VanDerWaalsContact O-CB 3.32Å; A72-T76 WeakPolarHBondContact O-CB 3.05Å; A72-T76 PolarHBondContact O-N 3Å; A72-T76 PolarHBondContact O-OG1 3.31Å |
| 73 | F | 97.6 | Very high | 95.2 | Very high | 135 Ų | 135 | 88.7 Ų | 88.7 | 59% | 0.592 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.9 | -48.2 | 177.4 | -170.3 | -100.6 | 0 | 0 | 0 | 111.6 | V69 A70 G71 I75 T76 I77 | V69-F73 WeakPolarHBondContact O-CB 3.44Å; V69-F73 PolarHBondContact O-N 2.93Å; A70-F73 PolarHBondContact O-N 3.43Å; G71-F73 VanDerWaalsContact C-N 3.3Å; G71-F73 PolarHBondContact O-N 3.43Å; F73-I75 PolarHBondContact O-N 3.25Å; F73-T76 WeakPolarHBondContact O-CB 3.14Å; F73-T76 PolarHBondContact O-N 3.19Å; F73-I77 HydrophobicContact CD1-CG1 4.18Å; F73-I77 HydrophobicContact CE1-CD1 4.26Å; F73-I77 HydrophobicContact CE1-CG1 3.89Å; F73-I77 HydrophobicContact CZ-CD1 4.1Å; F73-I77 HydrophobicContact CZ-CG1 4.2Å; F73-I77 WeakPolarHBondContact O-CG1 3.5Å; F73-I77 PolarHBondContact O-N 3.11Å |
| 74 | V | 97.4 | Very high | 94.9 | Very high | 84 Ų | 84 | 91 Ų | 91 | 51% | 0.509 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.2 | -46.4 | 177.5 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | A70 G71 T76 I77 I78 | A70-V74 WeakPolarHBondContact O-CG2 3.43Å; A70-V74 PolarHBondContact O-N 2.99Å; G71-V74 PolarHBondContact O-N 3.45Å; V74-T76 VanDerWaalsContact C-N 3.29Å; V74-T76 PolarHBondContact O-N 3.14Å; V74-I77 PolarHBondContact O-N 3.09Å; V74-I78 HydrophobicContact CG1-CD1 3.81Å; V74-I78 HydrophobicContact CG1-CG1 4.48Å; V74-I78 WeakPolarHBondContact O-CG1 3.48Å; V74-I78 PolarHBondContact O-N 3.06Å |
| 75 | I | 96.6 | Very high | 94.2 | Very high | 118 Ų | 118 | 90.7 Ų | 90.7 | 61% | 0.605 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.4 | -42.3 | 177 | -68 | 166.1 | 0 | 0 | 0 | 110.5 | G71 F73 I78 Y79 | G71-I75 WeakPolarHBondContact O-CB 3.21Å; G71-I75 WeakPolarHBondContact O-CD1 3.49Å; G71-I75 VanDerWaalsContact O-CG1 3.23Å; G71-I75 WeakPolarHBondContact O-CG1 3.36Å; G71-I75 PolarHBondContact O-N 3.26Å; F73-I75 PolarHBondContact O-N 3.25Å; I75-I78 PolarHBondContact O-N 3.28Å; I75-Y79 VanDerWaalsContact O-CB 3.25Å; I75-Y79 WeakPolarHBondContact O-CB 3.48Å; I75-Y79 PolarHBondContact O-N 3.41Å |
| 76 | T | 95.4 | Very high | 93.5 | Very high | 76 Ų | 76 | 95 Ų | 95 | 47% | 0.466 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.1 | -46.1 | 178.3 | -60.1 | 0 | 0 | 0 | 0 | 111.4 | A72 F73 V74 Y79 R80 | A72-T76 VanDerWaalsContact O-CB 3.32Å; A72-T76 WeakPolarHBondContact O-CB 3.05Å; A72-T76 PolarHBondContact O-N 3Å; A72-T76 PolarHBondContact O-OG1 3.31Å; F73-T76 WeakPolarHBondContact O-CB 3.14Å; F73-T76 PolarHBondContact O-N 3.19Å; V74-T76 VanDerWaalsContact C-N 3.29Å; V74-T76 PolarHBondContact O-N 3.14Å; T76-Y79 PolarHBondContact O-N 3.17Å; T76-R80 HydrophobicContact CG2-CG 4.31Å; T76-R80 WeakPolarHBondContact O-CG 3.17Å; T76-R80 PolarHBondContact O-N 3.07Å |
| 77 | I | 95.3 | Very high | 92.6 | Very high | 83 Ų | 83 | 99.2 Ų | 99.2 | 43% | 0.426 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -60.4 | -48.6 | 177 | -65.2 | -63 | 0 | 0 | 0 | 110.7 | F73 V74 Y79 R80 V81 | F73-I77 HydrophobicContact CD1-CG1 4.18Å; F73-I77 HydrophobicContact CE1-CD1 4.26Å; F73-I77 HydrophobicContact CE1-CG1 3.89Å; F73-I77 HydrophobicContact CZ-CD1 4.1Å; F73-I77 HydrophobicContact CZ-CG1 4.2Å; F73-I77 WeakPolarHBondContact O-CG1 3.5Å; F73-I77 PolarHBondContact O-N 3.11Å; V74-I77 PolarHBondContact O-N 3.09Å; I77-Y79 VanDerWaalsContact C-N 3.31Å; I77-Y79 PolarHBondContact O-N 3.49Å; I77-R80 PolarHBondContact O-N 3.44Å; I77-V81 HydrophobicContact CG2-CG2 4.39Å; I77-V81 WeakPolarHBondContact O-CB 3.03Å; I77-V81 VanDerWaalsContact O-CG2 3.26Å; I77-V81 WeakPolarHBondContact O-CG2 3.49Å; I77-V81 PolarHBondContact O-N 3.15Å |
| 78 | I | 95.3 | Very high | 91.4 | Very high | 98 Ų | 98 | 100.8 Ų | 100.8 | 50% | 0.503 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -59.6 | -45.2 | 177.3 | -65.8 | 168.4 | 0 | 0 | 0 | 110.2 | V74 I75 R80 V81 V82 | V74-I78 HydrophobicContact CG1-CD1 3.81Å; V74-I78 HydrophobicContact CG1-CG1 4.48Å; V74-I78 WeakPolarHBondContact O-CG1 3.48Å; V74-I78 PolarHBondContact O-N 3.06Å; I75-I78 PolarHBondContact O-N 3.28Å; I78-R80 PolarHBondContact O-N 3.08Å; I78-V81 PolarHBondContact O-N 2.74Å; I78-V82 HydrophobicContact CG2-CG2 4.16Å; I78-V82 WeakPolarHBondContact O-CB 3.37Å; I78-V82 VanDerWaalsContact O-CG2 3.26Å; I78-V82 WeakPolarHBondContact O-CG2 3.28Å; I78-V82 PolarHBondContact O-N 2.05Å |
| 79 | Y | 94.3 | Very high | 89.8 | Confident | 149 Ų | 149 | 105.3 Ų | 105.3 | 58% | 0.584 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.9 | -43 | 179.1 | -175.9 | -95.9 | 0 | 0 | 0 | 111.8 | I75 T76 I77 V82 Q83 | I75-Y79 VanDerWaalsContact O-CB 3.25Å; I75-Y79 WeakPolarHBondContact O-CB 3.48Å; I75-Y79 PolarHBondContact O-N 3.41Å; T76-Y79 PolarHBondContact O-N 3.17Å; I77-Y79 VanDerWaalsContact C-N 3.31Å; I77-Y79 PolarHBondContact O-N 3.49Å; Y79-V82 PolarHBondContact O-N 3.05Å; Y79-Q83 WeakPolarHBondContact O-CB 3.48Å; Y79-Q83 PolarHBondContact O-N 2.98Å |
| 80 | R | 91.8 | Very high | 88.1 | Confident | 158 Ų | 158 | 104.3 Ų | 104.3 | 60% | 0.596 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -63 | -45.4 | 175.9 | -61.2 | -134 | 90.3 | -160.6 | 10.1 | 111.2 | T76 I77 I78 V82 Q83 E84 | T76-R80 HydrophobicContact CG2-CG 4.31Å; T76-R80 WeakPolarHBondContact O-CG 3.17Å; T76-R80 PolarHBondContact O-N 3.07Å; I77-R80 PolarHBondContact O-N 3.44Å; I78-R80 PolarHBondContact O-N 3.08Å; R80-V82 PolarHBondContact O-N 3.46Å; R80-Q83 PolarHBondContact O-N 3.49Å; R80-E84 WeakPolarHBondContact O-CB 3.31Å; R80-E84 PolarHBondContact O-N 3.08Å |
| 81 | V | 91.4 | Very high | 86.3 | Confident | 89 Ų | 89 | 108.6 Ų | 108.6 | 54% | 0.539 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.6 | -41.9 | 178.9 | 172.7 | 0 | 0 | 0 | 0 | 111.3 | I77 I78 S85 | I77-V81 HydrophobicContact CG2-CG2 4.39Å; I77-V81 WeakPolarHBondContact O-CB 3.03Å; I77-V81 VanDerWaalsContact O-CG2 3.26Å; I77-V81 WeakPolarHBondContact O-CG2 3.49Å; I77-V81 PolarHBondContact O-N 3.15Å; I78-V81 PolarHBondContact O-N 2.74Å; V81-S85 VanDerWaalsContact O-CB 3.22Å; V81-S85 WeakPolarHBondContact O-CB 3.21Å; V81-S85 PolarHBondContact O-N 2.88Å; V81-S85 PolarHBondContact O-OG 3.44Å |
| 82 | V | 90.6 | Very high | 84.2 | Confident | 65 Ų | 65 | 112.2 Ų | 112.2 | 39% | 0.394 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -69.6 | -40.9 | 177 | 173.7 | 0 | 0 | 0 | 0 | 111.2 | I78 Y79 R80 S85 R86 | I78-V82 HydrophobicContact CG2-CG2 4.16Å; I78-V82 WeakPolarHBondContact O-CB 3.37Å; I78-V82 VanDerWaalsContact O-CG2 3.26Å; I78-V82 WeakPolarHBondContact O-CG2 3.28Å; I78-V82 PolarHBondContact O-N 2.05Å; Y79-V82 PolarHBondContact O-N 3.05Å; R80-V82 PolarHBondContact O-N 3.46Å; V82-S85 WeakPolarHBondContact CA-OG 3.08Å; V82-S85 PolarHBondContact O-OG 3.42Å; V82-R86 WeakPolarHBondContact O-CB 3.02Å; V82-R86 VanDerWaalsContact O-CG 3.32Å; V82-R86 WeakPolarHBondContact O-CG 3.33Å; V82-R86 PolarHBondContact O-N 2.06Å |
| 83 | Q | 87.3 | Confident | 81.8 | Confident | 65 Ų | 65 | 116 Ų | 116 | 30% | 0.304 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -64.8 | -44.8 | 177.6 | -174.8 | -179.5 | 32.3 | 0 | 0 | 111.2 | Y79 R80 R86 R87 | Y79-Q83 WeakPolarHBondContact O-CB 3.48Å; Y79-Q83 PolarHBondContact O-N 2.98Å; R80-Q83 PolarHBondContact O-N 3.49Å; Q83-R86 PolarHBondContact O-N 2.89Å; Q83-R87 WeakPolarHBondContact O-CG 3.05Å; Q83-R87 PolarHBondContact O-N 2.92Å |
| 84 | E | 87.4 | Confident | 79.3 | Confident | 115 Ų | 115 | 117.1 Ų | 117.1 | 54% | 0.537 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -69 | -43.3 | 179.5 | -173 | 166 | -164.9 | 0 | 0 | 111.6 | R80 R86 R87 Q88 | R80-E84 WeakPolarHBondContact O-CB 3.31Å; R80-E84 PolarHBondContact O-N 3.08Å; E84-R86 VanDerWaalsContact C-N 3.32Å; E84-R86 PolarHBondContact O-N 3Å; E84-R87 WeakPolarHBondContact O-CB 3.47Å; E84-R87 PolarHBondContact O-N 3.12Å; E84-R87 VanDerWaalsContact O-N 3.11Å; E84-Q88 WeakPolarHBondContact O-CG 3.37Å; E84-Q88 PolarHBondContact O-N 3.26Å |
| 85 | S | 80.6 | Confident | 77.1 | Confident | 42 Ų | 42 | 120.3 Ų | 120.3 | 29% | 0.294 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.1 | -35.3 | 174.1 | 58.6 | 0 | 0 | 0 | 0 | 112.7 | V81 V82 Q88 R89 | V81-S85 VanDerWaalsContact O-CB 3.22Å; V81-S85 WeakPolarHBondContact O-CB 3.21Å; V81-S85 PolarHBondContact O-N 2.88Å; V81-S85 PolarHBondContact O-OG 3.44Å; V82-S85 WeakPolarHBondContact CA-OG 3.08Å; V82-S85 PolarHBondContact O-OG 3.42Å; S85-Q88 PolarHBondContact O-N 3Å; S85-R89 WeakPolarHBondContact O-CB 3.28Å; S85-R89 VanDerWaalsContact O-CG 3.25Å; S85-R89 WeakPolarHBondContact O-CG 2.97Å; S85-R89 PolarHBondContact O-N 2.03Å |
| 86 | R | 80.3 | Confident | 74.3 | Confident | 188 Ų | 188 | 119.4 Ų | 119.4 | 71% | 0.709 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -66.3 | -37.9 | 171.1 | -77.3 | -170.7 | -178.5 | -143.2 | 2.7 | 112.3 | V82 Q83 E84 R89 A90 | V82-R86 WeakPolarHBondContact O-CB 3.02Å; V82-R86 VanDerWaalsContact O-CG 3.32Å; V82-R86 WeakPolarHBondContact O-CG 3.33Å; V82-R86 PolarHBondContact O-N 2.06Å; Q83-R86 PolarHBondContact O-N 2.89Å; E84-R86 VanDerWaalsContact C-N 3.32Å; E84-R86 PolarHBondContact O-N 3Å; R86-R89 PolarHBondContact O-N 3.39Å; R86-A90 WeakPolarHBondContact O-CB 3.18Å; R86-A90 PolarHBondContact O-N 3.1Å |
| 87 | R | 78.6 | Confident | 72.1 | Confident | 174 Ų | 174 | 123.8 Ų | 123.8 | 66% | 0.657 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -65.6 | -40.6 | 174.2 | -75.6 | -178 | 177.4 | -153.3 | -0.1 | 112.1 | Q83 E84 A90 | Q83-R87 WeakPolarHBondContact O-CG 3.05Å; Q83-R87 PolarHBondContact O-N 2.92Å; E84-R87 WeakPolarHBondContact O-CB 3.47Å; E84-R87 PolarHBondContact O-N 3.12Å; E84-R87 VanDerWaalsContact O-N 3.11Å; R87-A90 PolarHBondContact O-N 3.29Å |
| 88 | Q | 72 | Confident | 70.3 | Confident | 130 Ų | 130 | 124.7 Ų | 124.7 | 61% | 0.607 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -69 | -35.8 | 175.9 | -68.7 | 176.6 | 11.5 | 0 | 0 | 112.2 | E84 S85 A90 I91 | E84-Q88 WeakPolarHBondContact O-CG 3.37Å; E84-Q88 PolarHBondContact O-N 3.26Å; S85-Q88 PolarHBondContact O-N 3Å; Q88-A90 VanDerWaalsContact C-N 3.34Å; Q88-I91 PolarHBondContact O-N 2.76Å |
| 89 | R | 64.8 | Low | 67.4 | Low | 208 Ų | 208 | 129.3 Ų | 129.3 | 79% | 0.785 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -75.5 | -18.1 | 175.4 | -72.4 | 176.2 | -178.7 | -99 | 1.3 | 114.1 | S85 R86 I91 | S85-R89 WeakPolarHBondContact O-CB 3.28Å; S85-R89 VanDerWaalsContact O-CG 3.25Å; S85-R89 WeakPolarHBondContact O-CG 2.97Å; S85-R89 PolarHBondContact O-N 2.03Å; R86-R89 PolarHBondContact O-N 3.39Å; R89-I91 VanDerWaalsContact C-N 3.33Å |
| 90 | A | 60.8 | Low | 64.9 | Low | 79 Ų | 79 | 131.8 Ų | 131.8 | 65% | 0.653 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.1 | -9.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | R86 R87 Q88 | R86-A90 WeakPolarHBondContact O-CB 3.18Å; R86-A90 PolarHBondContact O-N 3.1Å; R87-A90 PolarHBondContact O-N 3.29Å; Q88-A90 VanDerWaalsContact C-N 3.34Å |
| 91 | I | 59.4 | Low | 62.4 | Low | 142 Ų | 142 | 129.8 Ų | 129.8 | 73% | 0.728 | 69% | 0.686 | S | S | * | * | S | Bend | trans | -129.2 | 65.1 | 179.7 | -49.8 | 176.9 | 0 | 0 | 0 | 108.1 | Q88 R89 | Q88-I91 PolarHBondContact O-N 2.76Å; R89-I91 VanDerWaalsContact C-N 3.33Å |
| 92 | P | 54.2 | Low | 60.6 | Low | 106 Ų | 106 | 131 Ų | 131 | 69% | 0.688 | 70% | 0.698 | S | S | * | * | S | Bend | -156.1 | 77 | 113.3 | 33.8 | -11.2 | 0 | 0 | 0 | 112.8 | |||
| 93 | T | 46 | Very low | 57.7 | Low | 131 Ų | 131 | 138 Ų | 138 | 80% | 0.804 | 72% | 0.724 | S | S | * | * | trans | -139 | 49.3 | 163.3 | -44.4 | 0 | 0 | 0 | 0 | 110 | ||||
| 94 | D | 45.7 | Very low | 55.2 | Low | 160 Ų | 160 | 144.4 Ų | 144.4 | 86% | 0.856 | 75% | 0.751 | S | S | * | * | trans | -137.9 | 47.9 | 169.7 | -121.1 | -55.9 | 0 | 0 | 0 | 109.6 | ||||
| 95 | V | 50.6 | Low | 52.9 | Low | 151 Ų | 151 | 143.5 Ų | 143.5 | 92% | 0.915 | 76% | 0.763 | S | S | * | * | trans | -132 | 79.3 | 163.6 | -174.3 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 96 | A | 38.3 | Very low | 50.4 | Low | 99 Ų | 99 | 151.4 Ų | 151.4 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -156.2 | 75.8 | 153.6 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 97 | L | 49.1 | Very low | 48.3 | Very low | 168 Ų | 168 | 148.9 Ų | 148.9 | 88% | 0.88 | 80% | 0.797 | S | S | * | * | trans | -63.5 | 172 | 156.3 | -83.2 | 163.4 | 0 | 0 | 0 | 109.7 | ||||
| 98 | P | 57.2 | Low | 46.2 | Very low | 101 Ų | 101 | 145 Ų | 145 | 66% | 0.656 | 80% | 0.802 | S | S | * | * | cis | -132.3 | 159.9 | -32.9 | 33.6 | -17.8 | 0 | 0 | 0 | 110.9 | ||||
| 99 | H | 34.7 | Very low | 44.2 | Very low | 195 Ų | 195 | 144.1 Ų | 144.1 | 90% | 0.903 | 81% | 0.81 | S | S | * | * | trans | -148.9 | 116 | 151.2 | -122.9 | -88.9 | 0 | 0 | 0 | 113.2 | ||||
| 100 | K | 42.5 | Very low | 42.7 | Very low | 202 Ų | 202 | 139.9 Ų | 139.9 | 88% | 0.878 | 81% | 0.813 | S | S | * | * | trans | -49.3 | 134.7 | 164.7 | -75.6 | 169.3 | 171.1 | 173.3 | 0 | 110.4 | ||||
| 101 | S | 38.8 | Very low | 41.4 | Very low | 116 Ų | 116 | 141.1 Ų | 141.1 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | -156.4 | 103.4 | 127.1 | 68.8 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 102 | S | 53.5 | Low | 40.1 | Very low | 113 Ų | 113 | 140 Ų | 140 | 79% | 0.79 | 82% | 0.821 | S | S | * | * | trans | -52.5 | 130.7 | 156.7 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 103 | K | 30.7 | Very low | 39.2 | Very low | 214 Ų | 214 | 143.9 Ų | 143.9 | 93% | 0.93 | 83% | 0.827 | S | S | * | * | trans | -158.1 | 144.4 | 143.2 | -110 | 169.7 | -172.6 | -178.9 | 0 | 111.5 | ||||
| 104 | K | 35.1 | Very low | 38.4 | Very low | 199 Ų | 199 | 145 Ų | 145 | 87% | 0.865 | 83% | 0.827 | S | S | * | * | trans | -102.7 | 148 | -151.6 | -162.1 | -175.2 | -172.9 | -175.2 | 0 | 110.3 | ||||
| 105 | A | 37.8 | Very low | 37.6 | Very low | 95 Ų | 95 | 141.1 Ų | 141.1 | 79% | 0.785 | 83% | 0.825 | S | S | * | * | trans | 9.2 | 136.4 | 157.1 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 106 | K | 27.8 | Very low | 36.7 | Very low | 208 Ų | 208 | 141.7 Ų | 141.7 | 90% | 0.904 | 82% | 0.823 | S | S | * | * | -160.8 | 124.7 | 128.4 | -155.4 | 158.4 | 179 | 178.3 | 0 | 112.9 | |||||
| 107 | V | 36.8 | Very low | 36.3 | Very low | 135 Ų | 135 | 146.6 Ų | 146.6 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | trans | -80.1 | 159.6 | 169.9 | 168.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 108 | A | 33.8 | Very low | 35.6 | Very low | 92 Ų | 92 | 142.7 Ų | 142.7 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | trans | 117 | 143.1 | 157.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 109 | S | 31.8 | Very low | 34.6 | Very low | 113 Ų | 113 | 144.1 Ų | 144.1 | 79% | 0.79 | 83% | 0.827 | S | S | * | * | cis | 175.3 | 144.4 | -4.8 | 158.9 | 0 | 0 | 0 | 0 | 104 | ||||
| 110 | S | 31.3 | Very low | 34.7 | Very low | 119 Ų | 119 | 140.2 Ų | 140.2 | 83% | 0.832 | 82% | 0.822 | S | S | * | * | trans | -177.7 | 117.4 | 142.9 | 175.1 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 111 | S | 35.3 | Very low | 35 | Very low | 104 Ų | 104 | 136.5 Ų | 136.5 | 73% | 0.727 | 82% | 0.818 | S | S | * | * | trans | -102.6 | 143.4 | 179.9 | 58 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 112 | S | 31.1 | Very low | 34.6 | Very low | 120 Ų | 120 | 134.4 Ų | 134.4 | 84% | 0.839 | 82% | 0.815 | S | S | * | * | trans | 173.5 | 154.5 | 141.5 | 45 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 113 | K | 34.8 | Very low | 34.4 | Very low | 186 Ų | 186 | 135.2 Ų | 135.2 | 81% | 0.809 | 82% | 0.817 | S | S | * | * | cis | -171.5 | 137.1 | -29.9 | -169.5 | 177.4 | -176.8 | -176.6 | 0 | 104.7 | ||||
| 114 | L | 30.7 | Very low | 35.3 | Very low | 154 Ų | 154 | 130.4 Ų | 130.4 | 81% | 0.806 | 81% | 0.808 | S | S | * | * | trans | 26.1 | 132.2 | 158.8 | -79.7 | 102.4 | 0 | 0 | 0 | 122.1 | ||||
| 115 | G | 28.1 | Very low | 35.3 | Very low | 79 Ų | 79 | 126.9 Ų | 126.9 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | trans | -164.7 | 122.3 | 155.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 116 | L | 31.9 | Very low | 35.2 | Very low | 164 Ų | 164 | 127 Ų | 127 | 86% | 0.859 | 81% | 0.809 | S | S | * | * | trans | -80 | 156.3 | -166.2 | -73.1 | 128.2 | 0 | 0 | 0 | 115.9 | ||||
| 117 | K | 29.5 | Very low | 35.5 | Very low | 201 Ų | 201 | 128.7 Ų | 128.7 | 87% | 0.874 | 81% | 0.81 | S | S | * | * | trans | 105.7 | 125.9 | 130.9 | -134.8 | 166 | -178 | 179.9 | 0 | 119.3 | ||||
| 118 | A | 34.7 | Very low | 36 | Very low | 87 Ų | 87 | 127.9 Ų | 127.9 | 72% | 0.719 | 81% | 0.807 | S | S | * | * | trans | -95.1 | 157.5 | 165.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 119 | P | 35.5 | Very low | 35.8 | Very low | 131 Ų | 131 | 128.3 Ų | 128.3 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | -143.1 | 143.7 | 125.1 | 25.6 | -5.1 | 0 | 0 | 0 | 115.1 | |||||
| 120 | S | 37 | Very low | 35.9 | Very low | 113 Ų | 113 | 131.7 Ų | 131.7 | 79% | 0.79 | 81% | 0.81 | S | S | * | * | trans | -76.3 | 175 | 161.7 | -142.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 121 | P | 49.1 | Very low | 36.1 | Very low | 123 Ų | 123 | 135.7 Ų | 135.7 | 80% | 0.799 | 81% | 0.813 | S | S | * | * | cis | -153.6 | 155.9 | 30 | 39.1 | -14.6 | 0 | 0 | 0 | 121.7 | ||||
| 122 | G | 29.8 | Very low | 36.1 | Very low | 72 Ų | 72 | 135.2 Ų | 135.2 | 74% | 0.742 | 81% | 0.81 | S | S | * | * | trans | 76 | 173.8 | 141.1 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 123 | P | 50.1 | Low | 36.3 | Very low | 131 Ų | 131 | 136.2 Ų | 136.2 | 85% | 0.851 | 81% | 0.805 | S | S | * | * | cis | -138.9 | -144 | -42.8 | 33.8 | -8.7 | 0 | 0 | 0 | 113.1 | ||||
| 124 | P | 50.3 | Low | 36.5 | Very low | 113 Ų | 113 | 134 Ų | 134 | 73% | 0.734 | 81% | 0.807 | S | S | * | * | -122.9 | 168.9 | -99.4 | 40.5 | -22.5 | 0 | 0 | 0 | 116.3 | |||||
| 125 | S | 34.7 | Very low | 36.7 | Very low | 125 Ų | 125 | 134 Ų | 134 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | trans | 176.1 | 147.1 | 154.7 | -90.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 126 | A | 34.8 | Very low | 37.1 | Very low | 96 Ų | 96 | 138.8 Ų | 138.8 | 79% | 0.793 | 81% | 0.806 | S | S | * | * | cis | -165.4 | 143.8 | -17.9 | 0 | 0 | 0 | 0 | 0 | 104.4 | ||||
| 127 | R | 34.8 | Very low | 37.4 | Very low | 245 Ų | 245 | 138.6 Ų | 138.6 | 93% | 0.925 | 81% | 0.806 | S | S | * | * | trans | -97 | 170.3 | 160.7 | -106.2 | -173.9 | 179.6 | -157.7 | 1.4 | 107 | ||||
| 128 | P | 46 | Very low | 37.6 | Very low | 118 Ų | 118 | 135 Ų | 135 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | cis | -153 | -164.3 | 31.8 | 38.9 | -14.4 | 0 | 0 | 0 | 116.8 | ||||
| 129 | S | 31.2 | Very low | 37.8 | Very low | 101 Ų | 101 | 136.7 Ų | 136.7 | 71% | 0.706 | 80% | 0.797 | S | S | * | * | trans | 85.9 | 143 | 153.7 | -131.1 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 130 | M | 33.8 | Very low | 37.6 | Very low | 184 Ų | 184 | 136.2 Ų | 136.2 | 91% | 0.906 | 79% | 0.792 | S | S | * | * | cis | -164.5 | 172.7 | 29.9 | -145.8 | 148 | 166.8 | 0 | 0 | 111.1 | ||||
| 131 | K | 36 | Very low | 37.6 | Very low | 202 Ų | 202 | 136.2 Ų | 136.2 | 88% | 0.878 | 79% | 0.787 | S | S | * | * | trans | -124.4 | 140.3 | -166.8 | 174.5 | -168.8 | -178.5 | -173.1 | 0 | 111.5 | ||||
| 132 | S | 35.2 | Very low | 36.9 | Very low | 95 Ų | 95 | 136.7 Ų | 136.7 | 66% | 0.664 | 79% | 0.788 | S | S | * | * | trans | 176.1 | 153.7 | 150.6 | 55.6 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 133 | D | 35.3 | Very low | 37.7 | Very low | 140 Ų | 140 | 139.9 Ų | 139.9 | 75% | 0.749 | 79% | 0.787 | S | S | * | * | -155.8 | 128.4 | 50.1 | -76 | -78.1 | 0 | 0 | 0 | 109.2 | |||||
| 134 | V | 37.8 | Very low | 37.1 | Very low | 139 Ų | 139 | 142.3 Ų | 142.3 | 84% | 0.842 | 79% | 0.787 | S | S | * | * | 63.2 | 113.3 | 89.6 | -178.7 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 135 | D | 34 | Very low | 36.9 | Very low | 154 Ų | 154 | 145.7 Ų | 145.7 | 82% | 0.824 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -80.1 | 160.8 | -174.8 | -168 | -128.4 | 0 | 0 | 0 | 112.2 | ||
| 136 | K | 36.9 | Very low | 37.2 | Very low | 181 Ų | 181 | 145.9 Ų | 145.9 | 79% | 0.787 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -91.7 | 118.4 | -158.9 | -157.1 | 173.9 | 80.1 | 172.4 | 0 | 111.9 | ||
| 137 | D | 38.4 | Very low | 37.7 | Very low | 160 Ų | 160 | 150.7 Ų | 150.7 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -77.2 | 121.5 | 167.1 | -80.1 | -66.3 | 0 | 0 | 0 | 111 | ||
| 138 | D | 34.1 | Very low | 38.1 | Very low | 126 Ų | 126 | 148.1 Ų | 148.1 | 67% | 0.674 | 79% | 0.793 | S | S | * | * | trans | -101.3 | 115.5 | 170.7 | -174.2 | -92.7 | 0 | 0 | 0 | 108 | ||||
| 139 | V | 38.1 | Very low | 38.2 | Very low | 121 Ų | 121 | 149.1 Ų | 149.1 | 73% | 0.733 | 80% | 0.797 | S | S | * | * | trans | -125.1 | 104.3 | 168.6 | 172.3 | 0 | 0 | 0 | 0 | 107.9 | V141 | V139-V141 HydrophobicContact CG1-CG2 4.1Š| ||
| 140 | T | 32.7 | Very low | 38.9 | Very low | 121 Ų | 121 | 153 Ų | 153 | 74% | 0.742 | 80% | 0.804 | S | S | * | * | trans | -78.4 | 116.1 | 170 | 3.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 141 | V | 35.9 | Very low | 39.3 | Very low | 114 Ų | 114 | 155.8 Ų | 155.8 | 69% | 0.691 | 82% | 0.823 | S | S | * | * | trans | -104.9 | 107.8 | 169.5 | 177.1 | 0 | 0 | 0 | 0 | 108.1 | V139 I143 | V139-V141 HydrophobicContact CG1-CG2 4.1Å; V141-I143 HydrophobicContact CG1-CG1 4.24Å | ||
| 142 | T | 34.6 | Very low | 39.5 | Very low | 133 Ų | 133 | 153.5 Ų | 153.5 | 82% | 0.816 | 82% | 0.82 | S | S | * | * | trans | -72.9 | 126.1 | 166.3 | 6.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 143 | I | 46.3 | Very low | 39.7 | Very low | 138 Ų | 138 | 156.6 Ų | 156.6 | 71% | 0.708 | 83% | 0.829 | S | S | * | * | trans | -113.4 | 108.6 | 166 | -58.8 | 177 | 0 | 0 | 0 | 106.1 | V141 E145 | V141-I143 HydrophobicContact CG1-CG1 4.24Å; I143-E145 HydrophobicContact CG2-CG 4.21Å | ||
| 144 | E | 37.9 | Very low | 39.9 | Very low | 183 Ų | 183 | 157.5 Ų | 157.5 | 86% | 0.855 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -81.5 | 116 | 164.7 | -73.9 | -179.5 | 149.3 | 0 | 0 | 107.5 | ||
| 145 | E | 46.1 | Very low | 40.1 | Very low | 184 Ų | 184 | 158.6 Ų | 158.6 | 86% | 0.86 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -91.4 | 120.2 | 167.5 | -69.6 | -172.4 | 133.7 | 0 | 0 | 108.7 | I143 | I143-E145 HydrophobicContact CG2-CG 4.21Š|
| 146 | T | 40.6 | Very low | 40.4 | Very low | 129 Ų | 129 | 158.9 Ų | 158.9 | 79% | 0.791 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 129.9 | 176.1 | 43 | 0 | 0 | 0 | 0 | 111.3 | ||
| 147 | E | 45 | Very low | 40.7 | Very low | 196 Ų | 196 | 157.4 Ų | 157.4 | 92% | 0.916 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 128.9 | 168.5 | -68.1 | -176 | 116.9 | 0 | 0 | 110.8 | ||
| 148 | E | 44.8 | Very low | 40.8 | Very low | 191 Ų | 191 | 157.2 Ų | 157.2 | 89% | 0.893 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -96.7 | 123.2 | 163.8 | -65.7 | -150.2 | 150.9 | 0 | 0 | 109.7 | ||
| 149 | T | 47.2 | Very low | 41.4 | Very low | 139 Ų | 139 | 159.6 Ų | 159.6 | 85% | 0.853 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 139.1 | -180 | -44.4 | 0 | 0 | 0 | 0 | 111.2 | ||
| 150 | E | 45.3 | Very low | 41.6 | Very low | 183 Ų | 183 | 162.8 Ų | 162.8 | 86% | 0.855 | 86% | 0.857 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 137.2 | 171.7 | -61.5 | 177.2 | 126.6 | 0 | 0 | 112.3 | ||
| 151 | D | 43.3 | Very low | 42.5 | Very low | 243 Ų | 243 | 166.6 Ų | 166.6 | 100% | 1.299 | 87% | 0.867 | S | S | * | * | trans | -145.5 | 0 | 151.1 | -120.4 | -47.7 | 0 | 0 | 0 | 109.4 |
Retrieved 151 of 151 residues in 24.8 ms
(Link to these results)