| 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 | 48.4 | Very low | 52.9 | Low | 223 Ų | 223 | 158.9 Ų | 158.9 | 100% | 1.099 | 78% | 0.779 | S | S | * | * | 0 | 146.9 | 0 | -87.4 | 152.5 | 159.3 | 0 | 0 | 108 | |||||
| 2 | E | 44.9 | Very low | 51.8 | Low | 172 Ų | 172 | 156.1 Ų | 156.1 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | trans | 23.4 | 140.4 | 140.6 | -66.2 | 162.4 | 117.5 | 0 | 0 | 119.7 | ||||
| 3 | V | 63 | Low | 51.4 | Low | 129 Ų | 129 | 152.8 Ų | 152.8 | 78% | 0.782 | 77% | 0.772 | S | S | * | * | cis | -138.6 | 145.1 | 22.5 | 176.9 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 4 | S | 52 | Low | 50.8 | Low | 100 Ų | 100 | 152.2 Ų | 152.2 | 70% | 0.699 | 77% | 0.772 | S | S | * | * | trans | -96.4 | 139.9 | 166.5 | -46 | 0 | 0 | 0 | 0 | 112 | ||||
| 5 | K | 66.2 | Low | 50.6 | Low | 182 Ų | 182 | 152.2 Ų | 152.2 | 79% | 0.791 | 77% | 0.773 | S | S | * | * | trans | 176.2 | 144.3 | 147.3 | -96.3 | 142.1 | -167.5 | 175 | 0 | 108.6 | ||||
| 6 | E | 55.1 | Low | 50.2 | Low | 151 Ų | 151 | 149.9 Ų | 149.9 | 71% | 0.706 | 76% | 0.756 | S | S | * | * | cis | 142.5 | 155.9 | -2.7 | -102.3 | 172.3 | -163.5 | 0 | 0 | 105.3 | ||||
| 7 | K | 58.7 | Low | 49.8 | Very low | 159 Ų | 159 | 148.8 Ų | 148.8 | 69% | 0.691 | 75% | 0.752 | S | S | * | * | trans | 74.6 | 137.1 | 171.4 | -62.3 | -178.7 | 162.5 | -74.3 | 0 | 117.3 | ||||
| 8 | E | 50.8 | Low | 49.5 | Very low | 144 Ų | 144 | 144.2 Ų | 144.2 | 67% | 0.673 | 74% | 0.735 | S | S | * | * | cis | -159.5 | 158.5 | -13.4 | -126.9 | 155.4 | -174.9 | 0 | 0 | 113.2 | ||||
| 9 | V | 52.9 | Low | 49.7 | Very low | 113 Ų | 113 | 146.4 Ų | 146.4 | 69% | 0.685 | 75% | 0.745 | S | S | * | * | trans | 49.1 | 98.1 | 162.8 | -167.1 | 0 | 0 | 0 | 0 | 118.8 | F11 | V9-F11 HydrophobicContact CG1-CD2 3.88Š| ||
| 10 | F | 39.3 | Very low | 49.3 | Very low | 180 Ų | 180 | 145.5 Ų | 145.5 | 79% | 0.789 | 74% | 0.742 | S | S | * | * | trans | -70.8 | 143.4 | 143.7 | -111.2 | -106 | 0 | 0 | 0 | 110.2 | ||||
| 11 | F | 50.6 | Low | 49.6 | Very low | 195 Ų | 195 | 144.2 Ų | 144.2 | 86% | 0.855 | 75% | 0.745 | S | S | * | * | trans | -154.7 | 92.7 | 144.2 | -98.2 | -65.4 | 0 | 0 | 0 | 110.8 | V9 | V9-F11 HydrophobicContact CG1-CD2 3.88Š| ||
| 12 | N | 40.2 | Very low | 49.2 | Very low | 125 Ų | 125 | 141.3 Ų | 141.3 | 67% | 0.668 | 73% | 0.734 | S | S | * | * | trans | -83.4 | 145.2 | 159.1 | -80.3 | 11.5 | 0 | 0 | 0 | 109 | ||||
| 13 | S | 46.5 | Very low | 49.7 | Very low | 113 Ų | 113 | 140.4 Ų | 140.4 | 79% | 0.79 | 73% | 0.733 | S | S | * | * | trans | -159.5 | 103.3 | 154.7 | 57.3 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 14 | D | 41.9 | Very low | 48.8 | Very low | 145 Ų | 145 | 139 Ų | 139 | 78% | 0.775 | 73% | 0.729 | S | S | * | * | trans | -67.1 | 149.1 | 174.5 | -41.7 | -104.4 | 0 | 0 | 0 | 111.8 | ||||
| 15 | I | 48.9 | Very low | 48.7 | Very low | 152 Ų | 152 | 142.3 Ų | 142.3 | 78% | 0.779 | 74% | 0.737 | S | S | * | * | trans | -134.2 | 139 | 148.6 | -63.2 | -172.6 | 0 | 0 | 0 | 109.5 | ||||
| 16 | K | 43.9 | Very low | 47.6 | Very low | 116 Ų | 116 | 140.6 Ų | 140.6 | 50% | 0.504 | 74% | 0.736 | S | S | . | * | trans | -132.2 | 130.5 | -170.9 | 156.6 | 175.5 | 177.1 | 172.9 | 0 | 109 | Y201 H202 S203 | K16-Y201 CarbonylContact C-O 3.34Å; K16-Y201 WeakPolarHBondContact CA-O 3.08Å; K16-H202 HydrophobicContact CB-CB 3.91Å; K16-H202 HydrophobicContact CD-CB 4.3Å; K16-H202 WeakPolarHBondContact CE-O 3.23Å; K16-H202 HydrophobicContact CG-CB 3.85Å; K16-H202 WeakPolarHBondContact CG-O 3.37Å; K16-S203 PolarHBondContact NZ-O 3.36Å | ||
| 17 | L | 44.1 | Very low | 46.9 | Very low | 131 Ų | 131 | 139.6 Ų | 139.6 | 69% | 0.686 | 74% | 0.736 | S | S | * | * | trans | -149.9 | 132.2 | 160.4 | -102.8 | 174.8 | 0 | 0 | 0 | 112.4 | Y201 | L17-Y201 CarbonylContact C-O 3.56Å; L17-Y201 PolarHBondContact N-O 2.92Å; L17-Y201 CarbonylContact O-C 3.15Å; L17-Y201 WeakPolarHBondContact O-CA 3.24Å; L17-Y201 PolarHBondContact O-N 3.42Å; L17-Y201 VanDerWaalsContact O-O 3.05Å | ||
| 18 | S | 42.7 | Very low | 46.4 | Very low | 65 Ų | 65 | 140.9 Ų | 140.9 | 46% | 0.455 | 75% | 0.746 | S | S | . | * | trans | -71.3 | 161.6 | 178.6 | -166.8 | 0 | 0 | 0 | 0 | 112.7 | D20 | S18-D20 PolarHBondContact OG-OD2 3.25Š| ||
| 19 | M | 54 | Low | 45.9 | Very low | 187 Ų | 187 | 140.1 Ų | 140.1 | 92% | 0.921 | 75% | 0.747 | S | S | * | * | trans | -145.5 | 98 | 144.3 | -115.8 | -178.7 | -174.9 | 0 | 0 | 110.7 | ||||
| 20 | D | 41.5 | Very low | 45.2 | Very low | 128 Ų | 128 | 141.7 Ų | 141.7 | 68% | 0.684 | 75% | 0.752 | S | S | * | * | trans | -71.1 | 154.7 | 173.2 | -58.4 | -85.9 | 0 | 0 | 0 | 111.3 | S18 | S18-D20 PolarHBondContact OG-OD2 3.25Š| ||
| 21 | C | 56.8 | Low | 45.5 | Very low | 119 Ų | 119 | 143.3 Ų | 143.3 | 80% | 0.804 | 76% | 0.759 | S | S | * | * | trans | -129.7 | 78.6 | 176.7 | -86.6 | 0 | 0 | 0 | 0 | 110.7 | I23 | C21-I23 PolarHBondContact O-N 3.32Š| ||
| 22 | D | 40.1 | Very low | 45.1 | Very low | 162 Ų | 162 | 139.5 Ų | 139.5 | 87% | 0.866 | 75% | 0.752 | S | S | * | * | trans | -62.5 | 100.3 | 171.1 | -75.9 | -48.4 | 0 | 0 | 0 | 111.2 | ||||
| 23 | I | 55.3 | Low | 45.2 | Very low | 152 Ų | 152 | 138.9 Ų | 138.9 | 78% | 0.779 | 75% | 0.752 | S | S | * | * | trans | -97.8 | 96.8 | 164.9 | -58.6 | 179.7 | 0 | 0 | 0 | 106.9 | C21 I25 | C21-I23 PolarHBondContact O-N 3.32Å; I23-I25 PolarHBondContact O-N 3.05Å; I23-I25 VanDerWaalsContact O-N 3.13Å | ||
| 24 | S | 43.7 | Very low | 45.4 | Very low | 101 Ų | 101 | 141.1 Ų | 141.1 | 71% | 0.706 | 75% | 0.75 | S | S | * | * | trans | -61.8 | 113 | -172.5 | 54.3 | 0 | 0 | 0 | 0 | 112.5 | N26 | S24-N26 VanDerWaalsContact C-N 3.34Å; S24-N26 PolarHBondContact O-N 3.01Å | ||
| 25 | I | 50.4 | Low | 45.6 | Very low | 169 Ų | 169 | 139.8 Ų | 139.8 | 87% | 0.867 | 74% | 0.743 | S | S | * | * | trans | -79.1 | 86.2 | 172.1 | -54.9 | 177.4 | 0 | 0 | 0 | 107.9 | I23 | I23-I25 PolarHBondContact O-N 3.05Å; I23-I25 VanDerWaalsContact O-N 3.13Å | ||
| 26 | N | 41.8 | Very low | 45.5 | Very low | 145 Ų | 145 | 140.8 Ų | 140.8 | 78% | 0.775 | 74% | 0.744 | S | S | * | * | trans | -144.4 | 131.8 | 175 | -97.9 | -45.3 | 0 | 0 | 0 | 113.2 | S24 | S24-N26 VanDerWaalsContact C-N 3.34Å; S24-N26 PolarHBondContact O-N 3.01Å | ||
| 27 | N | 39.8 | Very low | 45.8 | Very low | 130 Ų | 130 | 139.1 Ų | 139.1 | 70% | 0.695 | 75% | 0.747 | S | S | * | * | trans | 58 | 81.8 | 157.3 | -165.1 | 27.9 | 0 | 0 | 0 | 118.9 | ||||
| 28 | M | 48.6 | Very low | 45.8 | Very low | 186 Ų | 186 | 139.7 Ų | 139.7 | 92% | 0.916 | 76% | 0.756 | S | S | * | * | trans | -136.4 | 81.3 | 146.2 | -86.5 | -64 | 157.6 | 0 | 0 | 110.1 | ||||
| 29 | N | 40.5 | Very low | 46.5 | Very low | 129 Ų | 129 | 142.7 Ų | 142.7 | 69% | 0.69 | 77% | 0.766 | S | S | * | * | trans | -77.7 | 159.6 | 162.8 | -79.7 | -34.6 | 0 | 0 | 0 | 110.3 | ||||
| 30 | N | 37.5 | Very low | 46.1 | Very low | 146 Ų | 146 | 139.7 Ų | 139.7 | 78% | 0.781 | 75% | 0.754 | S | S | * | * | trans | 63.8 | 91.9 | 167 | -53.1 | -19.3 | 0 | 0 | 0 | 116.8 | ||||
| 31 | F | 47.4 | Very low | 46.8 | Very low | 214 Ų | 214 | 140 Ų | 140 | 94% | 0.939 | 75% | 0.754 | S | S | * | * | trans | -131 | 120.6 | 139.4 | -106.4 | -81.9 | 0 | 0 | 0 | 110.1 | ||||
| 32 | T | 40.8 | Very low | 46.2 | Very low | 115 Ų | 115 | 138.5 Ų | 138.5 | 71% | 0.706 | 75% | 0.746 | S | S | * | * | trans | -76.7 | 135 | -171.1 | -52.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 33 | V | 44 | Very low | 46.6 | Very low | 111 Ų | 111 | 136.7 Ų | 136.7 | 67% | 0.673 | 74% | 0.735 | S | S | * | * | trans | -87.4 | 108.7 | 171.3 | -178.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 34 | H | 48.7 | Very low | 46.5 | Very low | 160 Ų | 160 | 134.2 Ų | 134.2 | 74% | 0.741 | 73% | 0.727 | S | S | * | * | trans | -104.5 | 107.8 | 148 | -70.7 | -92.7 | 0 | 0 | 0 | 105.5 | ||||
| 35 | N | 48 | Very low | 46.9 | Very low | 118 Ų | 118 | 135.1 Ų | 135.1 | 63% | 0.631 | 73% | 0.731 | S | S | * | * | 67.5 | 151.9 | 58.8 | -70.7 | -15.3 | 0 | 0 | 0 | 114.1 | |||||
| 36 | E | 45.5 | Very low | 46.7 | Very low | 172 Ų | 172 | 133.8 Ų | 133.8 | 80% | 0.804 | 73% | 0.726 | S | S | * | * | trans | 76.1 | 143.9 | 168.5 | -65.2 | 166.5 | -128.5 | 0 | 0 | 117.4 | ||||
| 37 | S | 49.6 | Very low | 47.1 | Very low | 81 Ų | 81 | 131 Ų | 131 | 57% | 0.566 | 72% | 0.717 | S | S | * | * | cis | -164.5 | 125.7 | -20.5 | 46.8 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 38 | V | 46.2 | Very low | 47.6 | Very low | 144 Ų | 144 | 131.6 Ų | 131.6 | 87% | 0.873 | 72% | 0.72 | S | S | * | * | trans | -155.4 | 97.6 | 169.6 | -176.5 | 0 | 0 | 0 | 0 | 105.1 | ||||
| 39 | L | 57.3 | Low | 47.5 | Very low | 128 Ų | 128 | 130.1 Ų | 130.1 | 67% | 0.67 | 71% | 0.711 | S | S | * | * | cis | 56 | 115.4 | 42 | -59.4 | -179.6 | 0 | 0 | 0 | 112.5 | ||||
| 40 | D | 45.4 | Very low | 47.9 | Very low | 123 Ų | 123 | 125.5 Ų | 125.5 | 66% | 0.658 | 69% | 0.689 | S | S | * | * | cis | -159.6 | 173.7 | 0.6 | -143.2 | 2.3 | 0 | 0 | 0 | 112.9 | ||||
| 41 | L | 55.4 | Low | 48.3 | Very low | 134 Ų | 134 | 124.4 Ų | 124.4 | 70% | 0.702 | 68% | 0.677 | S | S | * | * | trans | 15.8 | 142.4 | 151.4 | -65.2 | 167.5 | 0 | 0 | 0 | 120.2 | ||||
| 42 | S | 43.6 | Very low | 48.3 | Very low | 89 Ų | 89 | 119 Ų | 119 | 62% | 0.622 | 66% | 0.664 | S | S | * | * | -171.8 | 138.7 | 50.9 | 41.3 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 43 | L | 48.7 | Very low | 48.1 | Very low | 124 Ų | 124 | 122.2 Ų | 122.2 | 65% | 0.649 | 67% | 0.671 | S | S | * | * | trans | 57.6 | 150.6 | 133.6 | -53.6 | 173.6 | 0 | 0 | 0 | 119.1 | N236 | L43-N236 PolarHBondContact O-ND2 3.33Š| ||
| 44 | T | 54.3 | Low | 48 | Very low | 99 Ų | 99 | 127.9 Ų | 127.9 | 61% | 0.607 | 68% | 0.682 | S | S | * | * | cis | -155.5 | 166.9 | 7.7 | 2.9 | 0 | 0 | 0 | 0 | 109.4 | N236 | T44-N236 PolarHBondContact N-ND2 3.17Å; T44-N236 PolarHBondContact OG1-ND2 3.17Å | ||
| 45 | P | 51.4 | Low | 47.5 | Very low | 120 Ų | 120 | 123.3 Ų | 123.3 | 78% | 0.779 | 68% | 0.678 | S | S | * | * | trans | -123.3 | -150.6 | -145.7 | 47.3 | -38.4 | 0 | 0 | 0 | 115.9 | ||||
| 46 | N | 47 | Very low | 47.2 | Very low | 142 Ų | 142 | 127.2 Ų | 127.2 | 76% | 0.759 | 69% | 0.689 | S | S | * | * | trans | 91.9 | 135.6 | 174.2 | -139.5 | 20.3 | 0 | 0 | 0 | 113.8 | ||||
| 47 | S | 49.2 | Very low | 47.4 | Very low | 86 Ų | 86 | 124.7 Ų | 124.7 | 60% | 0.601 | 69% | 0.686 | S | S | * | * | cis | -139.8 | 141.7 | 6.9 | 58.7 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 48 | N | 50.5 | Low | 46.6 | Very low | 142 Ų | 142 | 128.7 Ų | 128.7 | 76% | 0.759 | 70% | 0.701 | S | S | * | * | trans | 21.1 | 111 | 138.4 | -45.9 | -11.4 | 0 | 0 | 0 | 118.5 | ||||
| 49 | E | 46.4 | Very low | 46.4 | Very low | 155 Ų | 155 | 127 Ų | 127 | 72% | 0.724 | 70% | 0.696 | S | S | * | * | -148.2 | -163 | 114.4 | -144.2 | 171.1 | -134.2 | 0 | 0 | 109 | N229 | E49-N229 VanDerWaalsContact C-CG 3.5Å; E49-N229 VanDerWaalsContact C-ND2 3.27Å; E49-N229 WeakPolarHBondContact O-CB 3.48Å; E49-N229 PolarHBondContact O-N 3.47Å; E49-N229 VanDerWaalsContact O-N 3.07Å; E49-N229 PolarHBondContact O-ND2 3.04Å | |||
| 50 | S | 48.7 | Very low | 45.3 | Very low | 32 Ų | 32 | 129.3 Ų | 129.3 | 22% | 0.224 | 70% | 0.702 | C | S | . | * | trans | -171.1 | 152.7 | -138.8 | 23.3 | 0 | 0 | 0 | 0 | 119.3 | V227 N229 | S50-V227 WeakPolarHBondContact O-CG2 3.44Å; S50-V227 WeakPolarHBondContact OG-CG1 3.44Å; S50-V227 VanDerWaalsContact OG-CG2 3.3Å; S50-V227 WeakPolarHBondContact OG-CG2 3.49Å; S50-N229 WeakPolarHBondContact CA-OD1 3.43Å; S50-N229 VanDerWaalsContact N-CG 3.29Å; S50-N229 PolarHBondContact N-ND2 3Å | ||
| 51 | F | 46.1 | Very low | 44.9 | Very low | 123 Ų | 123 | 131.8 Ų | 131.8 | 54% | 0.539 | 72% | 0.715 | S | S | . | * | trans | 144.9 | 165.4 | 156.1 | -102.1 | -42.3 | 0 | 0 | 0 | 112.8 | P226 V227 S228 N229 | F51-P226 HydrophobicContact CE1-CB 4.35Å; F51-P226 HydrophobicContact CZ-CB 4.17Å; F51-V227 HydrophobicContact CB-CG2 3.98Å; F51-V227 HydrophobicContact CD1-CB 3.81Å; F51-V227 HydrophobicContact CD1-CG2 3.85Å; F51-V227 HydrophobicContact CD2-CB 4.06Å; F51-V227 HydrophobicContact CD2-CG2 3.24Å; F51-V227 HydrophobicContact CE1-CB 3.98Å; F51-V227 HydrophobicContact CE1-CG2 4.23Å; F51-V227 HydrophobicContact CE2-CB 4.13Å; F51-V227 HydrophobicContact CE2-CG2 3.6Å; F51-V227 HydrophobicContact CG-CB 3.9Å; F51-V227 HydrophobicContact CG-CG2 3.38Å; F51-V227 HydrophobicContact CZ-CB 4.12Å; F51-V227 HydrophobicContact CZ-CG2 4.1Å; F51-S228 PolarHBondContact N-O 3.07Å; F51-N229 PolarHBondContact N-OD1 3.09Å; F51-N229 VanDerWaalsContact N-OD1 3.17Å | ||
| 52 | P | 47.2 | Very low | 43.9 | Very low | 100 Ų | 100 | 128.6 Ų | 128.6 | 65% | 0.649 | 70% | 0.704 | S | S | * | * | trans | -128.5 | -170.4 | -140.3 | 38.7 | -15.2 | 0 | 0 | 0 | 115.3 | ||||
| 53 | Q | 36.5 | Very low | 43.5 | Very low | 184 Ų | 184 | 135 Ų | 135 | 86% | 0.86 | 72% | 0.716 | S | S | * | * | trans | -66.3 | 142.3 | 176 | -61.3 | 164 | -48.1 | 0 | 0 | 113 | ||||
| 54 | Y | 42 | Very low | 42.9 | Very low | 229 Ų | 229 | 132.4 Ų | 132.4 | 90% | 0.898 | 72% | 0.719 | S | S | * | * | trans | -130.3 | 126 | 147.7 | -99.3 | -82.6 | 0 | 0 | 0 | 109.3 | ||||
| 55 | G | 39.6 | Very low | 42 | Very low | 64 Ų | 64 | 135.4 Ų | 135.4 | 66% | 0.66 | 73% | 0.73 | S | S | * | * | trans | -98.9 | 147.6 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 56 | K | 41.7 | Very low | 41.5 | Very low | 201 Ų | 201 | 136 Ų | 136 | 87% | 0.874 | 73% | 0.732 | S | S | * | * | trans | -138 | 110.9 | 157 | -75.9 | -177 | 174.9 | 176.8 | 0 | 107 | ||||
| 57 | T | 49 | Very low | 41 | Very low | 118 Ų | 118 | 135.9 Ų | 135.9 | 72% | 0.724 | 73% | 0.731 | S | S | * | * | 67 | 83.3 | 61.7 | 73.5 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 58 | N | 33.5 | Very low | 40.5 | Very low | 165 Ų | 165 | 137.6 Ų | 137.6 | 88% | 0.882 | 74% | 0.742 | S | S | * | * | trans | 24.9 | 109.1 | 139.7 | -57.4 | -9.5 | 0 | 0 | 0 | 120.2 | ||||
| 59 | S | 40.1 | Very low | 39.7 | Very low | 110 Ų | 110 | 136.3 Ų | 136.3 | 77% | 0.769 | 74% | 0.739 | S | S | * | * | trans | -161.1 | 106.8 | 131.7 | 49.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 60 | H | 34.4 | Very low | 39.3 | Very low | 175 Ų | 175 | 135 Ų | 135 | 81% | 0.81 | 74% | 0.742 | S | S | * | * | 52.3 | 76.3 | 79.4 | -165 | -72.5 | 0 | 0 | 0 | 112.9 | |||||
| 61 | L | 37.6 | Very low | 38.6 | Very low | 175 Ų | 175 | 140.9 Ų | 140.9 | 92% | 0.916 | 77% | 0.768 | S | S | * | * | trans | -116.1 | 140.1 | 156.8 | -86.4 | 164.4 | 0 | 0 | 0 | 108.4 | ||||
| 62 | S | 33.6 | Very low | 38.3 | Very low | 67 Ų | 67 | 145.8 Ų | 145.8 | 47% | 0.469 | 78% | 0.784 | S | S | . | * | trans | -122.8 | 175.9 | 180 | -169.1 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 63 | Y | 36 | Very low | 37.9 | Very low | 225 Ų | 225 | 145.4 Ų | 145.4 | 88% | 0.882 | 78% | 0.784 | S | S | * | * | trans | 67.8 | 145.6 | -179.7 | -35.1 | -72.1 | 0 | 0 | 0 | 113.9 | ||||
| 64 | G | 36.6 | Very low | 38 | Very low | 69 Ų | 69 | 142.7 Ų | 142.7 | 71% | 0.711 | 78% | 0.775 | S | S | * | * | cis | -156 | 154.6 | -6.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 65 | L | 34.3 | Very low | 38.1 | Very low | 162 Ų | 162 | 139.8 Ų | 139.8 | 85% | 0.848 | 77% | 0.774 | S | S | * | * | trans | -84.7 | 129.8 | -176.4 | -71.8 | 167.2 | 0 | 0 | 0 | 111.7 | ||||
| 66 | T | 40.8 | Very low | 38.5 | Very low | 131 Ų | 131 | 141 Ų | 141 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | -129.5 | 94.4 | 162.5 | 55.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 67 | N | 37.1 | Very low | 38.8 | Very low | 141 Ų | 141 | 138.4 Ų | 138.4 | 75% | 0.754 | 77% | 0.768 | S | S | * | * | trans | -78.6 | 125.4 | 175.4 | -74.8 | -13 | 0 | 0 | 0 | 110.5 | ||||
| 68 | C | 39.7 | Very low | 38.8 | Very low | 121 Ų | 121 | 140.5 Ų | 140.5 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -127.4 | 92.3 | 165.9 | -65.9 | 0 | 0 | 0 | 0 | 108.8 | T70 | C68-T70 PolarHBondContact O-N 3.43Š| ||
| 69 | T | 33.3 | Very low | 39.5 | Very low | 116 Ų | 116 | 141.8 Ų | 141.8 | 71% | 0.712 | 77% | 0.771 | S | S | * | * | trans | -69.6 | 123.2 | -178.6 | -54.8 | 0 | 0 | 0 | 0 | 111.2 | M71 | T69-M71 HydrophobicContact CG2-CG 4.33Å; T69-M71 HydrophobicContact CG2-SD 4.25Å | ||
| 70 | T | 37.5 | Very low | 39.8 | Very low | 127 Ų | 127 | 143.7 Ų | 143.7 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | trans | -96.2 | 108.4 | 159.8 | -56.7 | 0 | 0 | 0 | 0 | 108.6 | C68 | C68-T70 PolarHBondContact O-N 3.43Š| ||
| 71 | M | 34.1 | Very low | 40.2 | Very low | 156 Ų | 156 | 145.4 Ų | 145.4 | 77% | 0.768 | 77% | 0.774 | S | S | * | * | trans | -68.8 | 139.9 | 168.5 | -60.8 | -79.9 | -83.2 | 0 | 0 | 108.8 | T69 | T69-M71 HydrophobicContact CG2-CG 4.33Å; T69-M71 HydrophobicContact CG2-SD 4.25Å | ||
| 72 | Y | 39.5 | Very low | 40.7 | Very low | 226 Ų | 226 | 148.3 Ų | 148.3 | 89% | 0.886 | 77% | 0.774 | S | S | * | * | trans | -126.1 | 122.1 | 157.3 | -128.5 | -87.5 | 0 | 0 | 0 | 109.1 | ||||
| 73 | S | 39.2 | Very low | 41.1 | Very low | 91 Ų | 91 | 150.5 Ų | 150.5 | 64% | 0.636 | 79% | 0.79 | S | S | * | * | trans | -81.8 | 171.6 | -173 | -50.5 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 74 | D | 37.9 | Very low | 41.6 | Very low | 127 Ų | 127 | 146.7 Ų | 146.7 | 68% | 0.679 | 79% | 0.789 | S | S | * | * | trans | 21.2 | 107.7 | 153.2 | -75.9 | -81.2 | 0 | 0 | 0 | 118.8 | S76 | D74-S76 PolarHBondContact OD1-OG 3.12Š| ||
| 75 | L | 45.4 | Very low | 42 | Very low | 168 Ų | 168 | 153 Ų | 153 | 88% | 0.88 | 80% | 0.801 | S | S | * | * | trans | -118 | 64.8 | 146.9 | -75.3 | 175.4 | 0 | 0 | 0 | 109.1 | D77 | L75-D77 PolarHBondContact O-N 2.78Å; L75-D77 VanDerWaalsContact O-N 3.14Å | ||
| 76 | S | 46.4 | Very low | 42.3 | Very low | 89 Ų | 89 | 156.7 Ų | 156.7 | 62% | 0.622 | 80% | 0.803 | S | S | * | * | trans | -78.7 | 21.6 | 178.8 | -66.1 | 0 | 0 | 0 | 0 | 113.2 | D74 | D74-S76 PolarHBondContact OD1-OG 3.12Š| ||
| 77 | D | 48.5 | Very low | 42.2 | Very low | 147 Ų | 147 | 157 Ų | 157 | 79% | 0.786 | 81% | 0.805 | S | S | * | * | trans | -121.6 | 56.5 | -164.6 | -79.7 | -39.6 | 0 | 0 | 0 | 114 | L75 | L75-D77 PolarHBondContact O-N 2.78Å; L75-D77 VanDerWaalsContact O-N 3.14Å | ||
| 78 | I | 49.6 | Very low | 42.7 | Very low | 163 Ų | 163 | 157.2 Ų | 157.2 | 84% | 0.836 | 81% | 0.806 | S | S | * | * | trans | -134 | 84.6 | 159 | -52.1 | -179.7 | 0 | 0 | 0 | 108.9 | ||||
| 79 | K | 46.8 | Very low | 42.6 | Very low | 191 Ų | 191 | 160.1 Ų | 160.1 | 83% | 0.83 | 81% | 0.807 | S | S | * | * | trans | -120 | -11.9 | 179.8 | -118.4 | 173.9 | -177.5 | 171.5 | 0 | 115.3 | ||||
| 80 | D | 48 | Very low | 42.8 | Very low | 151 Ų | 151 | 161.1 Ų | 161.1 | 81% | 0.807 | 81% | 0.813 | S | S | * | * | trans | -112.4 | 64.4 | -166.3 | -61.9 | -47.5 | 0 | 0 | 0 | 113.3 | ||||
| 81 | Y | 42.4 | Very low | 43.3 | Very low | 211 Ų | 211 | 161.7 Ų | 161.7 | 83% | 0.827 | 81% | 0.81 | S | S | * | * | trans | -136.7 | 16 | 176.5 | -125.1 | -89.4 | 0 | 0 | 0 | 116.5 | ||||
| 82 | Y | 47.8 | Very low | 43.4 | Very low | 235 Ų | 235 | 158.5 Ų | 158.5 | 92% | 0.922 | 80% | 0.803 | S | S | * | * | trans | -123.6 | 64 | 176.4 | -82.8 | -80.3 | 0 | 0 | 0 | 112.4 | ||||
| 83 | S | 41.7 | Very low | 43.3 | Very low | 114 Ų | 114 | 152.4 Ų | 152.4 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | trans | -143.3 | 33.7 | -175.4 | -69.1 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 84 | V | 47.8 | Very low | 43.4 | Very low | 144 Ų | 144 | 154.1 Ų | 154.1 | 87% | 0.873 | 80% | 0.795 | S | S | * | * | trans | -137.4 | 36.8 | -177.5 | -149.7 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 85 | E | 45.4 | Very low | 43.8 | Very low | 203 Ų | 203 | 156.1 Ų | 156.1 | 95% | 0.949 | 80% | 0.8 | S | S | * | * | trans | -128.5 | 86.2 | 165.4 | -71 | -166.4 | 159.1 | 0 | 0 | 111 | ||||
| 86 | R | 39.5 | Very low | 43.5 | Very low | 238 Ų | 238 | 156 Ų | 156 | 90% | 0.898 | 80% | 0.795 | S | S | * | * | trans | -153.3 | 56.8 | 170.9 | -162.1 | -157.6 | -71.8 | 179.2 | -3.4 | 113 | ||||
| 87 | T | 39.6 | Very low | 43 | Very low | 137 Ų | 137 | 157.3 Ų | 157.3 | 84% | 0.84 | 80% | 0.8 | S | S | * | * | trans | -159.4 | 164.4 | 167.5 | 4.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 88 | L | 45.8 | Very low | 42.9 | Very low | 147 Ų | 147 | 158.4 Ų | 158.4 | 77% | 0.77 | 80% | 0.804 | S | S | * | * | trans | 77.7 | 40.4 | 177 | -51.6 | 178.3 | 0 | 0 | 0 | 117.2 | I91 | L88-I91 HydrophobicContact CD2-CD1 4.17Š| ||
| 89 | E | 38 | Very low | 42.4 | Very low | 181 Ų | 181 | 154.2 Ų | 154.2 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | -67.2 | 157.6 | 129.7 | -70.8 | -176 | 121.6 | 0 | 0 | 109.5 | |||||
| 90 | T | 38.2 | Very low | 42.1 | Very low | 138 Ų | 138 | 151.4 Ų | 151.4 | 85% | 0.847 | 79% | 0.788 | S | S | * | * | trans | 70.5 | 59.6 | 165.6 | -37.7 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 91 | I | 47.3 | Very low | 41.8 | Very low | 139 Ų | 139 | 151.1 Ų | 151.1 | 71% | 0.713 | 79% | 0.786 | S | S | * | * | trans | -128.6 | 111.7 | 149.1 | -59.4 | -177.2 | 0 | 0 | 0 | 110.3 | L88 | L88-I91 HydrophobicContact CD2-CD1 4.17Š| ||
| 92 | S | 36.8 | Very low | 42.2 | Very low | 89 Ų | 89 | 146.3 Ų | 146.3 | 62% | 0.622 | 78% | 0.784 | S | S | * | * | trans | 33.2 | 116.9 | 148.9 | -141.2 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 93 | S | 36.4 | Very low | 42.3 | Very low | 97 Ų | 97 | 142.5 Ų | 142.5 | 68% | 0.678 | 78% | 0.78 | S | S | * | * | 55 | 141.8 | 55.6 | -159.5 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 94 | N | 41.2 | Very low | 42.7 | Very low | 127 Ų | 127 | 144.5 Ų | 144.5 | 68% | 0.679 | 78% | 0.781 | S | S | * | * | trans | 76.6 | 93.7 | 172.5 | -41.1 | -18.9 | 0 | 0 | 0 | 115.4 | ||||
| 95 | H | 46.5 | Very low | 42.7 | Very low | 169 Ų | 169 | 143 Ų | 143 | 78% | 0.782 | 78% | 0.777 | S | S | * | * | -175.3 | 99.6 | 111.4 | -90.1 | -65.1 | 0 | 0 | 0 | 107.2 | |||||
| 96 | Q | 40.4 | Very low | 42.8 | Very low | 166 Ų | 166 | 137 Ų | 137 | 78% | 0.776 | 77% | 0.77 | S | S | * | * | 93.4 | 103.6 | 73.5 | -176.2 | 168.2 | 13 | 0 | 0 | 110.9 | |||||
| 97 | T | 35.6 | Very low | 43.2 | Very low | 117 Ų | 117 | 132.1 Ų | 132.1 | 72% | 0.718 | 77% | 0.767 | S | S | * | * | trans | -63.1 | 141.2 | -176.1 | -24.9 | 0 | 0 | 0 | 0 | 112.6 | S99 | T97-S99 WeakPolarHBondContact CG2-OG 3.45Š| ||
| 98 | I | 47.1 | Very low | 43.5 | Very low | 169 Ų | 169 | 133.4 Ų | 133.4 | 87% | 0.867 | 77% | 0.767 | S | S | * | * | trans | -110.9 | 108.9 | 151.9 | -63.8 | 178 | 0 | 0 | 0 | 106 | ||||
| 99 | S | 37.3 | Very low | 43.6 | Very low | 76 Ų | 76 | 133.9 Ų | 133.9 | 53% | 0.531 | 77% | 0.771 | S | S | . | * | trans | -98.3 | 130.5 | 178.1 | -59.8 | 0 | 0 | 0 | 0 | 110.9 | T97 | T97-S99 WeakPolarHBondContact CG2-OG 3.45Š| ||
| 100 | T | 42.3 | Very low | 44.3 | Very low | 131 Ų | 131 | 130.9 Ų | 130.9 | 80% | 0.804 | 77% | 0.77 | S | S | * | * | trans | -149.8 | 91.9 | 147.1 | 45.3 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 101 | D | 41.3 | Very low | 45.1 | Very low | 145 Ų | 145 | 127 Ų | 127 | 78% | 0.775 | 76% | 0.757 | S | S | * | * | 67.8 | 76.6 | 76.5 | -64.9 | -18 | 0 | 0 | 0 | 113.4 | |||||
| 102 | S | 50.6 | Low | 45.5 | Very low | 111 Ų | 111 | 127.9 Ų | 127.9 | 78% | 0.776 | 76% | 0.763 | S | S | * | * | -170.8 | 137.8 | 117.6 | 49.3 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 103 | N | 49.6 | Very low | 46.9 | Very low | 155 Ų | 155 | 133.3 Ų | 133.3 | 83% | 0.829 | 77% | 0.772 | S | S | * | * | trans | 0.7 | 134.6 | 155 | -41.4 | -24.4 | 0 | 0 | 0 | 117 | ||||
| 104 | D | 50 | Low | 48.6 | Very low | 156 Ų | 156 | 135.4 Ų | 135.4 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | cis | -146.6 | -177.7 | 42.9 | -147.2 | -33.2 | 0 | 0 | 0 | 114 | ||||
| 105 | S | 48.4 | Very low | 50.4 | Low | 111 Ų | 111 | 132.6 Ų | 132.6 | 78% | 0.776 | 76% | 0.763 | S | S | * | * | trans | -88.7 | 140.6 | -170.8 | 55.8 | 0 | 0 | 0 | 0 | 114 | ||||
| 106 | G | 46.4 | Very low | 52 | Low | 79 Ų | 79 | 131.8 Ų | 131.8 | 81% | 0.814 | 76% | 0.764 | S | S | * | * | trans | -173.4 | 81.7 | -175.1 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 107 | V | 49.5 | Very low | 54 | Low | 135 Ų | 135 | 129.7 Ų | 129.7 | 82% | 0.818 | 76% | 0.757 | S | S | * | * | trans | -17.9 | 117 | 170.6 | -177.9 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 108 | L | 44.1 | Very low | 56.3 | Low | 163 Ų | 163 | 126.9 Ų | 126.9 | 85% | 0.853 | 74% | 0.74 | S | S | * | * | trans | 27 | 125.6 | 140.5 | -54.5 | 173.8 | 0 | 0 | 0 | 120.8 | ||||
| 109 | N | 48.4 | Very low | 58 | Low | 158 Ų | 158 | 121.7 Ų | 121.7 | 85% | 0.845 | 72% | 0.717 | S | S | * | * | trans | -151.4 | 123.4 | 134.5 | -160.4 | -6.5 | 0 | 0 | 0 | 112.2 | G111 | N109-G111 VanDerWaalsContact C-N 3.32Å; N109-G111 PolarHBondContact O-N 2.88Å; N109-G111 VanDerWaalsContact O-N 3.12Å | ||
| 110 | S | 53.7 | Low | 60.1 | Low | 118 Ų | 118 | 123 Ų | 123 | 83% | 0.825 | 72% | 0.723 | S | S | * | * | trans | -88 | 63 | -178.8 | 59.7 | 0 | 0 | 0 | 0 | 112 | ||||
| 111 | G | 54.9 | Low | 61.9 | Low | 57 Ų | 57 | 123.9 Ų | 123.9 | 59% | 0.588 | 72% | 0.718 | S | S | * | * | trans | -74.6 | 143.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | N109 Y113 | N109-G111 VanDerWaalsContact C-N 3.32Å; N109-G111 PolarHBondContact O-N 2.88Å; N109-G111 VanDerWaalsContact O-N 3.12Å; G111-Y113 PolarHBondContact O-N 3.11Å | ||
| 112 | N | 54.9 | Low | 63.8 | Low | 157 Ų | 157 | 122.6 Ų | 122.6 | 84% | 0.84 | 71% | 0.708 | S | S | * | * | trans | -62.9 | 100.4 | 177.7 | -75.2 | -42.3 | 0 | 0 | 0 | 111.1 | I114 | N112-I114 PolarHBondContact O-N 3.05Š| ||
| 113 | Y | 66.5 | Low | 65.1 | Low | 202 Ų | 202 | 122 Ų | 122 | 79% | 0.792 | 70% | 0.696 | S | S | * | * | trans | -73.4 | 87.9 | 177.6 | -165.5 | -90.6 | 0 | 0 | 0 | 110.1 | G111 P115 | G111-Y113 PolarHBondContact O-N 3.11Å; Y113-P115 VanDerWaalsContact O-CD 3.29Å; Y113-P115 WeakPolarHBondContact O-CD 3.47Å | ||
| 114 | I | 71.9 | Confident | 66.4 | Low | 142 Ų | 142 | 120.7 Ų | 120.7 | 73% | 0.728 | 69% | 0.688 | S | S | * | * | trans | -63.9 | 114.6 | 164.6 | -61.9 | 173.2 | 0 | 0 | 0 | 106.1 | N112 N116 | N112-I114 PolarHBondContact O-N 3.05Å; I114-N116 PolarHBondContact O-N 2.78Å | ||
| 115 | P | 78.9 | Confident | 67.4 | Low | 68 Ų | 68 | 117.3 Ų | 117.3 | 44% | 0.442 | 67% | 0.673 | S | S | . | * | trans | -63.2 | 124.9 | 179.2 | 26.7 | -33.3 | 0 | 0 | 0 | 108.3 | Y113 I117 | Y113-P115 VanDerWaalsContact O-CD 3.29Å; Y113-P115 WeakPolarHBondContact O-CD 3.47Å; P115-I117 WeakPolarHBondContact O-CG1 3.4Å; P115-I117 PolarHBondContact O-N 2.8Å | ||
| 116 | N | 81.3 | Confident | 67.7 | Low | 152 Ų | 152 | 117 Ų | 117 | 81% | 0.813 | 67% | 0.67 | S | S | * | * | trans | -65.4 | 101.6 | -176 | -164.2 | 7.8 | 0 | 0 | 0 | 109.2 | I114 P118 | I114-N116 PolarHBondContact O-N 2.78Å; N116-P118 WeakPolarHBondContact O-CD 3.31Å | ||
| 117 | I | 82.1 | Confident | 68.2 | Low | 121 Ų | 121 | 118.3 Ų | 118.3 | 62% | 0.621 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -69.7 | 117.6 | -173.1 | -56.4 | -179.4 | 0 | 0 | 0 | 107.6 | P115 T119 | P115-I117 WeakPolarHBondContact O-CG1 3.4Å; P115-I117 PolarHBondContact O-N 2.8Å; I117-T119 PolarHBondContact O-N 3.15Å |
| 118 | P | 83.3 | Confident | 68.9 | Low | 58 Ų | 58 | 120.9 Ų | 120.9 | 38% | 0.377 | 66% | 0.662 | S | S | . | * | P | Polyproline II helix | trans | -61 | 139.3 | -178 | 25.3 | -34.4 | 0 | 0 | 0 | 110.3 | N116 Q122 L123 | N116-P118 WeakPolarHBondContact O-CD 3.31Å; P118-Q122 VanDerWaalsContact CA-OE1 3.32Å; P118-Q122 HydrophobicContact CB-CB 4.07Å; P118-L123 HydrophobicContact CB-CD2 4.26Å; P118-L123 HydrophobicContact CB-CG 4.19Å; P118-L123 HydrophobicContact CG-CD1 4.33Å; P118-L123 HydrophobicContact CG-CD2 3.76Å; P118-L123 HydrophobicContact CG-CG 4Å |
| 119 | T | 83.7 | Confident | 69.7 | Low | 61 Ų | 61 | 122.4 Ų | 122.4 | 37% | 0.374 | 67% | 0.665 | S | S | . | * | P | Polyproline II helix | trans | -63 | 156.6 | -180 | 66.4 | 0 | 0 | 0 | 0 | 110.6 | I117 E121 Q122 L123 | I117-T119 PolarHBondContact O-N 3.15Å; T119-E121 PolarHBondContact O-N 2.79Å; T119-Q122 PolarHBondContact O-N 2.82Å; T119-Q122 WeakPolarHBondContact OG1-CG 3.18Å; T119-Q122 PolarHBondContact OG1-N 3.19Å; T119-Q122 VanDerWaalsContact OG1-N 3.16Å; T119-L123 PolarHBondContact O-N 3.35Å |
| 120 | P | 80.1 | Confident | 70 | Confident | 102 Ų | 102 | 117.7 Ų | 117.7 | 66% | 0.662 | 64% | 0.642 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -55.9 | -25.1 | 173.7 | -26.4 | 35.8 | 0 | 0 | 0 | 113.3 | L124 | P120-L124 WeakPolarHBondContact O-CB 3.41Å; P120-L124 VanDerWaalsContact O-CD1 3.31Å; P120-L124 WeakPolarHBondContact O-CD1 3.43Å; P120-L124 WeakPolarHBondContact O-CG 3.31Å; P120-L124 PolarHBondContact O-N 3.19Å |
| 121 | E | 79.7 | Confident | 69.4 | Low | 151 Ų | 151 | 116.8 Ų | 116.8 | 71% | 0.706 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | -47.7 | 173.3 | -69.3 | 167.3 | -174.3 | 0 | 0 | 111.3 | T119 L123 L124 T125 | T119-E121 PolarHBondContact O-N 2.79Å; E121-L123 PolarHBondContact O-N 2.88Å; E121-L124 CarbonylContact O-C 3.5Å; E121-L124 WeakPolarHBondContact O-CA 3.47Å; E121-L124 PolarHBondContact O-N 3.22Å; E121-T125 WeakPolarHBondContact O-CG2 3.29Å; E121-T125 PolarHBondContact O-N 3.46Å; E121-T125 PolarHBondContact O-OG1 3.11Å |
| 122 | Q | 81.1 | Confident | 69.3 | Low | 118 Ų | 118 | 122.1 Ų | 122.1 | 55% | 0.551 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.1 | -28.4 | 174.8 | -73.1 | 168.4 | -26.5 | 0 | 0 | 113.4 | P118 T119 L124 T125 | P118-Q122 VanDerWaalsContact CA-OE1 3.32Å; P118-Q122 HydrophobicContact CB-CB 4.07Å; T119-Q122 PolarHBondContact O-N 2.82Å; T119-Q122 WeakPolarHBondContact OG1-CG 3.18Å; T119-Q122 PolarHBondContact OG1-N 3.19Å; T119-Q122 VanDerWaalsContact OG1-N 3.16Å; Q122-L124 VanDerWaalsContact C-N 3.32Å; Q122-T125 WeakPolarHBondContact CA-OG1 3.14Å |
| 123 | L | 79.1 | Confident | 68.8 | Low | 99 Ų | 99 | 121 Ų | 121 | 52% | 0.518 | 63% | 0.633 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.8 | -8.9 | 173.1 | -69 | 174.3 | 0 | 0 | 0 | 114 | P118 T119 E121 | P118-L123 HydrophobicContact CB-CD2 4.26Å; P118-L123 HydrophobicContact CB-CG 4.19Å; P118-L123 HydrophobicContact CG-CD1 4.33Å; P118-L123 HydrophobicContact CG-CD2 3.76Å; P118-L123 HydrophobicContact CG-CG 4Å; T119-L123 PolarHBondContact O-N 3.35Å; E121-L123 PolarHBondContact O-N 2.88Å |
| 124 | L | 76.9 | Confident | 68.3 | Low | 127 Ų | 127 | 117.3 Ų | 117.3 | 67% | 0.665 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.5 | -20.1 | -179.1 | -69.7 | 173.8 | 0 | 0 | 0 | 113.4 | P120 E121 Q122 S126 | P120-L124 WeakPolarHBondContact O-CB 3.41Å; P120-L124 VanDerWaalsContact O-CD1 3.31Å; P120-L124 WeakPolarHBondContact O-CD1 3.43Å; P120-L124 WeakPolarHBondContact O-CG 3.31Å; P120-L124 PolarHBondContact O-N 3.19Å; E121-L124 CarbonylContact O-C 3.5Å; E121-L124 WeakPolarHBondContact O-CA 3.47Å; E121-L124 PolarHBondContact O-N 3.22Å; Q122-L124 VanDerWaalsContact C-N 3.32Å; L124-S126 PolarHBondContact O-N 3.05Å |
| 125 | T | 70.9 | Confident | 67.2 | Low | 84 Ų | 84 | 118.7 Ų | 118.7 | 52% | 0.515 | 63% | 0.629 | S | S | . | * | trans | -75.2 | 89.5 | 172.5 | 50.7 | 0 | 0 | 0 | 0 | 110.3 | E121 Q122 N127 | E121-T125 WeakPolarHBondContact O-CG2 3.29Å; E121-T125 PolarHBondContact O-N 3.46Å; E121-T125 PolarHBondContact O-OG1 3.11Å; Q122-T125 WeakPolarHBondContact CA-OG1 3.14Å; T125-N127 PolarHBondContact O-N 3.45Å | ||
| 126 | S | 55.3 | Low | 65.9 | Low | 104 Ų | 104 | 117.8 Ų | 117.8 | 73% | 0.727 | 63% | 0.632 | S | S | * | * | trans | -71.8 | 71.9 | 166.5 | 58.8 | 0 | 0 | 0 | 0 | 110.5 | L124 E128 | L124-S126 PolarHBondContact O-N 3.05Å; S126-E128 PolarHBondContact O-N 3.16Å | ||
| 127 | N | 57 | Low | 64.6 | Low | 107 Ų | 107 | 119.4 Ų | 119.4 | 57% | 0.572 | 64% | 0.635 | S | S | * | * | trans | -68.4 | 101.6 | 170 | -85.8 | 17.1 | 0 | 0 | 0 | 108.9 | T125 E129 T130 | T125-N127 PolarHBondContact O-N 3.45Å; N127-E129 PolarHBondContact O-N 3.01Å; N127-E129 VanDerWaalsContact O-N 3.12Å; N127-T130 PolarHBondContact O-N 3.02Å; N127-T130 PolarHBondContact O-OG1 2.84Å; N127-T130 VanDerWaalsContact O-OG1 3.11Å | ||
| 128 | E | 62.6 | Low | 63.6 | Low | 190 Ų | 190 | 118.2 Ų | 118.2 | 89% | 0.888 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.2 | -23.7 | -174.4 | -58.3 | -174.9 | 134.4 | 0 | 0 | 113.2 | S126 T130 | S126-E128 PolarHBondContact O-N 3.16Å; E128-T130 VanDerWaalsContact C-N 3.29Å; E128-T130 PolarHBondContact O-N 3.46Å |
| 129 | E | 62 | Low | 63.2 | Low | 195 Ų | 195 | 119 Ų | 119 | 91% | 0.911 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | -16.7 | 176.6 | -59.7 | -171.2 | 133.3 | 0 | 0 | 113.9 | N127 | N127-E129 PolarHBondContact O-N 3.01Å; N127-E129 VanDerWaalsContact O-N 3.12Å |
| 130 | T | 53.6 | Low | 63 | Low | 59 Ų | 59 | 122.2 Ų | 122.2 | 36% | 0.362 | 64% | 0.639 | S | S | . | * | trans | -111.3 | 82.4 | 174.6 | 39.8 | 0 | 0 | 0 | 0 | 111 | N127 E128 Y132 | N127-T130 PolarHBondContact O-N 3.02Å; N127-T130 PolarHBondContact O-OG1 2.84Å; N127-T130 VanDerWaalsContact O-OG1 3.11Å; E128-T130 VanDerWaalsContact C-N 3.29Å; E128-T130 PolarHBondContact O-N 3.46Å; T130-Y132 VanDerWaalsContact CB-CZ 3.49Å; T130-Y132 HydrophobicContact CG2-CE1 4.18Å; T130-Y132 WeakPolarHBondContact O-CD2 3.43Å; T130-Y132 PolarHBondContact O-N 2.98Å | ||
| 131 | S | 42.7 | Very low | 62.8 | Low | 98 Ų | 98 | 121.8 Ų | 121.8 | 69% | 0.685 | 63% | 0.634 | S | S | * | * | trans | -69.7 | 69.2 | 170.7 | -167.3 | 0 | 0 | 0 | 0 | 111.6 | N133 | S131-N133 PolarHBondContact O-N 2.83Å; S131-N133 VanDerWaalsContact O-N 3.15Å | ||
| 132 | Y | 51.4 | Low | 62.8 | Low | 170 Ų | 170 | 119 Ų | 119 | 67% | 0.667 | 62% | 0.624 | S | S | * | * | trans | -64 | 112.1 | 158.9 | -35.3 | -68.7 | 0 | 0 | 0 | 106.7 | T130 L134 | T130-Y132 VanDerWaalsContact CB-CZ 3.49Å; T130-Y132 HydrophobicContact CG2-CE1 4.18Å; T130-Y132 WeakPolarHBondContact O-CD2 3.43Å; T130-Y132 PolarHBondContact O-N 2.98Å; Y132-L134 PolarHBondContact O-N 2.89Å | ||
| 133 | N | 45.4 | Very low | 63 | Low | 134 Ų | 134 | 117.1 Ų | 117.1 | 72% | 0.717 | 62% | 0.617 | S | S | * | * | trans | -70 | 84 | 175.3 | -97 | -81.1 | 0 | 0 | 0 | 110.1 | S131 H135 | S131-N133 PolarHBondContact O-N 2.83Å; S131-N133 VanDerWaalsContact O-N 3.15Å; N133-H135 PolarHBondContact O-N 2.91Å | ||
| 134 | L | 56.2 | Low | 63.4 | Low | 123 Ų | 123 | 118.8 Ų | 118.8 | 64% | 0.644 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | 26.6 | 168.2 | -83.8 | 152.9 | 0 | 0 | 0 | 112.9 | Y132 G136 I138 | Y132-L134 PolarHBondContact O-N 2.89Å; L134-G136 VanDerWaalsContact C-N 3.26Å; L134-I138 HydrophobicContact CD2-CD1 3.61Å; L134-I138 HydrophobicContact CD2-CG1 4.09Å |
| 135 | H | 47.8 | Very low | 63.9 | Low | 171 Ų | 171 | 121.3 Ų | 121.3 | 79% | 0.792 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.5 | -25 | 165.9 | -164.9 | 83.5 | 0 | 0 | 0 | 111.5 | N133 Q137 | N133-H135 PolarHBondContact O-N 2.91Å; H135-Q137 PolarHBondContact O-N 3.19Å |
| 136 | G | 51.7 | Low | 64.6 | Low | 49 Ų | 49 | 122.8 Ų | 122.8 | 51% | 0.505 | 62% | 0.622 | S | S | . | * | S | Bend | trans | -67 | 108.9 | 157.8 | 0 | 0 | 0 | 0 | 0 | 109.1 | L134 I138 | L134-G136 VanDerWaalsContact C-N 3.26Å; G136-I138 VanDerWaalsContact C-N 3.33Å; G136-I138 PolarHBondContact O-N 2.93Å |
| 137 | Q | 53.9 | Low | 66.1 | Low | 186 Ų | 186 | 120.7 Ų | 120.7 | 87% | 0.869 | 61% | 0.605 | S | S | * | * | trans | -60.2 | 96.7 | 169 | -71.9 | -175 | -2 | 0 | 0 | 108.9 | H135 N139 | H135-Q137 PolarHBondContact O-N 3.19Å; Q137-N139 VanDerWaalsContact C-N 3.28Å; Q137-N139 PolarHBondContact O-N 2.92Å | ||
| 138 | I | 61.9 | Low | 67.5 | Low | 96 Ų | 96 | 121.8 Ų | 121.8 | 49% | 0.492 | 60% | 0.601 | S | S | . | * | trans | -62.5 | 99.2 | 166.5 | -62.6 | -178.1 | 0 | 0 | 0 | 105.6 | L134 G136 F140 | L134-I138 HydrophobicContact CD2-CD1 3.61Å; L134-I138 HydrophobicContact CD2-CG1 4.09Å; G136-I138 VanDerWaalsContact C-N 3.33Å; G136-I138 PolarHBondContact O-N 2.93Å; I138-F140 VanDerWaalsContact C-N 3.26Å; I138-F140 HydrophobicContact CB-CE2 4.43Å; I138-F140 HydrophobicContact CG2-CE2 4.42Å; I138-F140 HydrophobicContact CG2-CZ 4.46Å; I138-F140 WeakPolarHBondContact O-CD2 3.45Å; I138-F140 PolarHBondContact O-N 3.4Å | ||
| 139 | N | 74.9 | Confident | 68.7 | Low | 74 Ų | 74 | 120 Ų | 120 | 40% | 0.396 | 59% | 0.588 | S | S | . | * | trans | -73.4 | 88.2 | -176.3 | -174.7 | -17.4 | 0 | 0 | 0 | 108 | Q137 V141 N142 L143 | Q137-N139 VanDerWaalsContact C-N 3.28Å; Q137-N139 PolarHBondContact O-N 2.92Å; N139-V141 PolarHBondContact O-N 3.12Å; N139-V141 VanDerWaalsContact O-N 3.08Å; N139-V141 VanDerWaalsContact OD1-CB 3.28Å; N139-V141 WeakPolarHBondContact OD1-CB 3.41Å; N139-V141 PolarHBondContact OD1-N 3.31Å; N139-V141 VanDerWaalsContact OD1-N 3.12Å; N139-N142 HydrophobicContact CB-CB 4.12Å; N139-N142 PolarHBondContact ND2-ND2 2.88Å; N139-N142 PolarHBondContact ND2-OD1 3.08Å; N139-N142 WeakPolarHBondContact O-CA 3.46Å; N139-N142 WeakPolarHBondContact O-CB 3.06Å; N139-N142 PolarHBondContact O-N 2.81Å; N139-N142 PolarHBondContact OD1-N 3.43Å; N139-L143 PolarHBondContact O-N 3.03Å | ||
| 140 | F | 78.4 | Confident | 69.8 | Low | 130 Ų | 130 | 117 Ų | 117 | 57% | 0.57 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -54.6 | -26.4 | 178.5 | -74.2 | -84.8 | 0 | 0 | 0 | 112.1 | I138 F144 | I138-F140 VanDerWaalsContact C-N 3.26Å; I138-F140 HydrophobicContact CB-CE2 4.43Å; I138-F140 HydrophobicContact CG2-CE2 4.42Å; I138-F140 HydrophobicContact CG2-CZ 4.46Å; I138-F140 WeakPolarHBondContact O-CD2 3.45Å; I138-F140 PolarHBondContact O-N 3.4Å; F140-F144 WeakPolarHBondContact O-CB 3.28Å; F140-F144 PolarHBondContact O-N 3.45Å |
| 141 | V | 77 | Confident | 71.3 | Confident | 93 Ų | 93 | 120.6 Ų | 120.6 | 56% | 0.564 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -68.9 | -39.2 | 173.9 | -168.5 | 0 | 0 | 0 | 0 | 111.3 | N139 R145 | N139-V141 PolarHBondContact O-N 3.12Å; N139-V141 VanDerWaalsContact O-N 3.08Å; N139-V141 VanDerWaalsContact OD1-CB 3.28Å; N139-V141 WeakPolarHBondContact OD1-CB 3.41Å; N139-V141 PolarHBondContact OD1-N 3.31Å; N139-V141 VanDerWaalsContact OD1-N 3.12Å; V141-R145 VanDerWaalsContact O-CB 3.25Å; V141-R145 WeakPolarHBondContact O-CB 3.26Å; V141-R145 VanDerWaalsContact O-CG 3.26Å; V141-R145 WeakPolarHBondContact O-CG 3.25Å; V141-R145 PolarHBondContact O-N 2.85Å |
| 142 | N | 79.9 | Confident | 73.2 | Confident | 93 Ų | 93 | 119 Ų | 119 | 50% | 0.497 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -69.3 | -46.9 | 174.6 | -72.8 | -0 | 0 | 0 | 0 | 111.5 | N139 F144 R145 Q146 | N139-N142 HydrophobicContact CB-CB 4.12Å; N139-N142 PolarHBondContact ND2-ND2 2.88Å; N139-N142 PolarHBondContact ND2-OD1 3.08Å; N139-N142 WeakPolarHBondContact O-CA 3.46Å; N139-N142 WeakPolarHBondContact O-CB 3.06Å; N139-N142 PolarHBondContact O-N 2.81Å; N139-N142 PolarHBondContact OD1-N 3.43Å; N142-F144 VanDerWaalsContact C-N 3.34Å; N142-F144 PolarHBondContact O-N 3.15Å; N142-R145 PolarHBondContact O-N 2.99Å; N142-Q146 WeakPolarHBondContact O-CB 3.15Å; N142-Q146 PolarHBondContact O-N 3.04Å |
| 143 | L | 85.3 | Confident | 74.6 | Confident | 77 Ų | 77 | 115.3 Ų | 115.3 | 40% | 0.403 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -59.7 | -46.4 | 176.8 | -178.7 | 61.4 | 0 | 0 | 0 | 110.8 | N139 Q146 T147 | N139-L143 PolarHBondContact O-N 3.03Å; L143-Q146 PolarHBondContact O-N 2.79Å; L143-T147 HydrophobicContact CD1-CG2 4.39Å; L143-T147 PolarHBondContact O-N 3.36Å; L143-T147 PolarHBondContact O-OG1 3.24Å |
| 144 | F | 86.2 | Confident | 76.1 | Confident | 135 Ų | 135 | 117.8 Ų | 117.8 | 59% | 0.592 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -61.7 | -47 | 176.2 | -175.7 | -95.3 | 0 | 0 | 0 | 112 | F140 N142 Q146 T147 W148 | F140-F144 WeakPolarHBondContact O-CB 3.28Å; F140-F144 PolarHBondContact O-N 3.45Å; N142-F144 VanDerWaalsContact C-N 3.34Å; N142-F144 PolarHBondContact O-N 3.15Å; F144-Q146 VanDerWaalsContact C-N 3.32Å; F144-Q146 PolarHBondContact O-N 3.46Å; F144-T147 WeakPolarHBondContact CA-OG1 3.18Å; F144-T147 PolarHBondContact O-N 2.92Å; F144-T147 PolarHBondContact O-OG1 3.23Å; F144-W148 WeakPolarHBondContact O-CB 3.31Å; F144-W148 PolarHBondContact O-N 3.47Å |
| 145 | R | 86.9 | Confident | 77.1 | Confident | 180 Ų | 180 | 116.9 Ų | 116.9 | 68% | 0.679 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -56 | -45.4 | 175 | -85.5 | 179.6 | 164.9 | -146.2 | -4.8 | 111.9 | V141 N142 W148 Y149 | V141-R145 VanDerWaalsContact O-CB 3.25Å; V141-R145 WeakPolarHBondContact O-CB 3.26Å; V141-R145 VanDerWaalsContact O-CG 3.26Å; V141-R145 WeakPolarHBondContact O-CG 3.25Å; V141-R145 PolarHBondContact O-N 2.85Å; N142-R145 PolarHBondContact O-N 2.99Å; R145-W148 PolarHBondContact O-N 3.48Å; R145-Y149 WeakPolarHBondContact O-CB 3.38Å; R145-Y149 PolarHBondContact O-N 3.26Å |
| 146 | Q | 85.8 | Confident | 78.1 | Confident | 114 Ų | 114 | 114.4 Ų | 114.4 | 53% | 0.533 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -68 | -46.4 | -178.8 | -169.2 | 171.5 | 11.1 | 0 | 0 | 111.5 | N142 L143 F144 W148 Y149 Y150 | N142-Q146 WeakPolarHBondContact O-CB 3.15Å; N142-Q146 PolarHBondContact O-N 3.04Å; L143-Q146 PolarHBondContact O-N 2.79Å; F144-Q146 VanDerWaalsContact C-N 3.32Å; F144-Q146 PolarHBondContact O-N 3.46Å; Q146-W148 VanDerWaalsContact C-N 3.34Å; Q146-W148 PolarHBondContact O-N 2.96Å; Q146-Y149 PolarHBondContact O-N 2.96Å; Q146-Y150 HydrophobicContact CG-CD2 4.21Å; Q146-Y150 HydrophobicContact CG-CE2 3.78Å; Q146-Y150 WeakPolarHBondContact O-CD2 3.34Å; Q146-Y150 PolarHBondContact O-N 3.34Å; Q146-Y150 VanDerWaalsContact O-N 3.14Å |
| 147 | T | 87.3 | Confident | 78.4 | Confident | 60 Ų | 60 | 117.8 Ų | 117.8 | 37% | 0.368 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.7 | -36.3 | 175.1 | 51.9 | 0 | 0 | 0 | 0 | 112.9 | L143 F144 Y150 Y151 | L143-T147 HydrophobicContact CD1-CG2 4.39Å; L143-T147 PolarHBondContact O-N 3.36Å; L143-T147 PolarHBondContact O-OG1 3.24Å; F144-T147 WeakPolarHBondContact CA-OG1 3.18Å; F144-T147 PolarHBondContact O-N 2.92Å; F144-T147 PolarHBondContact O-OG1 3.23Å; T147-Y150 PolarHBondContact O-N 3.32Å; T147-Y151 WeakPolarHBondContact O-CB 3.4Å; T147-Y151 PolarHBondContact O-N 3.12Å |
| 148 | W | 87.6 | Confident | 78.2 | Confident | 131 Ų | 131 | 114.3 Ų | 114.3 | 50% | 0.496 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 176 | -178.7 | -104 | 0 | 0 | 0 | 111.6 | F144 R145 Q146 Y151 Q152 | F144-W148 WeakPolarHBondContact O-CB 3.31Å; F144-W148 PolarHBondContact O-N 3.47Å; R145-W148 PolarHBondContact O-N 3.48Å; Q146-W148 VanDerWaalsContact C-N 3.34Å; Q146-W148 PolarHBondContact O-N 2.96Å; W148-Y151 HydrophobicContact CE3-CD1 4.4Å; W148-Y151 HydrophobicContact CZ3-CD1 4.25Å; W148-Y151 PolarHBondContact O-N 3.47Å; W148-Q152 WeakPolarHBondContact O-CG 3.3Å; W148-Q152 PolarHBondContact O-N 2.81Å |
| 149 | Y | 87.3 | Confident | 77.8 | Confident | 152 Ų | 152 | 115.4 Ų | 115.4 | 60% | 0.596 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.9 | -44.3 | 176.6 | -176.6 | -104.6 | 0 | 0 | 0 | 112.2 | R145 Q146 Q152 Q153 | R145-Y149 WeakPolarHBondContact O-CB 3.38Å; R145-Y149 PolarHBondContact O-N 3.26Å; Q146-Y149 PolarHBondContact O-N 2.96Å; Y149-Q152 PolarHBondContact O-N 3.46Å; Y149-Q153 PolarHBondContact O-N 3.4Å; Y149-Q153 VanDerWaalsContact O-N 3.16Å; Y149-Q153 PolarHBondContact OH-NE2 3.31Å |
| 150 | Y | 84.7 | Confident | 76.8 | Confident | 133 Ų | 133 | 120 Ų | 120 | 52% | 0.522 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.7 | -42.9 | 172.7 | -74 | -61.4 | 0 | 0 | 0 | 112.4 | Q146 T147 Q152 Q153 Y154 | Q146-Y150 HydrophobicContact CG-CD2 4.21Å; Q146-Y150 HydrophobicContact CG-CE2 3.78Å; Q146-Y150 WeakPolarHBondContact O-CD2 3.34Å; Q146-Y150 PolarHBondContact O-N 3.34Å; Q146-Y150 VanDerWaalsContact O-N 3.14Å; T147-Y150 PolarHBondContact O-N 3.32Å; Y150-Q152 VanDerWaalsContact C-N 3.33Å; Y150-Q152 PolarHBondContact O-N 3.4Å; Y150-Q153 PolarHBondContact O-N 2.91Å; Y150-Y154 PolarHBondContact O-N 2.89Å; Y150-Y154 VanDerWaalsContact O-N 3.11Å |
| 151 | Y | 85.2 | Confident | 75.2 | Confident | 134 Ų | 134 | 116.7 Ų | 116.7 | 53% | 0.525 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.1 | -38.7 | 178.4 | -174.5 | -108.6 | 0 | 0 | 0 | 112.6 | T147 W148 Y154 L155 | T147-Y151 WeakPolarHBondContact O-CB 3.4Å; T147-Y151 PolarHBondContact O-N 3.12Å; W148-Y151 HydrophobicContact CE3-CD1 4.4Å; W148-Y151 HydrophobicContact CZ3-CD1 4.25Å; W148-Y151 PolarHBondContact O-N 3.47Å; Y151-Y154 PolarHBondContact O-N 3.14Å; Y151-L155 HydrophobicContact CD1-CD1 3.95Å; Y151-L155 HydrophobicContact CE1-CD1 3.45Å; Y151-L155 VanDerWaalsContact CE1-CD1 3.45Å; Y151-L155 HydrophobicContact CE1-CG 4.31Å; Y151-L155 PolarHBondContact O-N 3.38Å; Y151-L155 VanDerWaalsContact O-N 3.17Å |
| 152 | Q | 82.6 | Confident | 73.9 | Confident | 65 Ų | 65 | 116.3 Ų | 116.3 | 30% | 0.304 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.8 | -44.7 | 173.1 | -71.7 | -65.9 | -31.2 | 0 | 0 | 112 | W148 Y149 Y150 Y154 L155 I156 | W148-Q152 WeakPolarHBondContact O-CG 3.3Å; W148-Q152 PolarHBondContact O-N 2.81Å; Y149-Q152 PolarHBondContact O-N 3.46Å; Y150-Q152 VanDerWaalsContact C-N 3.33Å; Y150-Q152 PolarHBondContact O-N 3.4Å; Q152-Y154 VanDerWaalsContact C-N 3.3Å; Q152-Y154 PolarHBondContact O-N 3.3Å; Q152-L155 PolarHBondContact O-N 3.11Å; Q152-I156 HydrophobicContact CB-CD1 4.5Å; Q152-I156 WeakPolarHBondContact O-CD1 3.21Å; Q152-I156 VanDerWaalsContact O-CG1 3.23Å; Q152-I156 WeakPolarHBondContact O-CG1 3.39Å; Q152-I156 PolarHBondContact O-N 3.35Å |
| 153 | Q | 80.2 | Confident | 72.3 | Confident | 91 Ų | 91 | 118.7 Ų | 118.7 | 43% | 0.425 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.4 | -37.2 | 176.9 | -69.7 | -157.1 | 38.6 | 0 | 0 | 113 | Y149 Y150 I156 | Y149-Q153 PolarHBondContact O-N 3.4Å; Y149-Q153 VanDerWaalsContact O-N 3.16Å; Y149-Q153 PolarHBondContact OH-NE2 3.31Å; Y150-Q153 PolarHBondContact O-N 2.91Å; Q153-I156 PolarHBondContact O-N 3.21Å |
| 154 | Y | 78.4 | Confident | 70.3 | Confident | 186 Ų | 186 | 119.5 Ų | 119.5 | 73% | 0.729 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.2 | -32.6 | 175.4 | -93.9 | -80.5 | 0 | 0 | 0 | 113.8 | Y150 Y151 Q152 | Y150-Y154 PolarHBondContact O-N 2.89Å; Y150-Y154 VanDerWaalsContact O-N 3.11Å; Y151-Y154 PolarHBondContact O-N 3.14Å; Q152-Y154 VanDerWaalsContact C-N 3.3Å; Q152-Y154 PolarHBondContact O-N 3.3Å |
| 155 | L | 76.1 | Confident | 68.9 | Low | 105 Ų | 105 | 119.8 Ų | 119.8 | 55% | 0.55 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -77.7 | -22 | 177.2 | -77.1 | 174.2 | 0 | 0 | 0 | 113.9 | Y151 Q152 | Y151-L155 HydrophobicContact CD1-CD1 3.95Å; Y151-L155 HydrophobicContact CE1-CD1 3.45Å; Y151-L155 VanDerWaalsContact CE1-CD1 3.45Å; Y151-L155 HydrophobicContact CE1-CG 4.31Å; Y151-L155 PolarHBondContact O-N 3.38Å; Y151-L155 VanDerWaalsContact O-N 3.17Å; Q152-L155 PolarHBondContact O-N 3.11Å |
| 156 | I | 69.3 | Low | 66.8 | Low | 119 Ų | 119 | 119 Ų | 119 | 61% | 0.61 | 57% | 0.572 | S | S | * | * | S | Bend | trans | -86.6 | -9.5 | -171.3 | -72.1 | 167.3 | 0 | 0 | 0 | 113.2 | Q152 Q153 P158 | Q152-I156 HydrophobicContact CB-CD1 4.5Å; Q152-I156 WeakPolarHBondContact O-CD1 3.21Å; Q152-I156 VanDerWaalsContact O-CG1 3.23Å; Q152-I156 WeakPolarHBondContact O-CG1 3.39Å; Q152-I156 PolarHBondContact O-N 3.35Å; Q153-I156 PolarHBondContact O-N 3.21Å; I156-P158 VanDerWaalsContact O-CD 3.3Å; I156-P158 WeakPolarHBondContact O-CD 3.35Å |
| 157 | Q | 56.6 | Low | 65.1 | Low | 119 Ų | 119 | 121.7 Ų | 121.7 | 56% | 0.556 | 59% | 0.59 | S | S | * | * | trans | -102.3 | 102.1 | 178.9 | -62.2 | -162.7 | 19.2 | 0 | 0 | 112.6 | ||||
| 158 | P | 50.4 | Low | 63.1 | Low | 114 Ų | 114 | 123.5 Ų | 123.5 | 74% | 0.74 | 60% | 0.602 | S | S | * | * | trans | -91.9 | -2.3 | -169.6 | -5.6 | 27 | 0 | 0 | 0 | 114.7 | I156 | I156-P158 VanDerWaalsContact O-CD 3.3Å; I156-P158 WeakPolarHBondContact O-CD 3.35Å | ||
| 159 | N | 53.9 | Low | 61.3 | Low | 119 Ų | 119 | 122.7 Ų | 122.7 | 64% | 0.636 | 61% | 0.612 | S | S | * | * | trans | -141.7 | 82.1 | -165.5 | -76.9 | -67.4 | 0 | 0 | 0 | 113.7 | ||||
| 160 | Y | 54.4 | Low | 59.5 | Low | 171 Ų | 171 | 122.3 Ų | 122.3 | 67% | 0.671 | 62% | 0.62 | S | S | * | * | trans | -127.2 | 102.4 | 153.2 | -83.5 | -87.6 | 0 | 0 | 0 | 109.3 | Q187 | Y160-Q187 WeakPolarHBondContact CD1-O 3.04Å; Y160-Q187 VanDerWaalsContact CE1-O 3.24Å; Y160-Q187 WeakPolarHBondContact CE1-O 3.37Å | ||
| 161 | S | 45.2 | Very low | 57.9 | Low | 60 Ų | 60 | 122.5 Ų | 122.5 | 42% | 0.42 | 63% | 0.63 | S | S | . | * | trans | -72.3 | 167.2 | 164.9 | -178 | 0 | 0 | 0 | 0 | 109.4 | Q187 | S161-Q187 WeakPolarHBondContact O-CB 3.3Å; S161-Q187 PolarHBondContact OG-NE2 3.16Å | ||
| 162 | S | 49.8 | Very low | 56.3 | Low | 85 Ų | 85 | 126.9 Ų | 126.9 | 59% | 0.594 | 65% | 0.647 | S | S | * | * | trans | -133.7 | 129.8 | 176.9 | 57.5 | 0 | 0 | 0 | 0 | 112.6 | S186 | S162-S186 VanDerWaalsContact CA-OG 3.3Å; S162-S186 WeakPolarHBondContact CA-OG 3.02Å; S162-S186 WeakPolarHBondContact CB-OG 3.13Å | ||
| 163 | H | 44.2 | Very low | 54.5 | Low | 143 Ų | 143 | 131.4 Ų | 131.4 | 66% | 0.662 | 67% | 0.669 | S | S | * | * | trans | -126.5 | 134.1 | 176.4 | -80.4 | -34.7 | 0 | 0 | 0 | 108.3 | Q187 | H163-Q187 HydrophobicContact CB-CG 3.98Å; H163-Q187 PolarHBondContact CD2-NE2 3.42Å | ||
| 164 | T | 44 | Very low | 52.9 | Low | 93 Ų | 93 | 133.4 Ų | 133.4 | 57% | 0.571 | 69% | 0.691 | S | S | * | * | trans | -134.7 | 137 | -175.4 | 50 | 0 | 0 | 0 | 0 | 110.3 | S185 | T164-S185 VanDerWaalsContact CG2-OG 3.31Å; T164-S185 WeakPolarHBondContact CG2-OG 3.39Å | ||
| 165 | T | 56.6 | Low | 51.4 | Low | 141 Ų | 141 | 134.2 Ų | 134.2 | 87% | 0.865 | 69% | 0.694 | S | S | * | * | trans | -137.1 | 140.3 | 178.7 | -49.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 166 | Y | 43.2 | Very low | 49.9 | Very low | 163 Ų | 163 | 135 Ų | 135 | 64% | 0.639 | 70% | 0.703 | S | S | * | * | trans | -131.6 | 149.7 | -177.1 | -73.1 | -93.1 | 0 | 0 | 0 | 110.6 | F183 | Y166-F183 HydrophobicContact CE1-CE1 4.17Å; Y166-F183 HydrophobicContact CE1-CZ 4.47Å | ||
| 167 | L | 51.1 | Low | 48.8 | Very low | 172 Ų | 172 | 137 Ų | 137 | 90% | 0.901 | 71% | 0.709 | S | S | * | * | trans | -175.6 | 172.5 | 145.4 | -118.7 | 71.6 | 0 | 0 | 0 | 109.8 | ||||
| 168 | P | 45 | Very low | 48.1 | Very low | 98 Ų | 98 | 137.1 Ų | 137.1 | 64% | 0.636 | 71% | 0.714 | S | S | * | * | -139.7 | -168.5 | -121.8 | 41.5 | -19.3 | 0 | 0 | 0 | 117.8 | |||||
| 169 | T | 49.8 | Very low | 47.7 | Very low | 113 Ų | 113 | 138.6 Ų | 138.6 | 69% | 0.693 | 72% | 0.715 | S | S | * | * | trans | 70.1 | 150 | 156.9 | 38.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 170 | D | 49.1 | Very low | 47.2 | Very low | 144 Ų | 144 | 140.9 Ų | 140.9 | 77% | 0.77 | 72% | 0.722 | S | S | * | * | cis | -151.2 | 173.7 | 10.4 | -115.2 | -33.4 | 0 | 0 | 0 | 113.8 | ||||
| 171 | D | 51.1 | Low | 46.5 | Very low | 137 Ų | 137 | 138.8 Ų | 138.8 | 73% | 0.733 | 73% | 0.729 | S | S | * | * | trans | 55.8 | 112.8 | 162.1 | -91.3 | -27.5 | 0 | 0 | 0 | 123 | ||||
| 172 | Y | 52 | Low | 46.9 | Very low | 227 Ų | 227 | 143.4 Ų | 143.4 | 89% | 0.89 | 75% | 0.747 | S | S | * | * | 177.4 | 128.5 | 109.5 | -100.7 | -71.6 | 0 | 0 | 0 | 110.6 | |||||
| 173 | Q | 44.5 | Very low | 46.7 | Very low | 160 Ų | 160 | 146.4 Ų | 146.4 | 75% | 0.748 | 75% | 0.749 | S | S | * | * | trans | -94.3 | 133.8 | 179.2 | -72.7 | -164.5 | 10.6 | 0 | 0 | 114.1 | ||||
| 174 | C | 46.8 | Very low | 46.9 | Very low | 132 Ų | 132 | 144.8 Ų | 144.8 | 89% | 0.892 | 75% | 0.749 | S | S | * | * | trans | -140.1 | 154.1 | 153.5 | -85.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 175 | Y | 46.5 | Very low | 47.1 | Very low | 204 Ų | 204 | 144 Ų | 144 | 80% | 0.8 | 75% | 0.748 | S | S | * | * | trans | -102.8 | 155.2 | -154.8 | -107.6 | -108.2 | 0 | 0 | 0 | 115.5 | ||||
| 176 | V | 45.5 | Very low | 46.9 | Very low | 120 Ų | 120 | 139.6 Ų | 139.6 | 73% | 0.727 | 72% | 0.723 | S | S | * | * | trans | 88.8 | 115.4 | 157.6 | 175.3 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 177 | H | 44.8 | Very low | 47.2 | Very low | 162 Ų | 162 | 134 Ų | 134 | 75% | 0.75 | 70% | 0.703 | S | S | * | * | trans | 72 | 108 | 153.7 | -80.9 | -47.8 | 0 | 0 | 0 | 124.3 | ||||
| 178 | N | 42 | Very low | 47.4 | Very low | 121 Ų | 121 | 130.8 Ų | 130.8 | 65% | 0.647 | 69% | 0.694 | S | S | * | * | trans | 69.5 | 91.7 | 132.6 | -64.1 | 13.9 | 0 | 0 | 0 | 120.5 | ||||
| 179 | N | 42.3 | Very low | 47.7 | Very low | 146 Ų | 146 | 129 Ų | 129 | 78% | 0.781 | 68% | 0.682 | S | S | * | * | 46 | 132.8 | 116.8 | -48.2 | -10.4 | 0 | 0 | 0 | 120.5 | |||||
| 180 | Q | 43.9 | Very low | 47.5 | Very low | 166 Ų | 166 | 131.2 Ų | 131.2 | 78% | 0.776 | 69% | 0.69 | S | S | * | * | cis | 177.3 | 143.7 | -19 | -112.4 | -109.3 | -23 | 0 | 0 | 108 | ||||
| 181 | P | 40.4 | Very low | 47.1 | Very low | 127 Ų | 127 | 129.2 Ų | 129.2 | 83% | 0.825 | 69% | 0.687 | S | S | * | * | trans | -130.6 | 173.3 | 155.5 | 28.3 | -9.4 | 0 | 0 | 0 | 114.4 | ||||
| 182 | M | 51.9 | Low | 47 | Very low | 158 Ų | 158 | 129.9 Ų | 129.9 | 78% | 0.778 | 69% | 0.69 | S | S | * | * | trans | -111.6 | 170.7 | -150.8 | -150.8 | -175.9 | 77.5 | 0 | 0 | 117 | T184 | M182-T184 HydrophobicContact CE-CG2 4.25Š| ||
| 183 | F | 46.5 | Very low | 46.9 | Very low | 147 Ų | 147 | 126.6 Ų | 126.6 | 65% | 0.645 | 69% | 0.686 | S | S | * | * | trans | -57 | 179.6 | 173.7 | -57.4 | -94.9 | 0 | 0 | 0 | 115.6 | Y166 | Y166-F183 HydrophobicContact CE1-CE1 4.17Å; Y166-F183 HydrophobicContact CE1-CZ 4.47Å | ||
| 184 | T | 47.2 | Very low | 47.5 | Very low | 109 Ų | 109 | 124.1 Ų | 124.1 | 67% | 0.669 | 69% | 0.687 | S | S | * | * | 174.6 | 163.3 | 64.8 | 52.6 | 0 | 0 | 0 | 0 | 116.1 | M182 | M182-T184 HydrophobicContact CE-CG2 4.25Š| |||
| 185 | S | 48.8 | Very low | 47.8 | Very low | 77 Ų | 77 | 125.2 Ų | 125.2 | 54% | 0.538 | 68% | 0.679 | S | S | . | * | trans | 40.7 | 166.7 | 131.6 | -60.6 | 0 | 0 | 0 | 0 | 126 | T164 | T164-S185 VanDerWaalsContact CG2-OG 3.31Å; T164-S185 WeakPolarHBondContact CG2-OG 3.39Å | ||
| 186 | S | 52.8 | Low | 48 | Very low | 49 Ų | 49 | 124.2 Ų | 124.2 | 34% | 0.343 | 68% | 0.675 | S | S | . | * | cis | 178 | 161.8 | -30.9 | 65.8 | 0 | 0 | 0 | 0 | 113.7 | S162 | S162-S186 VanDerWaalsContact CA-OG 3.3Å; S162-S186 WeakPolarHBondContact CA-OG 3.02Å; S162-S186 WeakPolarHBondContact CB-OG 3.13Å | ||
| 187 | Q | 49.7 | Very low | 48.2 | Very low | 46 Ų | 46 | 125.4 Ų | 125.4 | 22% | 0.215 | 68% | 0.677 | C | S | . | * | trans | 68.9 | 176.2 | 152.5 | -90.6 | -138.4 | 59.2 | 0 | 0 | 121.7 | Y160 S161 H163 | Y160-Q187 WeakPolarHBondContact CD1-O 3.04Å; Y160-Q187 VanDerWaalsContact CE1-O 3.24Å; Y160-Q187 WeakPolarHBondContact CE1-O 3.37Å; S161-Q187 WeakPolarHBondContact O-CB 3.3Å; S161-Q187 PolarHBondContact OG-NE2 3.16Å; H163-Q187 HydrophobicContact CB-CG 3.98Å; H163-Q187 PolarHBondContact CD2-NE2 3.42Å | ||
| 188 | S | 55 | Low | 48.4 | Very low | 103 Ų | 103 | 122 Ų | 122 | 72% | 0.72 | 68% | 0.677 | S | S | * | * | -170.1 | -57.5 | -57.3 | -124.2 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 189 | P | 51.5 | Low | 48.8 | Very low | 60 Ų | 60 | 122.7 Ų | 122.7 | 39% | 0.39 | 69% | 0.686 | S | S | . | * | trans | -107.1 | 176 | -134.2 | 38.7 | -38.7 | 0 | 0 | 0 | 121.5 | ||||
| 190 | N | 45.1 | Very low | 49.1 | Very low | 161 Ų | 161 | 121.3 Ų | 121.3 | 86% | 0.861 | 67% | 0.674 | S | S | * | * | trans | -164.1 | 178 | -179.7 | -123.6 | -108.8 | 0 | 0 | 0 | 112.3 | ||||
| 191 | S | 41.9 | Very low | 49.3 | Very low | 101 Ų | 101 | 121.8 Ų | 121.8 | 71% | 0.706 | 67% | 0.67 | S | S | * | * | cis | -147.2 | -111.2 | 7.4 | 60.7 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 192 | L | 48.7 | Very low | 49.5 | Very low | 152 Ų | 152 | 120.7 Ų | 120.7 | 80% | 0.796 | 65% | 0.654 | S | S | * | * | trans | -143 | -172.1 | -160.2 | -57.6 | 174.6 | 0 | 0 | 0 | 113.2 | ||||
| 193 | I | 48.6 | Very low | 49.4 | Very low | 157 Ų | 157 | 116.4 Ų | 116.4 | 81% | 0.805 | 64% | 0.64 | S | S | * | * | cis | -158.7 | -175 | 13.5 | -153.1 | 163.8 | 0 | 0 | 0 | 112.7 | ||||
| 194 | S | 57.8 | Low | 49.8 | Very low | 108 Ų | 108 | 115.7 Ų | 115.7 | 76% | 0.755 | 64% | 0.642 | S | S | * | * | trans | -154 | 179.9 | -160.3 | -38.2 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 195 | Q | 53.6 | Low | 49.9 | Very low | 156 Ų | 156 | 116.9 Ų | 116.9 | 73% | 0.729 | 65% | 0.645 | S | S | * | * | trans | -176.8 | 137.2 | 153.2 | -105.4 | 173.5 | 20.7 | 0 | 0 | 120.6 | ||||
| 196 | Y | 50.5 | Low | 50.3 | Low | 183 Ų | 183 | 118.1 Ų | 118.1 | 72% | 0.718 | 65% | 0.654 | S | S | * | * | trans | 63.9 | 170 | 152.5 | -55.8 | -42.3 | 0 | 0 | 0 | 125 | ||||
| 197 | N | 50.2 | Low | 50.3 | Low | 145 Ų | 145 | 123.1 Ų | 123.1 | 78% | 0.775 | 67% | 0.672 | S | S | * | * | cis | -175.3 | -176.8 | -25.9 | -85.5 | -3.5 | 0 | 0 | 0 | 110.1 | ||||
| 198 | A | 49.2 | Very low | 50.2 | Low | 89 Ų | 89 | 129.3 Ų | 129.3 | 74% | 0.736 | 69% | 0.694 | S | S | * | * | cis | -178.7 | 171.7 | -22.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 199 | T | 50.2 | Low | 49.5 | Very low | 137 Ų | 137 | 132 Ų | 132 | 84% | 0.84 | 70% | 0.695 | S | S | * | * | cis | -165.9 | -160.5 | -19.5 | 36.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 200 | H | 48.4 | Very low | 49.4 | Very low | 117 Ų | 117 | 135.9 Ų | 135.9 | 54% | 0.542 | 72% | 0.718 | S | S | . | * | cis | -175.9 | 122.6 | 13.6 | -179 | -83.5 | 0 | 0 | 0 | 118.4 | H202 | H200-H202 AromaticContact CE1-NE2 3.6Š| ||
| 201 | Y | 46.7 | Very low | 49.4 | Very low | 175 Ų | 175 | 137.1 Ų | 137.1 | 69% | 0.686 | 72% | 0.719 | S | S | * | * | trans | 38.4 | 160.8 | 151.6 | -70.6 | -74.8 | 0 | 0 | 0 | 131.2 | K16 L17 | K16-Y201 CarbonylContact C-O 3.34Å; K16-Y201 WeakPolarHBondContact CA-O 3.08Å; L17-Y201 CarbonylContact C-O 3.56Å; L17-Y201 PolarHBondContact N-O 2.92Å; L17-Y201 CarbonylContact O-C 3.15Å; L17-Y201 WeakPolarHBondContact O-CA 3.24Å; L17-Y201 PolarHBondContact O-N 3.42Å; L17-Y201 VanDerWaalsContact O-O 3.05Å | ||
| 202 | H | 44.9 | Very low | 49.8 | Very low | 104 Ų | 104 | 138 Ų | 138 | 48% | 0.481 | 72% | 0.722 | S | S | . | * | trans | 104.8 | 155.3 | 152.7 | -57.8 | -72.3 | 0 | 0 | 0 | 121.2 | K16 H200 | K16-H202 HydrophobicContact CB-CB 3.91Å; K16-H202 HydrophobicContact CD-CB 4.3Å; K16-H202 WeakPolarHBondContact CE-O 3.23Å; K16-H202 HydrophobicContact CG-CB 3.85Å; K16-H202 WeakPolarHBondContact CG-O 3.37Å; H200-H202 AromaticContact CE1-NE2 3.6Å | ||
| 203 | S | 50.8 | Low | 49.4 | Very low | 69 Ų | 69 | 136.2 Ų | 136.2 | 48% | 0.483 | 72% | 0.722 | S | S | . | * | cis | 174.6 | 168.2 | -17.4 | -174.4 | 0 | 0 | 0 | 0 | 114.6 | K16 | K16-S203 PolarHBondContact NZ-O 3.36Š| ||
| 204 | N | 53.8 | Low | 49.2 | Very low | 131 Ų | 131 | 135.9 Ų | 135.9 | 70% | 0.701 | 72% | 0.72 | S | S | * | * | trans | 91 | 144.3 | 160 | -58.7 | 53.4 | 0 | 0 | 0 | 123.6 | ||||
| 205 | D | 49.7 | Very low | 48.4 | Very low | 134 Ų | 134 | 138.2 Ų | 138.2 | 72% | 0.717 | 72% | 0.719 | S | S | * | * | cis | -170.9 | 168.4 | -26.9 | -108.8 | -48.8 | 0 | 0 | 0 | 117.4 | ||||
| 206 | S | 56.9 | Low | 48.1 | Very low | 104 Ų | 104 | 136 Ų | 136 | 73% | 0.727 | 72% | 0.721 | S | S | * | * | trans | 78.7 | 163.5 | 164.6 | 78.4 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 207 | E | 54.2 | Low | 48.2 | Very low | 154 Ų | 154 | 134.4 Ų | 134.4 | 72% | 0.72 | 72% | 0.723 | S | S | * | * | cis | -174.1 | 169.9 | -20.8 | -103.5 | -177 | -165.7 | 0 | 0 | 109.5 | ||||
| 208 | Y | 46.6 | Very low | 48.4 | Very low | 176 Ų | 176 | 132.8 Ų | 132.8 | 69% | 0.69 | 72% | 0.721 | S | S | * | * | cis | -146.8 | -92.9 | -13.4 | -126.3 | -27 | 0 | 0 | 0 | 117.7 | ||||
| 209 | Q | 41.3 | Very low | 48.3 | Very low | 158 Ų | 158 | 135.2 Ų | 135.2 | 74% | 0.738 | 72% | 0.721 | S | S | * | * | trans | -152 | 160.6 | -153.2 | -57 | 179.9 | 13.7 | 0 | 0 | 119.8 | ||||
| 210 | T | 47.9 | Very low | 48.4 | Very low | 143 Ų | 143 | 134.3 Ų | 134.3 | 88% | 0.877 | 72% | 0.716 | S | S | * | * | trans | -171.9 | 149.1 | 141.3 | -67.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 211 | E | 46 | Very low | 48.8 | Very low | 186 Ų | 186 | 134.7 Ų | 134.7 | 87% | 0.869 | 73% | 0.727 | S | S | * | * | trans | -96.5 | 160.8 | 178.2 | -72.3 | -162 | 135.4 | 0 | 0 | 115.8 | ||||
| 212 | P | 48.9 | Very low | 49.3 | Very low | 121 Ų | 121 | 134 Ų | 134 | 79% | 0.786 | 73% | 0.73 | S | S | * | * | trans | -125.2 | 155.8 | 172 | 40.5 | -28.4 | 0 | 0 | 0 | 116.1 | ||||
| 213 | S | 42.1 | Very low | 50 | Low | 113 Ų | 113 | 134.6 Ų | 134.6 | 79% | 0.79 | 74% | 0.736 | S | S | * | * | trans | -159.7 | 123.1 | 162 | -108.8 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 214 | I | 43.5 | Very low | 50.2 | Low | 150 Ų | 150 | 137.2 Ų | 137.2 | 77% | 0.769 | 75% | 0.745 | S | S | * | * | trans | 55.1 | 130.7 | 149.3 | -1.6 | -179.1 | 0 | 0 | 0 | 124.6 | ||||
| 215 | H | 41.5 | Very low | 50.4 | Low | 158 Ų | 158 | 137.5 Ų | 137.5 | 73% | 0.731 | 75% | 0.745 | S | S | * | * | 99.9 | 108.7 | 127.1 | -132.2 | 75 | 0 | 0 | 0 | 121.5 | |||||
| 216 | S | 47.1 | Very low | 50.5 | Low | 109 Ų | 109 | 135.3 Ų | 135.3 | 76% | 0.762 | 74% | 0.738 | S | S | * | * | 175.4 | 165.4 | 113.8 | -74.2 | 0 | 0 | 0 | 0 | 113 | |||||
| 217 | I | 52.2 | Low | 50 | Low | 149 Ų | 149 | 133.2 Ų | 133.2 | 76% | 0.764 | 72% | 0.721 | S | S | * | * | trans | -131.2 | 141.7 | -169 | -73 | 162.3 | 0 | 0 | 0 | 107.6 | ||||
| 218 | P | 54 | Low | 50.5 | Low | 112 Ų | 112 | 129.7 Ų | 129.7 | 73% | 0.727 | 71% | 0.713 | S | S | * | * | -156.4 | 160.2 | 97.5 | 40.3 | -19.6 | 0 | 0 | 0 | 119.4 | |||||
| 219 | D | 47.8 | Very low | 50.7 | Low | 139 Ų | 139 | 125.6 Ų | 125.6 | 74% | 0.743 | 70% | 0.703 | S | S | * | * | trans | 24.9 | 148.3 | 137 | -49.5 | -31.4 | 0 | 0 | 0 | 121.2 | ||||
| 220 | T | 52.2 | Low | 51 | Low | 118 Ų | 118 | 128.9 Ų | 128.9 | 72% | 0.724 | 71% | 0.71 | S | S | * | * | cis | -168.9 | 166 | 48.2 | -27.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 221 | T | 57.6 | Low | 51.9 | Low | 126 Ų | 126 | 127 Ų | 127 | 77% | 0.773 | 70% | 0.703 | S | S | * | * | trans | 62.4 | 154.8 | 159.9 | 55 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 222 | E | 55.7 | Low | 52.3 | Low | 161 Ų | 161 | 127.4 Ų | 127.4 | 75% | 0.752 | 70% | 0.702 | S | S | * | * | cis | -169.3 | 169.6 | -31.1 | -169.7 | 169.8 | -140.5 | 0 | 0 | 107.9 | ||||
| 223 | N | 59.7 | Low | 52.9 | Low | 115 Ų | 115 | 127.9 Ų | 127.9 | 62% | 0.615 | 71% | 0.705 | S | S | * | * | trans | 87.8 | 106.8 | 163.4 | -62.6 | -74.6 | 0 | 0 | 0 | 120.8 | ||||
| 224 | N | 55 | Low | 54.2 | Low | 124 Ų | 124 | 128.1 Ų | 128.1 | 66% | 0.663 | 70% | 0.701 | S | S | * | * | 70.6 | 118.8 | 129.5 | -51.3 | -28.9 | 0 | 0 | 0 | 120.2 | |||||
| 225 | I | 58.3 | Low | 54.7 | Low | 137 Ų | 137 | 128 Ų | 128 | 70% | 0.703 | 70% | 0.701 | S | S | * | * | 77.7 | 132.6 | 59.8 | -68.3 | 166.9 | 0 | 0 | 0 | 112 | |||||
| 226 | P | 52.2 | Low | 55.6 | Low | 88 Ų | 88 | 125.1 Ų | 125.1 | 57% | 0.571 | 69% | 0.691 | S | S | * | * | cis | -147.6 | 153 | -22.4 | 43.4 | -23.5 | 0 | 0 | 0 | 117.2 | F51 | F51-P226 HydrophobicContact CE1-CB 4.35Å; F51-P226 HydrophobicContact CZ-CB 4.17Å | ||
| 227 | V | 47.1 | Very low | 56 | Low | 60 Ų | 60 | 126 Ų | 126 | 36% | 0.364 | 69% | 0.692 | S | S | . | * | 65.6 | 112.8 | 123.6 | 97.7 | 0 | 0 | 0 | 0 | 120.7 | S50 F51 | S50-V227 WeakPolarHBondContact O-CG2 3.44Å; S50-V227 WeakPolarHBondContact OG-CG1 3.44Å; S50-V227 VanDerWaalsContact OG-CG2 3.3Å; S50-V227 WeakPolarHBondContact OG-CG2 3.49Å; F51-V227 HydrophobicContact CB-CG2 3.98Å; F51-V227 HydrophobicContact CD1-CB 3.81Å; F51-V227 HydrophobicContact CD1-CG2 3.85Å; F51-V227 HydrophobicContact CD2-CB 4.06Å; F51-V227 HydrophobicContact CD2-CG2 3.24Å; F51-V227 HydrophobicContact CE1-CB 3.98Å; F51-V227 HydrophobicContact CE1-CG2 4.23Å; F51-V227 HydrophobicContact CE2-CB 4.13Å; F51-V227 HydrophobicContact CE2-CG2 3.6Å; F51-V227 HydrophobicContact CG-CB 3.9Å; F51-V227 HydrophobicContact CG-CG2 3.38Å; F51-V227 HydrophobicContact CZ-CB 4.12Å; F51-V227 HydrophobicContact CZ-CG2 4.1Å | |||
| 228 | S | 62.7 | Low | 56.3 | Low | 81 Ų | 81 | 125.9 Ų | 125.9 | 57% | 0.566 | 69% | 0.693 | S | S | * | * | trans | -157.8 | 130.9 | 161.4 | -172.3 | 0 | 0 | 0 | 0 | 114.3 | F51 | F51-S228 PolarHBondContact N-O 3.07Š| ||
| 229 | N | 51.6 | Low | 56.9 | Low | 90 Ų | 90 | 128.8 Ų | 128.8 | 48% | 0.481 | 69% | 0.694 | S | S | . | * | trans | -115 | 166.1 | 171.5 | -64.5 | -19.2 | 0 | 0 | 0 | 111.2 | E49 S50 F51 | E49-N229 VanDerWaalsContact C-CG 3.5Å; E49-N229 VanDerWaalsContact C-ND2 3.27Å; E49-N229 WeakPolarHBondContact O-CB 3.48Å; E49-N229 PolarHBondContact O-N 3.47Å; E49-N229 VanDerWaalsContact O-N 3.07Å; E49-N229 PolarHBondContact O-ND2 3.04Å; S50-N229 WeakPolarHBondContact CA-OD1 3.43Å; S50-N229 VanDerWaalsContact N-CG 3.29Å; S50-N229 PolarHBondContact N-ND2 3Å; F51-N229 PolarHBondContact N-OD1 3.09Å; F51-N229 VanDerWaalsContact N-OD1 3.17Å | ||
| 230 | Y | 48.9 | Very low | 57.8 | Low | 226 Ų | 226 | 129.1 Ų | 129.1 | 89% | 0.886 | 70% | 0.696 | S | S | * | * | trans | -123 | 129.9 | 161.9 | -93.6 | -94.9 | 0 | 0 | 0 | 113.3 | ||||
| 231 | S | 64.7 | Low | 58.1 | Low | 103 Ų | 103 | 130.7 Ų | 130.7 | 72% | 0.72 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -87.5 | 161.2 | -177.1 | -63.4 | 0 | 0 | 0 | 0 | 113.2 | ||
| 232 | K | 54.9 | Low | 58.5 | Low | 195 Ų | 195 | 133.5 Ų | 133.5 | 85% | 0.848 | 70% | 0.701 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 141.9 | 170.8 | -60.7 | 172.7 | -176.5 | 174.1 | 0 | 110.3 | ||
| 233 | P | 61.6 | Low | 58.7 | Low | 131 Ų | 131 | 133.8 Ų | 133.8 | 85% | 0.851 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -71.8 | 146.2 | 179.2 | 29.7 | -34.8 | 0 | 0 | 0 | 112.3 | ||
| 234 | V | 69 | Low | 58.7 | Low | 118 Ų | 118 | 134.2 Ų | 134.2 | 72% | 0.715 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -100.7 | 147.8 | 177.5 | 174.2 | 0 | 0 | 0 | 0 | 110 | ||
| 235 | I | 54.2 | Low | 58.9 | Low | 148 Ų | 148 | 132.7 Ų | 132.7 | 76% | 0.759 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 117.9 | 179.1 | -60.5 | 166.1 | 0 | 0 | 0 | 109.4 | T237 | I235-T237 HydrophobicContact CG2-CG2 4.39Š|
| 236 | N | 60.5 | Low | 58.7 | Low | 97 Ų | 97 | 133.9 Ų | 133.9 | 52% | 0.519 | 72% | 0.72 | S | S | . | * | trans | -100.2 | 105.5 | 173.1 | -99.9 | -14.7 | 0 | 0 | 0 | 111.5 | L43 T44 | L43-N236 PolarHBondContact O-ND2 3.33Å; T44-N236 PolarHBondContact N-ND2 3.17Å; T44-N236 PolarHBondContact OG1-ND2 3.17Å | ||
| 237 | T | 55.3 | Low | 59 | Low | 127 Ų | 127 | 132.9 Ų | 132.9 | 78% | 0.779 | 73% | 0.726 | S | S | * | * | trans | -99.1 | 91.8 | 167.2 | 44.2 | 0 | 0 | 0 | 0 | 109.8 | I235 K239 | I235-T237 HydrophobicContact CG2-CG2 4.39Å; T237-K239 PolarHBondContact O-N 3.18Å | ||
| 238 | N | 59.2 | Low | 59.6 | Low | 147 Ų | 147 | 136.2 Ų | 136.2 | 79% | 0.786 | 75% | 0.752 | S | S | * | * | trans | -82.6 | 115.3 | -177.3 | -153.1 | 5.4 | 0 | 0 | 0 | 110.9 | ||||
| 239 | K | 67.2 | Low | 59.6 | Low | 173 Ų | 173 | 141.3 Ų | 141.3 | 75% | 0.752 | 77% | 0.767 | S | S | * | * | trans | -82.2 | 133.1 | 173 | -65.8 | 179.4 | 179.8 | 179.6 | 0 | 109.3 | T237 | T237-K239 PolarHBondContact O-N 3.18Š| ||
| 240 | N | 66 | Low | 60.5 | Low | 147 Ų | 147 | 142.1 Ų | 142.1 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | trans | -133.8 | 110.1 | 160.8 | -90.2 | -40.2 | 0 | 0 | 0 | 108.1 | ||||
| 241 | D | 58.8 | Low | 61.3 | Low | 150 Ų | 150 | 137.9 Ų | 137.9 | 80% | 0.802 | 78% | 0.78 | S | S | * | * | trans | -71.8 | 128.1 | -178.6 | -57.8 | -76 | 0 | 0 | 0 | 111 | ||||
| 242 | K | 66.8 | Low | 61.2 | Low | 186 Ų | 186 | 135.3 Ų | 135.3 | 81% | 0.809 | 77% | 0.769 | S | S | * | * | trans | -135.8 | 106.8 | 160.3 | -168.3 | 174.8 | -178.5 | -178.4 | 0 | 109.9 | T244 | K242-T244 PolarHBondContact O-N 3.43Š| ||
| 243 | I | 58 | Low | 62.1 | Low | 166 Ų | 166 | 133.6 Ų | 133.6 | 85% | 0.851 | 77% | 0.77 | S | S | * | * | trans | -73 | 111.4 | -179.6 | -59.5 | 166.3 | 0 | 0 | 0 | 109 | ||||
| 244 | T | 61.3 | Low | 63 | Low | 125 Ų | 125 | 136.7 Ų | 136.7 | 77% | 0.767 | 77% | 0.769 | S | S | * | * | trans | -129.3 | 116.9 | 160.1 | 41.6 | 0 | 0 | 0 | 0 | 108 | K242 | K242-T244 PolarHBondContact O-N 3.43Š| ||
| 245 | S | 58.3 | Low | 63.6 | Low | 91 Ų | 91 | 136.8 Ų | 136.8 | 64% | 0.636 | 77% | 0.772 | S | S | * | * | trans | -81.6 | 165.3 | -174.7 | 50.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 246 | N | 55.3 | Low | 64.9 | Low | 162 Ų | 162 | 140.4 Ų | 140.4 | 87% | 0.866 | 78% | 0.777 | S | S | * | * | trans | 76.5 | 80.3 | 165.5 | -48.8 | -20.5 | 0 | 0 | 0 | 116.1 | ||||
| 247 | G | 57.6 | Low | 66.1 | Low | 68 Ų | 68 | 144.8 Ų | 144.8 | 70% | 0.701 | 79% | 0.794 | S | S | * | * | trans | -152.7 | 118.8 | 161.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | E249 | G247-E249 PolarHBondContact O-N 3.5Š| ||
| 248 | S | 59.2 | Low | 67.6 | Low | 130 Ų | 130 | 149.1 Ų | 149.1 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | trans | -91.6 | 81.8 | -177.3 | 56.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 249 | E | 63.7 | Low | 68.8 | Low | 188 Ų | 188 | 153 Ų | 153 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | trans | -88 | 127.8 | -179.8 | -65 | -172.6 | 160.4 | 0 | 0 | 111.7 | G247 | G247-E249 PolarHBondContact O-N 3.5Š| ||
| 250 | S | 69.3 | Low | 69.7 | Low | 107 Ų | 107 | 154.5 Ų | 154.5 | 75% | 0.748 | 81% | 0.808 | S | S | * | * | trans | -68.2 | 148.5 | 177.4 | -174.9 | 0 | 0 | 0 | 0 | 110.9 | G252 | S250-G252 PolarHBondContact O-N 3.34Š| ||
| 251 | P | 66.6 | Low | 70.6 | Confident | 137 Ų | 137 | 151.8 Ų | 151.8 | 89% | 0.89 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -73.9 | 54.5 | 177.3 | 32.7 | -37.9 | 0 | 0 | 0 | 113.1 | ||
| 252 | G | 62.4 | Low | 71.9 | Confident | 49 Ų | 49 | 154.8 Ų | 154.8 | 51% | 0.505 | 81% | 0.806 | S | S | . | * | trans | -88 | 154.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | S250 K254 | S250-G252 PolarHBondContact O-N 3.34Å; G252-K254 PolarHBondContact O-N 2.98Å | ||
| 253 | D | 73.6 | Confident | 72.8 | Confident | 159 Ų | 159 | 148.5 Ų | 148.5 | 85% | 0.85 | 79% | 0.789 | S | S | * | * | trans | 48.9 | 60.2 | 148.5 | -54.2 | -34.9 | 0 | 0 | 0 | 118.5 | P255 | D253-P255 VanDerWaalsContact O-CD 3.31Å; D253-P255 WeakPolarHBondContact O-CD 3.15Å | ||
| 254 | K | 80.2 | Confident | 74.5 | Confident | 195 Ų | 195 | 149.9 Ų | 149.9 | 85% | 0.848 | 79% | 0.785 | S | S | * | * | trans | -58 | 117 | 149.7 | -71.2 | 179.4 | -178.8 | 173.6 | 0 | 108.1 | G252 R256 | G252-K254 PolarHBondContact O-N 2.98Å; K254-R256 PolarHBondContact O-N 3.23Å; K254-R256 VanDerWaalsContact O-N 3.11Å | ||
| 255 | P | 81.7 | Confident | 76.1 | Confident | 120 Ų | 120 | 146.1 Ų | 146.1 | 78% | 0.779 | 76% | 0.758 | S | S | * | * | trans | -61.6 | 120.3 | -174.3 | 23.3 | -33.3 | 0 | 0 | 0 | 109.9 | D253 Q257 | D253-P255 VanDerWaalsContact O-CD 3.31Å; D253-P255 WeakPolarHBondContact O-CD 3.15Å; P255-Q257 PolarHBondContact O-N 3.12Å | ||
| 256 | R | 82.1 | Confident | 77.9 | Confident | 224 Ų | 224 | 147.8 Ų | 147.8 | 85% | 0.845 | 76% | 0.755 | S | S | * | * | trans | -60.2 | 109.5 | 179.8 | -68.5 | -173.7 | 179.9 | -159.8 | 1.7 | 108.6 | K254 Y258 | K254-R256 PolarHBondContact O-N 3.23Å; K254-R256 VanDerWaalsContact O-N 3.11Å; R256-Y258 PolarHBondContact O-N 3.17Å | ||
| 257 | Q | 85.2 | Confident | 79.9 | Confident | 190 Ų | 190 | 144.8 Ų | 144.8 | 89% | 0.888 | 75% | 0.745 | S | S | * | * | trans | -58.7 | 104.6 | -179.5 | -72.3 | -175.8 | -14 | 0 | 0 | 109.9 | P255 R259 | P255-Q257 PolarHBondContact O-N 3.12Å; Q257-R259 PolarHBondContact O-N 3.31Å; Q257-R259 VanDerWaalsContact O-N 3.15Å | ||
| 258 | Y | 86.6 | Confident | 81.7 | Confident | 218 Ų | 218 | 149.8 Ų | 149.8 | 86% | 0.855 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 117.2 | -175.7 | -153.5 | -87.1 | 0 | 0 | 0 | 108.8 | R256 K260 | R256-Y258 PolarHBondContact O-N 3.17Å; Y258-K260 PolarHBondContact O-N 3.03Å |
| 259 | R | 85.9 | Confident | 83.6 | Confident | 228 Ų | 228 | 145.5 Ų | 145.5 | 86% | 0.86 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 132.9 | 179.5 | -69.5 | -179 | 175.4 | 177.6 | -2.2 | 108.5 | Q257 A261 | Q257-R259 PolarHBondContact O-N 3.31Å; Q257-R259 VanDerWaalsContact O-N 3.15Å; R259-A261 PolarHBondContact O-N 3.47Å |
| 260 | K | 85.3 | Confident | 85.1 | Confident | 204 Ų | 204 | 139.4 Ų | 139.4 | 89% | 0.887 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -49.8 | 128.3 | 175.6 | -68 | -176.5 | 178.4 | -178.8 | 0 | 109 | Y258 R262 | Y258-K260 PolarHBondContact O-N 3.03Å; K260-R262 PolarHBondContact O-N 2.87Å |
| 261 | A | 84.5 | Confident | 86.4 | Confident | 91 Ų | 91 | 137.7 Ų | 137.7 | 75% | 0.752 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 139.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 110.1 | R259 A263 | R259-A261 PolarHBondContact O-N 3.47Å; A261-A263 PolarHBondContact O-N 3.37Å |
| 262 | R | 87.2 | Confident | 87.9 | Confident | 212 Ų | 212 | 132.4 Ų | 132.4 | 80% | 0.8 | 64% | 0.639 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 127.4 | 176.6 | -70.6 | -177.6 | 174.6 | -179.5 | -2.9 | 108.6 | K260 Y264 | K260-R262 PolarHBondContact O-N 2.87Å; R262-Y264 HydrophobicContact CB-CE2 4.03Å; R262-Y264 WeakPolarHBondContact O-CD2 3.42Å; R262-Y264 WeakPolarHBondContact O-CE2 3.37Å; R262-Y264 PolarHBondContact O-N 2.85Å |
| 263 | A | 85.1 | Confident | 89.5 | Confident | 55 Ų | 55 | 130.3 Ų | 130.3 | 46% | 0.455 | 62% | 0.616 | S | S | . | * | P | Polyproline II helix | trans | -74.2 | 124 | 170.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | A261 | A261-A263 PolarHBondContact O-N 3.37Š|
| 264 | Y | 92.8 | Very high | 90.6 | Very high | 194 Ų | 194 | 126.9 Ų | 126.9 | 76% | 0.761 | 60% | 0.595 | S | S | * | * | P | Polyproline II helix | trans | -98.5 | 141.8 | 171.3 | -65.3 | -94.1 | 0 | 0 | 0 | 108.9 | R262 | R262-Y264 HydrophobicContact CB-CE2 4.03Å; R262-Y264 WeakPolarHBondContact O-CD2 3.42Å; R262-Y264 WeakPolarHBondContact O-CE2 3.37Å; R262-Y264 PolarHBondContact O-N 2.85Å |
| 265 | F | 94.6 | Very high | 91.4 | Very high | 47 Ų | 47 | 120 Ų | 120 | 21% | 0.206 | 57% | 0.572 | C | S | . | * | P | Polyproline II helix | trans | -90.8 | 145.2 | 172.6 | -59.6 | -81.9 | 0 | 0 | 0 | 109.6 | Q269 M270 L273 L297 L305 | F265-Q269 HydrophobicContact CB-CB 4.47Å; F265-M270 HydrophobicContact CB-CE 4.27Å; F265-M270 HydrophobicContact CD2-CE 3.82Å; F265-M270 HydrophobicContact CG-CE 4.39Å; F265-L273 HydrophobicContact CD1-CD1 4.39Å; F265-L297 HydrophobicContact CD1-CD1 3.81Å; F265-L297 HydrophobicContact CD1-CD2 4.11Å; F265-L297 HydrophobicContact CE1-CD1 3.87Å; F265-L297 HydrophobicContact CE1-CD2 4.13Å; F265-L305 HydrophobicContact CD2-CD2 4.43Å; F265-L305 HydrophobicContact CE2-CB 4.46Å; F265-L305 HydrophobicContact CE2-CD1 3.98Å; F265-L305 HydrophobicContact CE2-CD2 4.01Å; F265-L305 HydrophobicContact CE2-CG 4.38Å; F265-L305 HydrophobicContact CZ-CB 4.21Å; F265-L305 HydrophobicContact CZ-CD2 4.05Å |
| 266 | H | 96.6 | Very high | 92.1 | Very high | 125 Ų | 125 | 115.9 Ų | 115.9 | 58% | 0.579 | 54% | 0.542 | S | S | * | . | P | Polyproline II helix | trans | -67.5 | 143.5 | 171.7 | -163.4 | -100 | 0 | 0 | 0 | 109.5 | K268 Q269 M270 | H266-K268 PolarHBondContact O-N 2.87Å; H266-K268 VanDerWaalsContact O-N 3.08Å; H266-Q269 HydrophobicContact CB-CG 4.2Å; H266-Q269 WeakPolarHBondContact O-CA 3.19Å; H266-Q269 WeakPolarHBondContact O-CB 3.26Å; H266-Q269 PolarHBondContact O-N 2.85Å; H266-M270 PolarHBondContact O-N 3.34Å |
| 267 | P | 97.1 | Very high | 92.8 | Very high | 99 Ų | 99 | 106.8 Ų | 106.8 | 64% | 0.643 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -53.5 | -36.7 | -177.5 | -30.1 | 36.4 | 0 | 0 | 0 | 114.1 | Q269 M270 S271 | P267-Q269 VanDerWaalsContact C-N 3.34Å; P267-Q269 PolarHBondContact O-N 3.35Å; P267-M270 PolarHBondContact O-N 3.28Å; P267-S271 PolarHBondContact O-N 3.29Å |
| 268 | K | 97 | Very high | 93.3 | Very high | 173 Ų | 173 | 105.4 Ų | 105.4 | 75% | 0.752 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.8 | -33.5 | 173.2 | -173.3 | 177.3 | 179.7 | 179.8 | 0 | 113.8 | H266 | H266-K268 PolarHBondContact O-N 2.87Å; H266-K268 VanDerWaalsContact O-N 3.08Å |
| 269 | Q | 97.3 | Very high | 93.7 | Very high | 40 Ų | 40 | 102.9 Ų | 102.9 | 19% | 0.187 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -71.8 | -46.8 | 172.9 | -67 | 169.6 | -40.8 | 0 | 0 | 109.9 | F265 H266 P267 S271 C272 L273 L295 | F265-Q269 HydrophobicContact CB-CB 4.47Å; H266-Q269 HydrophobicContact CB-CG 4.2Å; H266-Q269 WeakPolarHBondContact O-CA 3.19Å; H266-Q269 WeakPolarHBondContact O-CB 3.26Å; H266-Q269 PolarHBondContact O-N 2.85Å; P267-Q269 VanDerWaalsContact C-N 3.34Å; P267-Q269 PolarHBondContact O-N 3.35Å; Q269-S271 PolarHBondContact O-N 3.48Å; Q269-C272 PolarHBondContact O-N 2.7Å; Q269-C272 VanDerWaalsContact O-N 3.15Å; Q269-L273 HydrophobicContact CB-CD1 4.42Å; Q269-L273 WeakPolarHBondContact O-CD1 3.43Å; Q269-L273 VanDerWaalsContact O-CG 3.3Å; Q269-L273 WeakPolarHBondContact O-CG 3.37Å; Q269-L273 PolarHBondContact O-N 3.2Å; Q269-L295 HydrophobicContact CG-CB 4.39Å; Q269-L295 HydrophobicContact CG-CD2 4.44Å; Q269-L295 PolarHBondContact NE2-O 3.19Å |
| 270 | M | 96.4 | Very high | 94.2 | Very high | 61 Ų | 61 | 95.8 Ų | 95.8 | 30% | 0.3 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.8 | -50.2 | -178.4 | -167.8 | 64 | 87.3 | 0 | 0 | 111.8 | F265 H266 P267 C272 L273 E274 L305 | F265-M270 HydrophobicContact CB-CE 4.27Å; F265-M270 HydrophobicContact CD2-CE 3.82Å; F265-M270 HydrophobicContact CG-CE 4.39Å; H266-M270 PolarHBondContact O-N 3.34Å; P267-M270 PolarHBondContact O-N 3.28Å; M270-C272 PolarHBondContact O-N 3.45Å; M270-L273 CarbonylContact O-C 3.59Å; M270-L273 WeakPolarHBondContact O-CA 3.43Å; M270-L273 WeakPolarHBondContact O-CB 3.43Å; M270-L273 PolarHBondContact O-N 3.13Å; M270-E274 HydrophobicContact CG-CG 4.19Å; M270-E274 VanDerWaalsContact CG-OE1 3.31Å; M270-E274 WeakPolarHBondContact CG-OE1 3.42Å; M270-E274 WeakPolarHBondContact O-CG 3.32Å; M270-E274 PolarHBondContact O-N 3.03Å; M270-L305 HydrophobicContact SD-CD2 4.23Å |
| 271 | S | 97.1 | Very high | 94.6 | Very high | 71 Ų | 71 | 88.3 Ų | 88.3 | 50% | 0.497 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -58.9 | -32.9 | 177.2 | 178.9 | 0 | 0 | 0 | 0 | 113.4 | P267 Q269 E274 S275 | P267-S271 PolarHBondContact O-N 3.29Å; Q269-S271 PolarHBondContact O-N 3.48Å; S271-E274 WeakPolarHBondContact CA-OE2 3.3Å; S271-S275 VanDerWaalsContact O-CB 3.31Å; S271-S275 WeakPolarHBondContact O-CB 3.28Å; S271-S275 PolarHBondContact O-N 3.01Å; S271-S275 VanDerWaalsContact O-N 3.09Å; S271-S275 PolarHBondContact O-OG 2.85Å |
| 272 | C | 96.5 | Very high | 95.2 | Very high | 26 Ų | 26 | 92.6 Ų | 92.6 | 18% | 0.176 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -74.3 | -26 | 173.7 | -168.8 | 0 | 0 | 0 | 0 | 113.2 | Q269 M270 F276 L295 | Q269-C272 PolarHBondContact O-N 2.7Å; Q269-C272 VanDerWaalsContact O-N 3.15Å; M270-C272 PolarHBondContact O-N 3.45Å; C272-F276 WeakPolarHBondContact O-CB 3.2Å; C272-F276 PolarHBondContact O-N 2.95Å; C272-L295 HydrophobicContact CB-CD1 4.48Å; C272-L295 HydrophobicContact CB-CD2 3.89Å |
| 273 | L | 97.1 | Very high | 95.6 | Very high | 4 Ų | 4 | 83.6 Ų | 83.6 | 2% | 0.021 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -80.7 | -45.5 | 177.3 | -68.9 | 155.4 | 0 | 0 | 0 | 110.2 | F265 Q269 M270 F276 F277 L291 L295 L297 I302 L305 F306 | F265-L273 HydrophobicContact CD1-CD1 4.39Å; Q269-L273 HydrophobicContact CB-CD1 4.42Å; Q269-L273 WeakPolarHBondContact O-CD1 3.43Å; Q269-L273 VanDerWaalsContact O-CG 3.3Å; Q269-L273 WeakPolarHBondContact O-CG 3.37Å; Q269-L273 PolarHBondContact O-N 3.2Å; M270-L273 CarbonylContact O-C 3.59Å; M270-L273 WeakPolarHBondContact O-CA 3.43Å; M270-L273 WeakPolarHBondContact O-CB 3.43Å; M270-L273 PolarHBondContact O-N 3.13Å; L273-F276 PolarHBondContact O-N 2.8Å; L273-F277 WeakPolarHBondContact O-CB 3.09Å; L273-F277 PolarHBondContact O-N 3.04Å; L273-L291 HydrophobicContact CD2-CD1 4.29Å; L273-L295 HydrophobicContact CD1-CD1 3.95Å; L273-L295 HydrophobicContact CD2-CD1 3.66Å; L273-L295 HydrophobicContact CG-CD1 3.59Å; L273-L297 HydrophobicContact CD1-CD1 4.21Å; L273-I302 HydrophobicContact CD2-CG2 3.97Å; L273-L305 HydrophobicContact CB-CD2 4.19Å; L273-L305 HydrophobicContact CD1-CD2 3.68Å; L273-L305 HydrophobicContact CD2-CD2 4.47Å; L273-L305 HydrophobicContact CG-CD2 4.31Å; L273-F306 HydrophobicContact CD2-CE2 3.96Å |
| 274 | E | 96.6 | Very high | 96.2 | Very high | 87 Ų | 87 | 83.6 Ų | 83.6 | 41% | 0.407 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -56.9 | -50.9 | 173 | -68.5 | 164.8 | 167.6 | 0 | 0 | 111.8 | M270 S271 F276 F277 Q278 | M270-E274 HydrophobicContact CG-CG 4.19Å; M270-E274 VanDerWaalsContact CG-OE1 3.31Å; M270-E274 WeakPolarHBondContact CG-OE1 3.42Å; M270-E274 WeakPolarHBondContact O-CG 3.32Å; M270-E274 PolarHBondContact O-N 3.03Å; S271-E274 WeakPolarHBondContact CA-OE2 3.3Å; E274-F276 PolarHBondContact O-N 3.43Å; E274-F277 PolarHBondContact O-N 3.08Å; E274-F277 VanDerWaalsContact O-N 3.16Å; E274-Q278 WeakPolarHBondContact O-CG 3.29Å; E274-Q278 PolarHBondContact O-N 2.92Å |
| 275 | S | 96.6 | Very high | 96.4 | Very high | 52 Ų | 52 | 78 Ų | 78 | 36% | 0.364 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -70.2 | -12 | 178.8 | 58.7 | 0 | 0 | 0 | 0 | 114.7 | S271 | S271-S275 VanDerWaalsContact O-CB 3.31Å; S271-S275 WeakPolarHBondContact O-CB 3.28Å; S271-S275 PolarHBondContact O-N 3.01Å; S271-S275 VanDerWaalsContact O-N 3.09Å; S271-S275 PolarHBondContact O-OG 2.85Å |
| 276 | F | 96.7 | Very high | 96.5 | Very high | 33 Ų | 33 | 85.1 Ų | 85.1 | 15% | 0.145 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -87.2 | -45.5 | 166.5 | -163.3 | -76.3 | 0 | 0 | 0 | 111 | C272 L273 E274 Q278 K279 N280 L283 D287 L291 F306 | C272-F276 WeakPolarHBondContact O-CB 3.2Å; C272-F276 PolarHBondContact O-N 2.95Å; L273-F276 PolarHBondContact O-N 2.8Å; E274-F276 PolarHBondContact O-N 3.43Å; F276-Q278 VanDerWaalsContact C-N 3.32Å; F276-Q278 PolarHBondContact O-N 2.8Å; F276-K279 PolarHBondContact O-N 3.1Å; F276-N280 HydrophobicContact CD1-CB 4.3Å; F276-N280 HydrophobicContact CE1-CB 3.81Å; F276-N280 PolarHBondContact O-N 3.28Å; F276-L283 HydrophobicContact CD1-CD1 3.81Å; F276-L283 HydrophobicContact CE1-CD1 3.35Å; F276-L283 HydrophobicContact CZ-CD1 4.14Å; F276-D287 HydrophobicContact CE1-CB 4.11Å; F276-D287 HydrophobicContact CZ-CB 3.76Å; F276-L291 HydrophobicContact CB-CD1 4.41Å; F276-L291 HydrophobicContact CB-CD2 4.48Å; F276-L291 HydrophobicContact CD1-CD1 4.05Å; F276-L291 HydrophobicContact CD2-CD1 4.21Å; F276-L291 HydrophobicContact CD2-CD2 3.88Å; F276-L291 HydrophobicContact CD2-CG 4.32Å; F276-L291 HydrophobicContact CE1-CD1 4.41Å; F276-L291 HydrophobicContact CE2-CD2 4.42Å; F276-L291 HydrophobicContact CG-CD1 3.95Å; F276-L291 HydrophobicContact CG-CD2 4.24Å; F276-F306 HydrophobicContact CB-CZ 4.49Å; F276-F306 HydrophobicContact CD1-CE1 4.28Å; F276-F306 HydrophobicContact CD1-CZ 4.04Å |
| 277 | F | 96.4 | Very high | 96.6 | Very high | 33 Ų | 33 | 81.1 Ų | 81.1 | 15% | 0.145 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -57.4 | -42.2 | 178.6 | -175 | -95.5 | 0 | 0 | 0 | 112.4 | L273 E274 K279 N280 P281 F306 H309 L310 | L273-F277 WeakPolarHBondContact O-CB 3.09Å; L273-F277 PolarHBondContact O-N 3.04Å; E274-F277 PolarHBondContact O-N 3.08Å; E274-F277 VanDerWaalsContact O-N 3.16Å; F277-K279 PolarHBondContact O-N 2.93Å; F277-K279 VanDerWaalsContact O-N 3.1Å; F277-N280 CarbonylContact O-C 3.54Å; F277-N280 PolarHBondContact O-N 3.48Å; F277-P281 HydrophobicContact CD2-CB 4.23Å; F277-P281 HydrophobicContact CE1-CB 4.33Å; F277-P281 HydrophobicContact CE2-CB 3.88Å; F277-P281 HydrophobicContact CZ-CB 3.94Å; F277-P281 WeakPolarHBondContact O-CA 3.5Å; F277-P281 VanDerWaalsContact O-N 3.16Å; F277-F306 HydrophobicContact CB-CE1 4.11Å; F277-F306 HydrophobicContact CB-CZ 4.13Å; F277-F306 AromaticContact CD2-CD1 3.68Å; F277-F306 HydrophobicContact CD2-CD1 3.68Å; F277-F306 AromaticContact CD2-CE1 3.72Å; F277-F306 HydrophobicContact CD2-CE1 3.72Å; F277-F306 HydrophobicContact CD2-CG 4.32Å; F277-F306 HydrophobicContact CD2-CZ 4.37Å; F277-F306 HydrophobicContact CE2-CD1 4.31Å; F277-F306 HydrophobicContact CG-CE1 4.41Å; F277-H309 AromaticContact CD1-CD2 3.46Å; F277-H309 VanDerWaalsContact CD1-CD2 3.46Å; F277-H309 WeakPolarHBondContact CD1-CD2 3.49Å; F277-H309 AromaticContact CD1-NE2 3.61Å; F277-H309 HydrophobicContact CD2-CB 4.42Å; F277-H309 AromaticContact CD2-CD2 3.77Å; F277-H309 AromaticContact CE1-CD2 3.57Å; F277-H309 AromaticContact CE1-CG 3.95Å; F277-H309 AromaticContact CE1-NE2 3.77Å; F277-H309 HydrophobicContact CE2-CB 3.92Å; F277-H309 AromaticContact CE2-CD2 3.88Å; F277-H309 AromaticContact CG-CD2 3.57Å; F277-H309 HydrophobicContact CZ-CB 4.06Å; F277-H309 AromaticContact CZ-CD2 3.78Å; F277-H309 AromaticContact CZ-CG 3.81Å; F277-L310 HydrophobicContact CE2-CD2 4.01Å; F277-L310 HydrophobicContact CE2-CG 4Å; F277-L310 HydrophobicContact CZ-CD2 4.01Å; F277-L310 HydrophobicContact CZ-CG 4.32Å |
| 278 | Q | 95.8 | Very high | 96.6 | Very high | 161 Ų | 161 | 78.7 Ų | 78.7 | 75% | 0.752 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -22.1 | 173.5 | -74.6 | 173.7 | -5.9 | 0 | 0 | 114.2 | E274 F276 | E274-Q278 WeakPolarHBondContact O-CG 3.29Å; E274-Q278 PolarHBondContact O-N 2.92Å; F276-Q278 VanDerWaalsContact C-N 3.32Å; F276-Q278 PolarHBondContact O-N 2.8Å |
| 279 | K | 95.9 | Very high | 96.7 | Very high | 164 Ų | 164 | 73.3 Ų | 73.3 | 71% | 0.713 | 36% | 0.359 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -100.5 | -41.3 | 179.3 | -60.2 | -179.8 | -176.4 | -175.8 | 0 | 111.9 | F276 F277 | F276-K279 PolarHBondContact O-N 3.1Å; F277-K279 PolarHBondContact O-N 2.93Å; F277-K279 VanDerWaalsContact O-N 3.1Å |
| 280 | N | 95.2 | Very high | 96.7 | Very high | 80 Ų | 80 | 77 Ų | 77 | 43% | 0.428 | 37% | 0.373 | S | S | . | . | trans | -139.4 | 90.9 | -178.5 | -66.6 | -59.1 | 0 | 0 | 0 | 109 | F276 F277 Y282 | F276-N280 HydrophobicContact CD1-CB 4.3Å; F276-N280 HydrophobicContact CE1-CB 3.81Å; F276-N280 PolarHBondContact O-N 3.28Å; F277-N280 CarbonylContact O-C 3.54Å; F277-N280 PolarHBondContact O-N 3.48Å; N280-Y282 PolarHBondContact O-N 2.97Å | ||
| 281 | P | 95.1 | Very high | 96.8 | Very high | 47 Ų | 47 | 74.1 Ų | 74.1 | 31% | 0.305 | 36% | 0.358 | S | S | . | . | S | Bend | trans | -70.7 | -22.9 | 179.6 | 27.9 | -34.8 | 0 | 0 | 0 | 112.3 | F277 L310 | F277-P281 HydrophobicContact CD2-CB 4.23Å; F277-P281 HydrophobicContact CE1-CB 4.33Å; F277-P281 HydrophobicContact CE2-CB 3.88Å; F277-P281 HydrophobicContact CZ-CB 3.94Å; F277-P281 WeakPolarHBondContact O-CA 3.5Å; F277-P281 VanDerWaalsContact O-N 3.16Å; P281-L310 HydrophobicContact CB-CD2 4.13Å |
| 282 | Y | 96.6 | Very high | 96.8 | Very high | 180 Ų | 180 | 72 Ų | 72 | 71% | 0.706 | 34% | 0.343 | S | S | * | . | S | Bend | trans | -99.4 | 118 | 172.8 | -57.7 | -72.6 | 0 | 0 | 0 | 110.4 | N280 L310 | N280-Y282 PolarHBondContact O-N 2.97Å; Y282-L310 HydrophobicContact CD1-CD1 4.06Å; Y282-L310 HydrophobicContact CE1-CD1 4.12Å; Y282-L310 HydrophobicContact CE1-CD2 4.12Å |
| 283 | L | 95.4 | Very high | 96.9 | Very high | 24 Ų | 24 | 78.8 Ų | 78.8 | 13% | 0.126 | 37% | 0.365 | C | S | . | . | trans | -100.8 | 111.8 | -167.2 | -166.4 | 67.1 | 0 | 0 | 0 | 112.7 | F276 D287 R288 L291 I302 F306 | F276-L283 HydrophobicContact CD1-CD1 3.81Å; F276-L283 HydrophobicContact CE1-CD1 3.35Å; F276-L283 HydrophobicContact CZ-CD1 4.14Å; L283-D287 HydrophobicContact CD1-CB 3.37Å; L283-D287 HydrophobicContact CG-CB 4.06Å; L283-R288 HydrophobicContact CD2-CG 3.5Å; L283-R288 HydrophobicContact CG-CG 3.76Å; L283-R288 PolarHBondContact O-NH1 3.44Å; L283-R288 VanDerWaalsContact O-NH1 3.1Å; L283-L291 HydrophobicContact CD1-CD1 3.82Å; L283-L291 HydrophobicContact CD2-CD1 4.17Å; L283-I302 HydrophobicContact CD2-CG2 3.51Å; L283-F306 HydrophobicContact CB-CD1 3.68Å; L283-F306 HydrophobicContact CB-CE1 4Å; L283-F306 HydrophobicContact CB-CG 4.22Å; L283-F306 HydrophobicContact CD1-CD1 4.41Å; L283-F306 HydrophobicContact CD1-CE1 3.89Å; L283-F306 HydrophobicContact CD1-CZ 4.08Å; L283-F306 HydrophobicContact CD2-CD1 3.99Å; L283-F306 HydrophobicContact CD2-CD2 3.88Å; L283-F306 HydrophobicContact CD2-CE1 4.08Å; L283-F306 HydrophobicContact CD2-CE2 3.98Å; L283-F306 HydrophobicContact CD2-CG 3.88Å; L283-F306 HydrophobicContact CD2-CZ 4.09Å; L283-F306 HydrophobicContact CG-CD1 4.26Å; L283-F306 HydrophobicContact CG-CE1 4.23Å | ||
| 284 | S | 96.9 | Very high | 96.9 | Very high | 54 Ų | 54 | 83.8 Ų | 83.8 | 38% | 0.378 | 39% | 0.387 | S | S | . | . | trans | -68.5 | 165.1 | 178.6 | 89.2 | 0 | 0 | 0 | 0 | 112.1 | R286 D287 R288 | S284-R286 VanDerWaalsContact C-N 3.3Å; S284-R286 PolarHBondContact O-N 2.89Å; S284-R286 PolarHBondContact OG-N 3.2Å; S284-D287 WeakPolarHBondContact CB-OD2 3.34Å; S284-D287 PolarHBondContact N-OD2 3.15Å; S284-D287 PolarHBondContact O-N 2.84Å; S284-D287 VanDerWaalsContact OG-CG 3.27Å; S284-D287 PolarHBondContact OG-N 3.26Å; S284-D287 PolarHBondContact OG-OD2 2.92Å; S284-R288 PolarHBondContact O-N 3.24Å | ||
| 285 | T | 97.3 | Very high | 96.9 | Very high | 78 Ų | 78 | 80.6 Ų | 80.6 | 48% | 0.479 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -58.8 | -41.3 | 175.6 | -53.3 | 0 | 0 | 0 | 0 | 112.1 | D287 R288 E289 | T285-D287 VanDerWaalsContact C-N 3.29Å; T285-D287 PolarHBondContact O-N 3.02Å; T285-R288 PolarHBondContact O-N 3.2Å; T285-R288 PolarHBondContact OG1-NH2 3.23Å; T285-E289 PolarHBondContact O-N 2.7Å |
| 286 | R | 97.7 | Very high | 96.9 | Very high | 195 Ų | 195 | 85.1 Ų | 85.1 | 74% | 0.736 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -63.8 | -36.2 | 177.6 | -175.6 | -178.5 | -68.2 | 162.5 | -1.3 | 111.9 | S284 Y290 | S284-R286 VanDerWaalsContact C-N 3.3Å; S284-R286 PolarHBondContact O-N 2.89Å; S284-R286 PolarHBondContact OG-N 3.2Å; R286-Y290 WeakPolarHBondContact O-CB 3.29Å; R286-Y290 PolarHBondContact O-N 3.34Å |
| 287 | D | 97.8 | Very high | 96.9 | Very high | 42 Ų | 42 | 84.3 Ų | 84.3 | 23% | 0.225 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -75 | -35.4 | 179.2 | -56 | -54.1 | 0 | 0 | 0 | 111.9 | F276 L283 S284 T285 Y290 L291 | F276-D287 HydrophobicContact CE1-CB 4.11Å; F276-D287 HydrophobicContact CZ-CB 3.76Å; L283-D287 HydrophobicContact CD1-CB 3.37Å; L283-D287 HydrophobicContact CG-CB 4.06Å; S284-D287 WeakPolarHBondContact CB-OD2 3.34Å; S284-D287 PolarHBondContact N-OD2 3.15Å; S284-D287 PolarHBondContact O-N 2.84Å; S284-D287 VanDerWaalsContact OG-CG 3.27Å; S284-D287 PolarHBondContact OG-N 3.26Å; S284-D287 PolarHBondContact OG-OD2 2.92Å; T285-D287 VanDerWaalsContact C-N 3.29Å; T285-D287 PolarHBondContact O-N 3.02Å; D287-Y290 PolarHBondContact O-N 2.91Å; D287-L291 WeakPolarHBondContact O-CB 3.37Å; D287-L291 WeakPolarHBondContact O-CG 3.3Å; D287-L291 PolarHBondContact O-N 3.08Å |
| 288 | R | 97.6 | Very high | 96.9 | Very high | 47 Ų | 47 | 85.5 Ų | 85.5 | 18% | 0.177 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -59.8 | -50.1 | 169.6 | -73.6 | -165.5 | -54.4 | -82.9 | 4 | 111.4 | L283 S284 T285 Y290 L291 S292 E299 | L283-R288 HydrophobicContact CD2-CG 3.5Å; L283-R288 HydrophobicContact CG-CG 3.76Å; L283-R288 PolarHBondContact O-NH1 3.44Å; L283-R288 VanDerWaalsContact O-NH1 3.1Å; S284-R288 PolarHBondContact O-N 3.24Å; T285-R288 PolarHBondContact O-N 3.2Å; T285-R288 PolarHBondContact OG1-NH2 3.23Å; R288-Y290 VanDerWaalsContact C-N 3.33Å; R288-Y290 PolarHBondContact O-N 3.45Å; R288-L291 PolarHBondContact O-N 2.93Å; R288-S292 WeakPolarHBondContact O-CB 3.42Å; R288-S292 PolarHBondContact O-N 3Å; R288-E299 HydrophobicContact CB-CB 4.34Å; R288-E299 HydrophobicContact CB-CG 4.11Å; R288-E299 IonicContact NE-OE2 2.91Å |
| 289 | E | 98.3 | Very high | 97 | Very high | 61 Ų | 61 | 80.8 Ų | 80.8 | 29% | 0.285 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -55.9 | -45.5 | 175 | -77.9 | -177.7 | -120.1 | 0 | 0 | 112.2 | T285 S292 R293 | T285-E289 PolarHBondContact O-N 2.7Å; E289-S292 WeakPolarHBondContact O-CB 3.31Å; E289-S292 PolarHBondContact O-N 2.91Å; E289-R293 VanDerWaalsContact O-CG 3.31Å; E289-R293 WeakPolarHBondContact O-CG 3.43Å; E289-R293 PolarHBondContact O-N 3.01Å; E289-R293 VanDerWaalsContact O-N 3.08Å; E289-R293 IonicContact OE2-CZ 3.86Å; E289-R293 VanDerWaalsContact OE2-CZ 3.25Å; E289-R293 IonicContact OE2-NH1 2.7Å; E289-R293 PolarHBondContact OE2-NH1 2.83Å; E289-R293 IonicContact OE2-NH2 3.25Å; E289-R293 PolarHBondContact OE2-NH2 3.41Å |
| 290 | Y | 97.9 | Very high | 97.1 | Very high | 118 Ų | 118 | 78.7 Ų | 78.7 | 46% | 0.463 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.4 | -50.2 | 179.1 | 171.6 | -100.3 | 0 | 0 | 0 | 112 | R286 D287 R288 S292 R293 K294 | R286-Y290 WeakPolarHBondContact O-CB 3.29Å; R286-Y290 PolarHBondContact O-N 3.34Å; D287-Y290 PolarHBondContact O-N 2.91Å; R288-Y290 VanDerWaalsContact C-N 3.33Å; R288-Y290 PolarHBondContact O-N 3.45Å; Y290-S292 VanDerWaalsContact C-N 3.33Å; Y290-S292 PolarHBondContact O-N 3.38Å; Y290-R293 PolarHBondContact O-N 3.47Å; Y290-K294 HydrophobicContact CE1-CD 3.71Å; Y290-K294 WeakPolarHBondContact O-CB 3.4Å; Y290-K294 PolarHBondContact O-N 2.89Å; Y290-K294 PolarHBondContact OH-NZ 2.96Å |
| 291 | L | 97.9 | Very high | 97.1 | Very high | 0 Ų | 0 | 80.7 Ų | 80.7 | 0% | 0 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -66.2 | -35.3 | 178.4 | -69.3 | 175.5 | 0 | 0 | 0 | 112 | L273 F276 L283 D287 R288 K294 L295 I302 F306 | L273-L291 HydrophobicContact CD2-CD1 4.29Å; F276-L291 HydrophobicContact CB-CD1 4.41Å; F276-L291 HydrophobicContact CB-CD2 4.48Å; F276-L291 HydrophobicContact CD1-CD1 4.05Å; F276-L291 HydrophobicContact CD2-CD1 4.21Å; F276-L291 HydrophobicContact CD2-CD2 3.88Å; F276-L291 HydrophobicContact CD2-CG 4.32Å; F276-L291 HydrophobicContact CE1-CD1 4.41Å; F276-L291 HydrophobicContact CE2-CD2 4.42Å; F276-L291 HydrophobicContact CG-CD1 3.95Å; F276-L291 HydrophobicContact CG-CD2 4.24Å; L283-L291 HydrophobicContact CD1-CD1 3.82Å; L283-L291 HydrophobicContact CD2-CD1 4.17Å; D287-L291 WeakPolarHBondContact O-CB 3.37Å; D287-L291 WeakPolarHBondContact O-CG 3.3Å; D287-L291 PolarHBondContact O-N 3.08Å; R288-L291 PolarHBondContact O-N 2.93Å; L291-K294 PolarHBondContact O-N 3.3Å; L291-L295 HydrophobicContact CD2-CD1 4.48Å; L291-L295 VanDerWaalsContact O-CB 3.29Å; L291-L295 WeakPolarHBondContact O-CB 3.31Å; L291-L295 WeakPolarHBondContact O-CG 3.33Å; L291-L295 PolarHBondContact O-N 3.38Å; L291-I302 HydrophobicContact CB-CD1 3.8Å; L291-I302 HydrophobicContact CB-CG2 4.35Å; L291-I302 HydrophobicContact CD1-CG2 4.13Å; L291-F306 HydrophobicContact CD1-CE2 4.36Å; L291-F306 HydrophobicContact CD1-CZ 4.27Å |
| 292 | S | 97.7 | Very high | 97.1 | Very high | 26 Ų | 26 | 78.5 Ų | 78.5 | 18% | 0.182 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -57 | -54.3 | 174.6 | 165.2 | 0 | 0 | 0 | 0 | 111.1 | R288 E289 Y290 K294 N296 L297 I302 | R288-S292 WeakPolarHBondContact O-CB 3.42Å; R288-S292 PolarHBondContact O-N 3Å; E289-S292 WeakPolarHBondContact O-CB 3.31Å; E289-S292 PolarHBondContact O-N 2.91Å; Y290-S292 VanDerWaalsContact C-N 3.33Å; Y290-S292 PolarHBondContact O-N 3.38Å; S292-K294 PolarHBondContact O-N 3.42Å; S292-N296 WeakPolarHBondContact O-CA 3.38Å; S292-N296 PolarHBondContact O-N 3.49Å; S292-L297 WeakPolarHBondContact CA-O 3.42Å; S292-L297 VanDerWaalsContact CB-O 3.29Å; S292-L297 WeakPolarHBondContact CB-O 3.46Å; S292-L297 PolarHBondContact O-N 3.31Å; S292-L297 PolarHBondContact OG-O 3.4Å; S292-I302 VanDerWaalsContact CA-CD1 3.5Å; S292-I302 VanDerWaalsContact N-CD1 3.28Å |
| 293 | R | 97.9 | Very high | 97.1 | Very high | 169 Ų | 169 | 76 Ų | 76 | 64% | 0.638 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -65.2 | -36.5 | 176.8 | -65.8 | 168.7 | -171.2 | 135.1 | 13.3 | 112.7 | E289 Y290 | E289-R293 VanDerWaalsContact O-CG 3.31Å; E289-R293 WeakPolarHBondContact O-CG 3.43Å; E289-R293 PolarHBondContact O-N 3.01Å; E289-R293 VanDerWaalsContact O-N 3.08Å; E289-R293 IonicContact OE2-CZ 3.86Å; E289-R293 VanDerWaalsContact OE2-CZ 3.25Å; E289-R293 IonicContact OE2-NH1 2.7Å; E289-R293 PolarHBondContact OE2-NH1 2.83Å; E289-R293 IonicContact OE2-NH2 3.25Å; E289-R293 PolarHBondContact OE2-NH2 3.41Å; Y290-R293 PolarHBondContact O-N 3.47Å |
| 294 | K | 97.4 | Very high | 97.1 | Very high | 109 Ų | 109 | 78.9 Ų | 78.9 | 47% | 0.474 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -73.5 | -32.2 | -178.2 | -175.6 | 176.1 | -172.4 | 172.8 | 0 | 113.7 | Y290 L291 S292 | Y290-K294 HydrophobicContact CE1-CD 3.71Å; Y290-K294 WeakPolarHBondContact O-CB 3.4Å; Y290-K294 PolarHBondContact O-N 2.89Å; Y290-K294 PolarHBondContact OH-NZ 2.96Å; L291-K294 PolarHBondContact O-N 3.3Å; S292-K294 PolarHBondContact O-N 3.42Å |
| 295 | L | 97.2 | Very high | 97 | Very high | 19 Ų | 19 | 78 Ų | 78 | 10% | 0.099 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -111.4 | -4.5 | -171.5 | -59.3 | 179.5 | 0 | 0 | 0 | 113.9 | Q269 C272 L273 L291 L297 | Q269-L295 HydrophobicContact CG-CB 4.39Å; Q269-L295 HydrophobicContact CG-CD2 4.44Å; Q269-L295 PolarHBondContact NE2-O 3.19Å; C272-L295 HydrophobicContact CB-CD1 4.48Å; C272-L295 HydrophobicContact CB-CD2 3.89Å; L273-L295 HydrophobicContact CD1-CD1 3.95Å; L273-L295 HydrophobicContact CD2-CD1 3.66Å; L273-L295 HydrophobicContact CG-CD1 3.59Å; L291-L295 HydrophobicContact CD2-CD1 4.48Å; L291-L295 VanDerWaalsContact O-CB 3.29Å; L291-L295 WeakPolarHBondContact O-CB 3.31Å; L291-L295 WeakPolarHBondContact O-CG 3.33Å; L291-L295 PolarHBondContact O-N 3.38Å; L295-L297 HydrophobicContact CB-CD1 3.83Å; L295-L297 HydrophobicContact CB-CG 4.09Å; L295-L297 HydrophobicContact CD1-CD1 4.25Å |
| 296 | N | 97.4 | Very high | 97 | Very high | 148 Ų | 148 | 74.6 Ų | 74.6 | 79% | 0.791 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 54.2 | 52.1 | -172.4 | -63.5 | -34.2 | 0 | 0 | 0 | 112 | S292 | S292-N296 WeakPolarHBondContact O-CA 3.38Å; S292-N296 PolarHBondContact O-N 3.49Å |
| 297 | L | 96.4 | Very high | 96.9 | Very high | 16 Ų | 16 | 69.2 Ų | 69.2 | 8% | 0.084 | 32% | 0.323 | C | S | . | . | trans | -128.2 | 144.2 | 178.9 | -67.2 | 171.2 | 0 | 0 | 0 | 109 | F265 L273 S292 L295 I302 | F265-L297 HydrophobicContact CD1-CD1 3.81Å; F265-L297 HydrophobicContact CD1-CD2 4.11Å; F265-L297 HydrophobicContact CE1-CD1 3.87Å; F265-L297 HydrophobicContact CE1-CD2 4.13Å; L273-L297 HydrophobicContact CD1-CD1 4.21Å; S292-L297 WeakPolarHBondContact CA-O 3.42Å; S292-L297 VanDerWaalsContact CB-O 3.29Å; S292-L297 WeakPolarHBondContact CB-O 3.46Å; S292-L297 PolarHBondContact O-N 3.31Å; S292-L297 PolarHBondContact OG-O 3.4Å; L295-L297 HydrophobicContact CB-CD1 3.83Å; L295-L297 HydrophobicContact CB-CG 4.09Å; L295-L297 HydrophobicContact CD1-CD1 4.25Å; L297-I302 HydrophobicContact CB-CD1 4.06Å; L297-I302 HydrophobicContact CB-CG1 4.05Å; L297-I302 HydrophobicContact CD1-CG1 4.37Å | ||
| 298 | S | 96.8 | Very high | 96.7 | Very high | 57 Ų | 57 | 73.7 Ų | 73.7 | 40% | 0.399 | 34% | 0.337 | S | S | . | . | trans | -66.7 | 146.5 | 172.9 | 59.7 | 0 | 0 | 0 | 0 | 111.4 | D300 R301 I302 | S298-D300 PolarHBondContact O-N 3.36Å; S298-R301 WeakPolarHBondContact O-CB 3.39Å; S298-R301 PolarHBondContact O-N 3.44Å; S298-R301 WeakPolarHBondContact OG-CG 3.2Å; S298-I302 PolarHBondContact O-N 2.68Å | ||
| 299 | E | 97.7 | Very high | 96.6 | Very high | 63 Ų | 63 | 74.4 Ų | 74.4 | 29% | 0.294 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -54.4 | -40.2 | 178.6 | -70.5 | -175.5 | -129.3 | 0 | 0 | 112.3 | R288 R301 I302 Y303 | R288-E299 HydrophobicContact CB-CB 4.34Å; R288-E299 HydrophobicContact CB-CG 4.11Å; R288-E299 IonicContact NE-OE2 2.91Å; E299-R301 VanDerWaalsContact C-N 3.29Å; E299-R301 PolarHBondContact O-N 3.38Å; E299-I302 PolarHBondContact O-N 2.85Å; E299-I302 VanDerWaalsContact O-N 3.12Å; E299-Y303 WeakPolarHBondContact O-CB 3.49Å; E299-Y303 PolarHBondContact O-N 3.09Å |
| 300 | D | 96.3 | Very high | 96.4 | Very high | 119 Ų | 119 | 74.8 Ų | 74.8 | 64% | 0.636 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -55.9 | -39.6 | 175.4 | -62.8 | -22.5 | 0 | 0 | 0 | 113 | S298 I302 L304 | S298-D300 PolarHBondContact O-N 3.36Å; D300-I302 VanDerWaalsContact C-N 3.34Å; D300-L304 VanDerWaalsContact O-CB 3.26Å; D300-L304 WeakPolarHBondContact O-CB 3.31Å; D300-L304 WeakPolarHBondContact O-CG 3.41Å; D300-L304 PolarHBondContact O-N 3.4Å |
| 301 | R | 95.2 | Very high | 96.3 | Very high | 123 Ų | 123 | 72.7 Ų | 72.7 | 46% | 0.464 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -69.1 | -36 | 179 | -76.6 | -179.4 | 179.4 | -157.5 | 2.9 | 111.6 | S298 E299 L305 | S298-R301 WeakPolarHBondContact O-CB 3.39Å; S298-R301 PolarHBondContact O-N 3.44Å; S298-R301 WeakPolarHBondContact OG-CG 3.2Å; E299-R301 VanDerWaalsContact C-N 3.29Å; E299-R301 PolarHBondContact O-N 3.38Å; R301-L305 WeakPolarHBondContact O-CB 3.42Å; R301-L305 PolarHBondContact O-N 2.94Å |
| 302 | I | 96.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 81.3 Ų | 81.3 | 0% | 0 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -73.9 | -44.1 | 178.4 | -57.8 | 169.9 | 0 | 0 | 0 | 109.6 | L273 L283 L291 S292 L297 S298 E299 D300 L305 F306 | L273-I302 HydrophobicContact CD2-CG2 3.97Å; L283-I302 HydrophobicContact CD2-CG2 3.51Å; L291-I302 HydrophobicContact CB-CD1 3.8Å; L291-I302 HydrophobicContact CB-CG2 4.35Å; L291-I302 HydrophobicContact CD1-CG2 4.13Å; S292-I302 VanDerWaalsContact CA-CD1 3.5Å; S292-I302 VanDerWaalsContact N-CD1 3.28Å; L297-I302 HydrophobicContact CB-CD1 4.06Å; L297-I302 HydrophobicContact CB-CG1 4.05Å; L297-I302 HydrophobicContact CD1-CG1 4.37Å; S298-I302 PolarHBondContact O-N 2.68Å; E299-I302 PolarHBondContact O-N 2.85Å; E299-I302 VanDerWaalsContact O-N 3.12Å; D300-I302 VanDerWaalsContact C-N 3.34Å; I302-L305 PolarHBondContact O-N 3.16Å; I302-F306 HydrophobicContact CG2-CD2 4.04Å; I302-F306 HydrophobicContact CG2-CE2 4.08Å; I302-F306 WeakPolarHBondContact O-CD2 3.37Å; I302-F306 PolarHBondContact O-N 3.19Å |
| 303 | Y | 96.2 | Very high | 95.5 | Very high | 129 Ų | 129 | 86.9 Ų | 86.9 | 51% | 0.506 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -58.1 | -49.4 | 173.9 | 177.1 | -105 | 0 | 0 | 0 | 111.9 | E299 L305 F306 M307 | E299-Y303 WeakPolarHBondContact O-CB 3.49Å; E299-Y303 PolarHBondContact O-N 3.09Å; Y303-L305 PolarHBondContact O-N 2.89Å; Y303-F306 PolarHBondContact O-N 3.23Å; Y303-M307 WeakPolarHBondContact O-CB 3.31Å; Y303-M307 PolarHBondContact O-N 3Å |
| 304 | L | 95.2 | Very high | 95.3 | Very high | 84 Ų | 84 | 82.8 Ų | 82.8 | 44% | 0.44 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -60.7 | -43.2 | 176.4 | -74.8 | 169.2 | 0 | 0 | 0 | 111.5 | D300 M307 Y308 | D300-L304 VanDerWaalsContact O-CB 3.26Å; D300-L304 WeakPolarHBondContact O-CB 3.31Å; D300-L304 WeakPolarHBondContact O-CG 3.41Å; D300-L304 PolarHBondContact O-N 3.4Å; L304-M307 PolarHBondContact O-N 2.54Å; L304-Y308 HydrophobicContact CB-CD2 4.47Å; L304-Y308 HydrophobicContact CB-CE2 4.47Å; L304-Y308 WeakPolarHBondContact O-CB 3.43Å; L304-Y308 WeakPolarHBondContact O-CD2 3.41Å; L304-Y308 PolarHBondContact O-N 3.37Å |
| 305 | L | 94.7 | Very high | 95.2 | Very high | 34 Ų | 34 | 81.4 Ų | 81.4 | 18% | 0.178 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -61.6 | -46.6 | 177 | -179.8 | 65.3 | 0 | 0 | 0 | 112 | F265 M270 L273 R301 I302 Y303 Y308 H309 | F265-L305 HydrophobicContact CD2-CD2 4.43Å; F265-L305 HydrophobicContact CE2-CB 4.46Å; F265-L305 HydrophobicContact CE2-CD1 3.98Å; F265-L305 HydrophobicContact CE2-CD2 4.01Å; F265-L305 HydrophobicContact CE2-CG 4.38Å; F265-L305 HydrophobicContact CZ-CB 4.21Å; F265-L305 HydrophobicContact CZ-CD2 4.05Å; M270-L305 HydrophobicContact SD-CD2 4.23Å; L273-L305 HydrophobicContact CB-CD2 4.19Å; L273-L305 HydrophobicContact CD1-CD2 3.68Å; L273-L305 HydrophobicContact CD2-CD2 4.47Å; L273-L305 HydrophobicContact CG-CD2 4.31Å; R301-L305 WeakPolarHBondContact O-CB 3.42Å; R301-L305 PolarHBondContact O-N 2.94Å; I302-L305 PolarHBondContact O-N 3.16Å; Y303-L305 PolarHBondContact O-N 2.89Å; L305-Y308 PolarHBondContact O-N 3.37Å; L305-H309 WeakPolarHBondContact O-CB 3.4Å; L305-H309 PolarHBondContact O-N 2.96Å |
| 306 | F | 96.5 | Very high | 95.1 | Very high | 7 Ų | 7 | 84.8 Ų | 84.8 | 3% | 0.031 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -64 | -40.4 | 177.5 | -88.6 | -116.5 | 0 | 0 | 0 | 111.7 | L273 F276 F277 L283 L291 I302 Y303 H309 L310 | L273-F306 HydrophobicContact CD2-CE2 3.96Å; F276-F306 HydrophobicContact CB-CZ 4.49Å; F276-F306 HydrophobicContact CD1-CE1 4.28Å; F276-F306 HydrophobicContact CD1-CZ 4.04Å; F277-F306 HydrophobicContact CB-CE1 4.11Å; F277-F306 HydrophobicContact CB-CZ 4.13Å; F277-F306 AromaticContact CD2-CD1 3.68Å; F277-F306 HydrophobicContact CD2-CD1 3.68Å; F277-F306 AromaticContact CD2-CE1 3.72Å; F277-F306 HydrophobicContact CD2-CE1 3.72Å; F277-F306 HydrophobicContact CD2-CG 4.32Å; F277-F306 HydrophobicContact CD2-CZ 4.37Å; F277-F306 HydrophobicContact CE2-CD1 4.31Å; F277-F306 HydrophobicContact CG-CE1 4.41Å; L283-F306 HydrophobicContact CB-CD1 3.68Å; L283-F306 HydrophobicContact CB-CE1 4Å; L283-F306 HydrophobicContact CB-CG 4.22Å; L283-F306 HydrophobicContact CD1-CD1 4.41Å; L283-F306 HydrophobicContact CD1-CE1 3.89Å; L283-F306 HydrophobicContact CD1-CZ 4.08Å; L283-F306 HydrophobicContact CD2-CD1 3.99Å; L283-F306 HydrophobicContact CD2-CD2 3.88Å; L283-F306 HydrophobicContact CD2-CE1 4.08Å; L283-F306 HydrophobicContact CD2-CE2 3.98Å; L283-F306 HydrophobicContact CD2-CG 3.88Å; L283-F306 HydrophobicContact CD2-CZ 4.09Å; L283-F306 HydrophobicContact CG-CD1 4.26Å; L283-F306 HydrophobicContact CG-CE1 4.23Å; L291-F306 HydrophobicContact CD1-CE2 4.36Å; L291-F306 HydrophobicContact CD1-CZ 4.27Å; I302-F306 HydrophobicContact CG2-CD2 4.04Å; I302-F306 HydrophobicContact CG2-CE2 4.08Å; I302-F306 WeakPolarHBondContact O-CD2 3.37Å; I302-F306 PolarHBondContact O-N 3.19Å; Y303-F306 PolarHBondContact O-N 3.23Å; F306-H309 PolarHBondContact O-N 3.45Å; F306-L310 WeakPolarHBondContact O-CB 3.48Å; F306-L310 VanDerWaalsContact O-CG 3.31Å; F306-L310 WeakPolarHBondContact O-CG 3.43Å; F306-L310 PolarHBondContact O-N 3.1Å |
| 307 | M | 95.2 | Very high | 95 | Very high | 83 Ų | 83 | 81.1 Ų | 81.1 | 41% | 0.409 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -63.8 | -43.3 | 175.4 | -175.1 | -84.3 | 159 | 0 | 0 | 111.8 | Y303 L304 T311 | Y303-M307 WeakPolarHBondContact O-CB 3.31Å; Y303-M307 PolarHBondContact O-N 3Å; L304-M307 PolarHBondContact O-N 2.54Å; M307-T311 VanDerWaalsContact CE-OG1 3.28Å; M307-T311 WeakPolarHBondContact CE-OG1 3.48Å; M307-T311 WeakPolarHBondContact O-CB 3.35Å; M307-T311 PolarHBondContact O-N 3.14Å; M307-T311 PolarHBondContact O-OG1 2.81Å |
| 308 | Y | 94.8 | Very high | 94.9 | Very high | 135 Ų | 135 | 85.2 Ų | 85.2 | 53% | 0.529 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -61.2 | -45.1 | 171.9 | -81.1 | -59.2 | 0 | 0 | 0 | 111.5 | L304 L305 L310 T311 Y312 | L304-Y308 HydrophobicContact CB-CD2 4.47Å; L304-Y308 HydrophobicContact CB-CE2 4.47Å; L304-Y308 WeakPolarHBondContact O-CB 3.43Å; L304-Y308 WeakPolarHBondContact O-CD2 3.41Å; L304-Y308 PolarHBondContact O-N 3.37Å; L305-Y308 PolarHBondContact O-N 3.37Å; Y308-L310 PolarHBondContact O-N 3.03Å; Y308-T311 PolarHBondContact O-N 3.13Å; Y308-Y312 HydrophobicContact CD1-CD2 4.2Å; Y308-Y312 AromaticContact CD1-CE2 3.89Å; Y308-Y312 HydrophobicContact CD1-CE2 3.89Å; Y308-Y312 HydrophobicContact CE1-CE2 4.42Å; Y308-Y312 WeakPolarHBondContact O-CD2 3.46Å; Y308-Y312 PolarHBondContact O-N 3.02Å; Y308-Y312 VanDerWaalsContact O-N 3.13Å |
| 309 | H | 94.3 | Very high | 94.8 | Very high | 63 Ų | 63 | 87.1 Ų | 87.1 | 29% | 0.292 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63 | -42.9 | -179 | -154.4 | 7.3 | 0 | 0 | 0 | 111.7 | F277 L305 F306 T311 Y312 C313 | F277-H309 AromaticContact CD1-CD2 3.46Å; F277-H309 VanDerWaalsContact CD1-CD2 3.46Å; F277-H309 WeakPolarHBondContact CD1-CD2 3.49Å; F277-H309 AromaticContact CD1-NE2 3.61Å; F277-H309 HydrophobicContact CD2-CB 4.42Å; F277-H309 AromaticContact CD2-CD2 3.77Å; F277-H309 AromaticContact CE1-CD2 3.57Å; F277-H309 AromaticContact CE1-CG 3.95Å; F277-H309 AromaticContact CE1-NE2 3.77Å; F277-H309 HydrophobicContact CE2-CB 3.92Å; F277-H309 AromaticContact CE2-CD2 3.88Å; F277-H309 AromaticContact CG-CD2 3.57Å; F277-H309 HydrophobicContact CZ-CB 4.06Å; F277-H309 AromaticContact CZ-CD2 3.78Å; F277-H309 AromaticContact CZ-CG 3.81Å; L305-H309 WeakPolarHBondContact O-CB 3.4Å; L305-H309 PolarHBondContact O-N 2.96Å; F306-H309 PolarHBondContact O-N 3.45Å; H309-T311 PolarHBondContact O-N 2.65Å; H309-Y312 PolarHBondContact O-N 2.81Å; H309-C313 VanDerWaalsContact CE1-SG 3.5Å; H309-C313 PolarHBondContact ND1-SG 2.72Å; H309-C313 WeakPolarHBondContact O-CB 3.17Å; H309-C313 PolarHBondContact O-N 3.41Å |
| 310 | L | 95.3 | Very high | 94.6 | Very high | 68 Ų | 68 | 88.8 Ų | 88.8 | 36% | 0.356 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -65.2 | -13.3 | 172.4 | -72.3 | 171 | 0 | 0 | 0 | 115 | F277 P281 Y282 F306 Y308 | F277-L310 HydrophobicContact CE2-CD2 4.01Å; F277-L310 HydrophobicContact CE2-CG 4Å; F277-L310 HydrophobicContact CZ-CD2 4.01Å; F277-L310 HydrophobicContact CZ-CG 4.32Å; P281-L310 HydrophobicContact CB-CD2 4.13Å; Y282-L310 HydrophobicContact CD1-CD1 4.06Å; Y282-L310 HydrophobicContact CE1-CD1 4.12Å; Y282-L310 HydrophobicContact CE1-CD2 4.12Å; F306-L310 WeakPolarHBondContact O-CB 3.48Å; F306-L310 VanDerWaalsContact O-CG 3.31Å; F306-L310 WeakPolarHBondContact O-CG 3.43Å; F306-L310 PolarHBondContact O-N 3.1Å; Y308-L310 PolarHBondContact O-N 3.03Å |
| 311 | T | 95.5 | Very high | 94.4 | Very high | 75 Ų | 75 | 86.5 Ų | 86.5 | 46% | 0.46 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -102.9 | -19.8 | -177.7 | -55.7 | 0 | 0 | 0 | 0 | 112.5 | M307 Y308 H309 | M307-T311 VanDerWaalsContact CE-OG1 3.28Å; M307-T311 WeakPolarHBondContact CE-OG1 3.48Å; M307-T311 WeakPolarHBondContact O-CB 3.35Å; M307-T311 PolarHBondContact O-N 3.14Å; M307-T311 PolarHBondContact O-OG1 2.81Å; Y308-T311 PolarHBondContact O-N 3.13Å; H309-T311 PolarHBondContact O-N 2.65Å |
| 312 | Y | 92.7 | Very high | 94.4 | Very high | 181 Ų | 181 | 83.4 Ų | 83.4 | 71% | 0.71 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -125.2 | 9.4 | -171.1 | -72.8 | -80.3 | 0 | 0 | 0 | 113.6 | Y308 H309 | Y308-Y312 HydrophobicContact CD1-CD2 4.2Å; Y308-Y312 AromaticContact CD1-CE2 3.89Å; Y308-Y312 HydrophobicContact CD1-CE2 3.89Å; Y308-Y312 HydrophobicContact CE1-CE2 4.42Å; Y308-Y312 WeakPolarHBondContact O-CD2 3.46Å; Y308-Y312 PolarHBondContact O-N 3.02Å; Y308-Y312 VanDerWaalsContact O-N 3.13Å; H309-Y312 PolarHBondContact O-N 2.81Å |
| 313 | C | 85.1 | Confident | 94.1 | Very high | 142 Ų | 142 | 91 Ų | 91 | 96% | 0.959 | 44% | 0.443 | S | S | * | . | trans | -138.8 | 0 | 175.4 | -63.1 | 0 | 0 | 0 | 0 | 109.9 | H309 | H309-C313 VanDerWaalsContact CE1-SG 3.5Å; H309-C313 PolarHBondContact ND1-SG 2.72Å; H309-C313 WeakPolarHBondContact O-CB 3.17Å; H309-C313 PolarHBondContact O-N 3.41Å |
Retrieved 313 of 313 residues in 53.5 ms
(Link to these results)