| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 38.2 | Very low | 44 | Very low | 242 Ų | 242 | 136.5 Ų | 136.5 | 100% | 1.192 | 78% | 0.775 | S | S | * | * | 0 | 75.4 | 0 | -64.3 | 164.5 | 130.4 | 0 | 0 | 106.3 | |||||
| 2 | N | 39.5 | Very low | 43.4 | Very low | 126 Ų | 126 | 134.8 Ų | 134.8 | 67% | 0.674 | 78% | 0.778 | S | S | * | * | 26.9 | 109.4 | 89 | -159.3 | 12.7 | 0 | 0 | 0 | 114.7 | T4 | N2-T4 PolarHBondContact OD1-N 3.28Š| |||
| 3 | S | 45.3 | Very low | 42.6 | Very low | 122 Ų | 122 | 129.8 Ų | 129.8 | 85% | 0.853 | 77% | 0.774 | S | S | * | * | trans | -149.9 | 90.5 | 141.2 | -76.7 | 0 | 0 | 0 | 0 | 107.8 | A5 | S3-A5 PolarHBondContact O-N 3.41Š| ||
| 4 | T | 52.4 | Low | 42.8 | Very low | 113 Ų | 113 | 132.3 Ų | 132.3 | 69% | 0.693 | 78% | 0.78 | S | S | * | * | trans | -47 | 120.3 | 157.3 | 39.4 | 0 | 0 | 0 | 0 | 110.5 | N2 F6 | N2-T4 PolarHBondContact OD1-N 3.28Å; T4-F6 PolarHBondContact O-N 3.32Å; T4-F6 VanDerWaalsContact O-N 3.09Å | ||
| 5 | A | 47 | Very low | 42.8 | Very low | 109 Ų | 109 | 136.3 Ų | 136.3 | 90% | 0.901 | 78% | 0.784 | S | S | * | * | trans | -65 | 105.6 | 169.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | S3 | S3-A5 PolarHBondContact O-N 3.41Š| ||
| 6 | F | 42.5 | Very low | 42.6 | Very low | 140 Ų | 140 | 137.6 Ų | 137.6 | 61% | 0.614 | 79% | 0.788 | S | S | * | * | trans | -100.9 | 95.9 | 175.8 | -170.3 | -98.3 | 0 | 0 | 0 | 107.6 | T4 Q8 | T4-F6 PolarHBondContact O-N 3.32Å; T4-F6 VanDerWaalsContact O-N 3.09Å; F6-Q8 HydrophobicContact CD1-CB 3.91Å; F6-Q8 HydrophobicContact CD1-CG 3.91Å; F6-Q8 HydrophobicContact CD2-CG 4.11Å; F6-Q8 HydrophobicContact CE1-CB 3.58Å; F6-Q8 HydrophobicContact CE1-CG 3.4Å; F6-Q8 VanDerWaalsContact CE1-CG 3.4Å; F6-Q8 HydrophobicContact CE2-CG 3.62Å; F6-Q8 VanDerWaalsContact CE2-NE2 3.29Å; F6-Q8 HydrophobicContact CG-CG 4.3Å; F6-Q8 HydrophobicContact CZ-CB 4.08Å; F6-Q8 HydrophobicContact CZ-CG 3.35Å | ||
| 7 | N | 42.8 | Very low | 42.7 | Very low | 168 Ų | 168 | 140.2 Ų | 140.2 | 90% | 0.898 | 79% | 0.788 | S | S | * | * | trans | -105.2 | 81.2 | 155.8 | -88.9 | -18.3 | 0 | 0 | 0 | 107.1 | T9 | N7-T9 PolarHBondContact O-N 3.33Š| ||
| 8 | Q | 41.6 | Very low | 42.9 | Very low | 96 Ų | 96 | 138.8 Ų | 138.8 | 45% | 0.449 | 78% | 0.784 | S | S | . | * | trans | -68.9 | 112.1 | 155.2 | -89 | -172.5 | -9 | 0 | 0 | 108.6 | F6 E10 | F6-Q8 HydrophobicContact CD1-CB 3.91Å; F6-Q8 HydrophobicContact CD1-CG 3.91Å; F6-Q8 HydrophobicContact CD2-CG 4.11Å; F6-Q8 HydrophobicContact CE1-CB 3.58Å; F6-Q8 HydrophobicContact CE1-CG 3.4Å; F6-Q8 VanDerWaalsContact CE1-CG 3.4Å; F6-Q8 HydrophobicContact CE2-CG 3.62Å; F6-Q8 VanDerWaalsContact CE2-NE2 3.29Å; F6-Q8 HydrophobicContact CG-CG 4.3Å; F6-Q8 HydrophobicContact CZ-CB 4.08Å; F6-Q8 HydrophobicContact CZ-CG 3.35Å; Q8-E10 HydrophobicContact CB-CG 3.73Å; Q8-E10 HydrophobicContact CG-CG 3.76Å; Q8-E10 PolarHBondContact NE2-OE1 3.16Å; Q8-E10 PolarHBondContact OE1-OE1 3.06Å; Q8-E10 VanDerWaalsContact OE1-OE1 3.09Å | ||
| 9 | T | 44.4 | Very low | 42.8 | Very low | 145 Ų | 145 | 139.2 Ų | 139.2 | 89% | 0.89 | 78% | 0.778 | S | S | * | * | trans | -106.7 | 85.5 | 141 | -56.6 | 0 | 0 | 0 | 0 | 105.3 | N7 | N7-T9 PolarHBondContact O-N 3.33Š| ||
| 10 | E | 49.8 | Very low | 42.6 | Very low | 138 Ų | 138 | 140.6 Ų | 140.6 | 65% | 0.645 | 78% | 0.784 | S | S | * | * | trans | -71 | 130.1 | 162.9 | -31 | -169.1 | 118.7 | 0 | 0 | 107 | Q8 | Q8-E10 HydrophobicContact CB-CG 3.73Å; Q8-E10 HydrophobicContact CG-CG 3.76Å; Q8-E10 PolarHBondContact NE2-OE1 3.16Å; Q8-E10 PolarHBondContact OE1-OE1 3.06Å; Q8-E10 VanDerWaalsContact OE1-OE1 3.09Å | ||
| 11 | S | 40.7 | Very low | 42.8 | Very low | 103 Ų | 103 | 139.2 Ų | 139.2 | 72% | 0.72 | 77% | 0.774 | S | S | * | * | trans | -179.8 | 117.8 | 136.3 | 177.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 12 | S | 36.1 | Very low | 43.4 | Very low | 116 Ų | 116 | 133 Ų | 133 | 81% | 0.811 | 74% | 0.741 | S | S | * | * | trans | 74.2 | 106 | 153.9 | -47.3 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 13 | G | 34 | Very low | 43.7 | Very low | 70 Ų | 70 | 132 Ų | 132 | 72% | 0.722 | 74% | 0.742 | S | S | * | * | cis | 127.7 | 129.7 | 33.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 14 | L | 45.3 | Very low | 43.9 | Very low | 164 Ų | 164 | 132 Ų | 132 | 86% | 0.859 | 74% | 0.741 | S | S | * | * | trans | 74.1 | 147.1 | 160.6 | -70.7 | 150.7 | 0 | 0 | 0 | 119.4 | ||||
| 15 | F | 41.9 | Very low | 43.7 | Very low | 193 Ų | 193 | 130.6 Ų | 130.6 | 85% | 0.846 | 73% | 0.729 | S | S | * | * | trans | 81.9 | 90.7 | -179.6 | -63.3 | -87.2 | 0 | 0 | 0 | 114.3 | ||||
| 16 | N | 40.6 | Very low | 43.8 | Very low | 157 Ų | 157 | 131.3 Ų | 131.3 | 84% | 0.84 | 71% | 0.712 | S | S | * | * | cis | 50.4 | 96.2 | 36.2 | -123 | -10.6 | 0 | 0 | 0 | 113.6 | ||||
| 17 | K | 44.2 | Very low | 43.7 | Very low | 182 Ų | 182 | 130.9 Ų | 130.9 | 79% | 0.791 | 73% | 0.726 | S | S | * | * | S | Bend | trans | 70.9 | 133.9 | 166 | -166.6 | 171.5 | 159.8 | 70.7 | 0 | 115.4 | ||
| 18 | T | 46.4 | Very low | 43.8 | Very low | 115 Ų | 115 | 127.3 Ų | 127.3 | 71% | 0.706 | 71% | 0.714 | S | S | * | * | trans | 75.5 | 120.4 | -179.4 | -8.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 19 | E | 40.1 | Very low | 43.7 | Very low | 145 Ų | 145 | 128.4 Ų | 128.4 | 68% | 0.678 | 73% | 0.727 | S | S | * | * | -160.3 | 127.1 | 55.5 | -58.9 | -157.2 | 142.4 | 0 | 0 | 110.2 | I21 | E19-I21 HydrophobicContact CB-CD1 4.14Å; E19-I21 HydrophobicContact CB-CG1 3.65Å; E19-I21 PolarHBondContact O-N 3.38Å | |||
| 20 | D | 39.5 | Very low | 43.6 | Very low | 167 Ų | 167 | 128.3 Ų | 128.3 | 89% | 0.893 | 73% | 0.726 | S | S | * | * | trans | -58.7 | 67.5 | 153.1 | -58.9 | -73.3 | 0 | 0 | 0 | 109.3 | F22 | D20-F22 PolarHBondContact O-N 3.07Š| ||
| 21 | I | 47.6 | Very low | 43.1 | Very low | 112 Ų | 112 | 126.1 Ų | 126.1 | 57% | 0.574 | 72% | 0.723 | S | S | * | * | trans | -69.5 | 86.3 | 168 | -64.8 | 166.7 | 0 | 0 | 0 | 104.5 | E19 C23 | E19-I21 HydrophobicContact CB-CD1 4.14Å; E19-I21 HydrophobicContact CB-CG1 3.65Å; E19-I21 PolarHBondContact O-N 3.38Å; I21-C23 WeakPolarHBondContact O-CA 3.04Å; I21-C23 WeakPolarHBondContact O-CB 3.39Å; I21-C23 PolarHBondContact O-N 3.32Å | ||
| 22 | F | 50 | Low | 43.2 | Very low | 113 Ų | 113 | 128 Ų | 128 | 50% | 0.496 | 73% | 0.725 | S | S | . | * | 36.5 | 31.1 | 118.7 | -124.2 | -112.9 | 0 | 0 | 0 | 117.3 | D20 C24 Q52 M56 | D20-F22 PolarHBondContact O-N 3.07Å; F22-C24 VanDerWaalsContact C-N 3.32Å; F22-C24 PolarHBondContact O-N 3.38Å; F22-Q52 HydrophobicContact CD1-CG 4.37Å; F22-Q52 HydrophobicContact CE1-CG 3.24Å; F22-Q52 HydrophobicContact CE2-CG 4.07Å; F22-Q52 HydrophobicContact CZ-CG 3.08Å; F22-M56 HydrophobicContact CE1-CG 4.04Å; F22-M56 HydrophobicContact CZ-CE 4.11Å; F22-M56 HydrophobicContact CZ-CG 4.3Å | |||
| 23 | C | 46.5 | Very low | 43.4 | Very low | 103 Ų | 103 | 128 Ų | 128 | 70% | 0.696 | 72% | 0.715 | S | S | * | * | trans | -86.3 | -1.4 | -162.6 | -112.3 | 0 | 0 | 0 | 0 | 113.6 | I21 | I21-C23 WeakPolarHBondContact O-CA 3.04Å; I21-C23 WeakPolarHBondContact O-CB 3.39Å; I21-C23 PolarHBondContact O-N 3.32Å | ||
| 24 | C | 49.6 | Very low | 43.7 | Very low | 123 Ų | 123 | 127.9 Ų | 127.9 | 83% | 0.831 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -132.6 | 63.6 | -170.1 | -64 | 0 | 0 | 0 | 0 | 113.4 | F22 | F22-C24 VanDerWaalsContact C-N 3.32Å; F22-C24 PolarHBondContact O-N 3.38Å |
| 25 | N | 48.2 | Very low | 43.6 | Very low | 83 Ų | 83 | 129.7 Ų | 129.7 | 44% | 0.444 | 72% | 0.716 | S | S | . | * | S | Bend | trans | -170.7 | 45.6 | 139.2 | -135 | -36.5 | 0 | 0 | 0 | 116.7 | R49 | N25-R49 VanDerWaalsContact CG-NH2 3.27Å; N25-R49 PolarHBondContact ND2-NH2 3.11Å; N25-R49 VanDerWaalsContact ND2-NH2 3.14Å; N25-R49 PolarHBondContact OD1-NE 2.96Å; N25-R49 PolarHBondContact OD1-NH2 2.67Å |
| 26 | F | 47.6 | Very low | 43.7 | Very low | 125 Ų | 125 | 126.7 Ų | 126.7 | 55% | 0.548 | 71% | 0.713 | S | S | . | * | trans | -135.3 | 12.6 | 171.9 | -97.9 | -76.9 | 0 | 0 | 0 | 114.7 | S28 I53 | F26-S28 PolarHBondContact O-N 3.04Å; F26-I53 HydrophobicContact CE2-CG1 3.97Å; F26-I53 HydrophobicContact CZ-CD1 4.11Å; F26-I53 HydrophobicContact CZ-CG1 3.68Å | ||
| 27 | S | 41.8 | Very low | 44 | Very low | 131 Ų | 131 | 122.5 Ų | 122.5 | 92% | 0.916 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | 10 | -179.7 | -86.7 | 0 | 0 | 0 | 0 | 115.3 | ||
| 28 | S | 44.4 | Very low | 43.9 | Very low | 93 Ų | 93 | 117.2 Ų | 117.2 | 65% | 0.65 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -155.1 | 32.9 | -178.7 | -170.4 | 0 | 0 | 0 | 0 | 115.5 | F26 | F26-S28 PolarHBondContact O-N 3.04Š|
| 29 | V | 39.8 | Very low | 43.7 | Very low | 118 Ų | 118 | 116.4 Ų | 116.4 | 72% | 0.715 | 68% | 0.679 | S | S | * | * | trans | -134.8 | 44.2 | 167.7 | -166 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 30 | V | 42.7 | Very low | 44.1 | Very low | 144 Ų | 144 | 113.6 Ų | 113.6 | 87% | 0.873 | 67% | 0.674 | S | S | * | * | trans | -122.4 | 57.5 | 151.2 | -170.9 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 31 | T | 39.3 | Very low | 44.3 | Very low | 92 Ų | 92 | 112.3 Ų | 112.3 | 56% | 0.564 | 67% | 0.667 | S | S | * | * | trans | -114 | 113.5 | 161.9 | -42.8 | 0 | 0 | 0 | 0 | 105.4 | N33 | T31-N33 WeakPolarHBondContact CG2-OD1 3.25Å; T31-N33 PolarHBondContact O-N 3.47Å | ||
| 32 | D | 42 | Very low | 44.3 | Very low | 143 Ų | 143 | 111.3 Ų | 111.3 | 77% | 0.765 | 66% | 0.66 | S | S | * | * | trans | -73.5 | 52.3 | -172.6 | 68.7 | -36.9 | 0 | 0 | 0 | 112 | ||||
| 33 | N | 41.2 | Very low | 44.2 | Very low | 114 Ų | 114 | 114.5 Ų | 114.5 | 61% | 0.61 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -167.6 | 113.4 | 174.5 | 24.7 | 65.1 | 0 | 0 | 0 | 112.6 | T31 | T31-N33 WeakPolarHBondContact CG2-OD1 3.25Å; T31-N33 PolarHBondContact O-N 3.47Å |
| 34 | G | 39.7 | Very low | 44.3 | Very low | 69 Ų | 69 | 114 Ų | 114 | 71% | 0.711 | 67% | 0.667 | S | S | * | * | trans | 75.4 | 101 | 152.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | V36 | G34-V36 PolarHBondContact O-N 3.36Š| ||
| 35 | F | 42.7 | Very low | 44.3 | Very low | 202 Ų | 202 | 114.1 Ų | 114.1 | 89% | 0.886 | 66% | 0.658 | S | S | * | * | trans | -15.8 | 96.2 | 149.6 | -174.9 | -96.7 | 0 | 0 | 0 | 114.6 | ||||
| 36 | V | 43.5 | Very low | 44.4 | Very low | 130 Ų | 130 | 113.7 Ų | 113.7 | 79% | 0.788 | 65% | 0.652 | S | S | * | * | trans | -133.4 | 94.9 | 161.3 | 174.7 | 0 | 0 | 0 | 0 | 107.1 | G34 | G34-V36 PolarHBondContact O-N 3.36Š| ||
| 37 | A | 48 | Very low | 44.8 | Very low | 69 Ų | 69 | 113.6 Ų | 113.6 | 57% | 0.57 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 127.7 | 162.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||
| 38 | P | 42.1 | Very low | 45.6 | Very low | 70 Ų | 70 | 114.2 Ų | 114.2 | 46% | 0.455 | 65% | 0.647 | S | S | . | * | P | Polyproline II helix | trans | -75.9 | 159 | 171.2 | 32 | -30 | 0 | 0 | 0 | 110.4 | F46 | P38-F46 HydrophobicContact CG-CE2 4.27Š|
| 39 | T | 42.4 | Very low | 46.3 | Very low | 98 Ų | 98 | 113.4 Ų | 113.4 | 60% | 0.601 | 63% | 0.63 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 157.7 | -159.2 | 39.3 | 0 | 0 | 0 | 0 | 116.2 | D41 | T39-D41 VanDerWaalsContact C-N 3.26Å; T39-D41 PolarHBondContact O-N 3.36Å |
| 40 | P | 47 | Very low | 47.4 | Very low | 86 Ų | 86 | 111.4 Ų | 111.4 | 56% | 0.558 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.5 | 40.2 | -157.8 | 33.1 | -37.5 | 0 | 0 | 0 | 116.9 | ||
| 41 | D | 44.8 | Very low | 48.9 | Very low | 141 Ų | 141 | 108.9 Ų | 108.9 | 75% | 0.754 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.4 | -6.2 | -179.2 | -33.5 | -31.6 | 0 | 0 | 0 | 111.7 | T39 | T39-D41 VanDerWaalsContact C-N 3.26Å; T39-D41 PolarHBondContact O-N 3.36Å |
| 42 | E | 47.7 | Very low | 49.8 | Very low | 91 Ų | 91 | 107.4 Ų | 107.4 | 43% | 0.425 | 59% | 0.589 | S | S | . | * | trans | -114.8 | 20.2 | -167.5 | -57 | -178.5 | 112.9 | 0 | 0 | 113.9 | S44 L45 F46 | E42-S44 PolarHBondContact O-N 2.84Å; E42-L45 PolarHBondContact O-N 3.28Å; E42-F46 PolarHBondContact O-N 2.66Å | ||
| 43 | R | 47.6 | Very low | 51.2 | Low | 179 Ų | 179 | 103.3 Ų | 103.3 | 68% | 0.675 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -63.8 | -29.7 | -165 | -61.9 | -169.4 | -166.9 | -173 | 2 | 115.5 | F46 L47 | R43-F46 PolarHBondContact O-N 3.46Å; R43-L47 PolarHBondContact O-N 2.62Å; R43-L47 VanDerWaalsContact O-N 3.15Å |
| 44 | S | 48.4 | Very low | 52.9 | Low | 94 Ų | 94 | 100 Ų | 100 | 66% | 0.657 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -73.9 | -38.2 | -179.8 | 50.3 | 0 | 0 | 0 | 0 | 112.6 | E42 F46 M48 | E42-S44 PolarHBondContact O-N 2.84Å; S44-F46 VanDerWaalsContact C-N 3.27Å; S44-M48 PolarHBondContact O-N 3.04Å |
| 45 | L | 49.3 | Very low | 55 | Low | 124 Ų | 124 | 100.2 Ų | 100.2 | 65% | 0.649 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -69.2 | -29.9 | 172.7 | -66.3 | 174.1 | 0 | 0 | 0 | 111.4 | E42 M48 R49 | E42-L45 PolarHBondContact O-N 3.28Å; L45-M48 PolarHBondContact O-N 2.75Å; L45-R49 PolarHBondContact O-N 2.76Å |
| 46 | F | 50.3 | Low | 56.6 | Low | 74 Ų | 74 | 95 Ų | 95 | 33% | 0.325 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -69.1 | -40.5 | 175.8 | -125.9 | -87.5 | 0 | 0 | 0 | 113.3 | P38 E42 R43 S44 M48 R49 V50 | P38-F46 HydrophobicContact CG-CE2 4.27Å; E42-F46 PolarHBondContact O-N 2.66Å; R43-F46 PolarHBondContact O-N 3.46Å; S44-F46 VanDerWaalsContact C-N 3.27Å; F46-M48 VanDerWaalsContact C-N 3.28Å; F46-M48 PolarHBondContact O-N 3.17Å; F46-R49 PolarHBondContact O-N 3.39Å; F46-V50 HydrophobicContact CD1-CG2 4.07Å; F46-V50 WeakPolarHBondContact O-CB 3.49Å; F46-V50 VanDerWaalsContact O-CG2 3.27Å; F46-V50 WeakPolarHBondContact O-CG2 3.49Å; F46-V50 PolarHBondContact O-N 3.36Å |
| 47 | L | 56.5 | Low | 58.3 | Low | 123 Ų | 123 | 91.9 Ų | 91.9 | 64% | 0.644 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -60.2 | -41.8 | 175.1 | -72.3 | 175.5 | 0 | 0 | 0 | 111.3 | R43 V50 V51 | R43-L47 PolarHBondContact O-N 2.62Å; R43-L47 VanDerWaalsContact O-N 3.15Å; L47-V50 PolarHBondContact O-N 3.16Å; L47-V51 WeakPolarHBondContact O-CB 3.29Å; L47-V51 VanDerWaalsContact O-CG2 3.23Å; L47-V51 WeakPolarHBondContact O-CG2 3.39Å; L47-V51 PolarHBondContact O-N 2.84Å |
| 48 | M | 57.2 | Low | 60 | Low | 144 Ų | 144 | 92.7 Ų | 92.7 | 71% | 0.709 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -67 | -41.6 | 179 | -149.3 | 171.3 | 169.3 | 0 | 0 | 111.3 | S44 L45 F46 V51 Q52 | S44-M48 PolarHBondContact O-N 3.04Å; L45-M48 PolarHBondContact O-N 2.75Å; F46-M48 VanDerWaalsContact C-N 3.28Å; F46-M48 PolarHBondContact O-N 3.17Å; M48-V51 PolarHBondContact O-N 2.75Å; M48-Q52 WeakPolarHBondContact O-CB 3.29Å; M48-Q52 PolarHBondContact O-N 3.4Å |
| 49 | R | 59.9 | Low | 62.1 | Low | 76 Ų | 76 | 93.6 Ų | 93.6 | 29% | 0.287 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62 | -43.2 | 173.3 | -171.9 | -171.9 | -80.7 | 158 | -7.7 | 112 | N25 L45 F46 Q52 I53 | N25-R49 VanDerWaalsContact CG-NH2 3.27Å; N25-R49 PolarHBondContact ND2-NH2 3.11Å; N25-R49 VanDerWaalsContact ND2-NH2 3.14Å; N25-R49 PolarHBondContact OD1-NE 2.96Å; N25-R49 PolarHBondContact OD1-NH2 2.67Å; L45-R49 PolarHBondContact O-N 2.76Å; F46-R49 PolarHBondContact O-N 3.39Å; R49-Q52 PolarHBondContact O-N 3.26Å; R49-I53 HydrophobicContact CG-CD1 3.82Å; R49-I53 HydrophobicContact CG-CG1 4.48Å; R49-I53 WeakPolarHBondContact O-CB 3.11Å; R49-I53 WeakPolarHBondContact O-CD1 3.1Å; R49-I53 WeakPolarHBondContact O-CG1 3.48Å; R49-I53 PolarHBondContact O-N 2.64Å |
| 50 | V | 63 | Low | 63.6 | Low | 76 Ų | 76 | 92.3 Ų | 92.3 | 46% | 0.461 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.4 | -41.2 | 179.6 | 172 | 0 | 0 | 0 | 0 | 111.6 | F46 L47 Q52 I53 A54 | F46-V50 HydrophobicContact CD1-CG2 4.07Å; F46-V50 WeakPolarHBondContact O-CB 3.49Å; F46-V50 VanDerWaalsContact O-CG2 3.27Å; F46-V50 WeakPolarHBondContact O-CG2 3.49Å; F46-V50 PolarHBondContact O-N 3.36Å; L47-V50 PolarHBondContact O-N 3.16Å; V50-Q52 VanDerWaalsContact C-N 3.31Å; V50-Q52 PolarHBondContact O-N 2.8Å; V50-I53 PolarHBondContact O-N 3.46Å; V50-A54 WeakPolarHBondContact O-CB 3.35Å; V50-A54 PolarHBondContact O-N 2.74Å |
| 51 | V | 74.8 | Confident | 65.4 | Low | 91 Ų | 91 | 92.8 Ų | 92.8 | 55% | 0.552 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.1 | -40.7 | 175.2 | 171.7 | 0 | 0 | 0 | 0 | 110.3 | L47 M48 A54 V55 | L47-V51 WeakPolarHBondContact O-CB 3.29Å; L47-V51 VanDerWaalsContact O-CG2 3.23Å; L47-V51 WeakPolarHBondContact O-CG2 3.39Å; L47-V51 PolarHBondContact O-N 2.84Å; M48-V51 PolarHBondContact O-N 2.75Å; V51-A54 PolarHBondContact O-N 2.79Å; V51-V55 HydrophobicContact CG1-CG2 4.34Å; V51-V55 WeakPolarHBondContact O-CB 3.11Å; V51-V55 VanDerWaalsContact O-CG2 3.24Å; V51-V55 WeakPolarHBondContact O-CG2 3.24Å; V51-V55 PolarHBondContact O-N 2.64Å |
| 52 | Q | 57 | Low | 67.4 | Low | 62 Ų | 62 | 90 Ų | 90 | 29% | 0.29 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 177.9 | -161.9 | 175.9 | 26 | 0 | 0 | 112.1 | F22 M48 R49 V50 M56 | F22-Q52 HydrophobicContact CD1-CG 4.37Å; F22-Q52 HydrophobicContact CE1-CG 3.24Å; F22-Q52 HydrophobicContact CE2-CG 4.07Å; F22-Q52 HydrophobicContact CZ-CG 3.08Å; M48-Q52 WeakPolarHBondContact O-CB 3.29Å; M48-Q52 PolarHBondContact O-N 3.4Å; R49-Q52 PolarHBondContact O-N 3.26Å; V50-Q52 VanDerWaalsContact C-N 3.31Å; V50-Q52 PolarHBondContact O-N 2.8Å; Q52-M56 WeakPolarHBondContact O-CB 3.39Å; Q52-M56 WeakPolarHBondContact O-CG 3.46Å; Q52-M56 PolarHBondContact O-N 3.42Å |
| 53 | I | 72.7 | Confident | 69.3 | Low | 56 Ų | 56 | 89.8 Ų | 89.8 | 29% | 0.287 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.2 | -47.4 | 173.5 | -66.2 | 166.9 | 0 | 0 | 0 | 110.3 | F26 R49 V50 V55 M56 C57 | F26-I53 HydrophobicContact CE2-CG1 3.97Å; F26-I53 HydrophobicContact CZ-CD1 4.11Å; F26-I53 HydrophobicContact CZ-CG1 3.68Å; R49-I53 HydrophobicContact CG-CD1 3.82Å; R49-I53 HydrophobicContact CG-CG1 4.48Å; R49-I53 WeakPolarHBondContact O-CB 3.11Å; R49-I53 WeakPolarHBondContact O-CD1 3.1Å; R49-I53 WeakPolarHBondContact O-CG1 3.48Å; R49-I53 PolarHBondContact O-N 2.64Å; V50-I53 PolarHBondContact O-N 3.46Å; I53-V55 PolarHBondContact O-N 3.09Å; I53-M56 PolarHBondContact O-N 2.94Å; I53-C57 WeakPolarHBondContact O-CB 3.49Å; I53-C57 PolarHBondContact O-N 3.37Å; I53-C57 PolarHBondContact O-SG 3.41Å |
| 54 | A | 76.8 | Confident | 70.9 | Confident | 45 Ų | 45 | 84.2 Ų | 84.2 | 37% | 0.372 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -61 | -44.5 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | V50 V51 C57 V58 | V50-A54 WeakPolarHBondContact O-CB 3.35Å; V50-A54 PolarHBondContact O-N 2.74Å; V51-A54 PolarHBondContact O-N 2.79Å; A54-C57 PolarHBondContact O-N 3.5Å; A54-V58 VanDerWaalsContact O-CB 3.24Å; A54-V58 WeakPolarHBondContact O-CB 3.42Å; A54-V58 WeakPolarHBondContact O-CG2 3.13Å; A54-V58 PolarHBondContact O-N 2.87Å |
| 55 | V | 82.4 | Confident | 72.5 | Confident | 74 Ų | 74 | 85.4 Ų | 85.4 | 45% | 0.448 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -66.3 | -47.4 | 177.8 | 173.7 | 0 | 0 | 0 | 0 | 110.7 | V51 I53 C57 V58 L59 | V51-V55 HydrophobicContact CG1-CG2 4.34Å; V51-V55 WeakPolarHBondContact O-CB 3.11Å; V51-V55 VanDerWaalsContact O-CG2 3.24Å; V51-V55 WeakPolarHBondContact O-CG2 3.24Å; V51-V55 PolarHBondContact O-N 2.64Å; I53-V55 PolarHBondContact O-N 3.09Å; V55-C57 VanDerWaalsContact C-N 3.34Å; V55-C57 PolarHBondContact O-N 3.22Å; V55-V58 PolarHBondContact O-N 3.34Å; V55-L59 HydrophobicContact CG1-CD1 3.75Å; V55-L59 HydrophobicContact CG1-CG 4.22Å; V55-L59 VanDerWaalsContact O-CB 3.31Å; V55-L59 WeakPolarHBondContact O-CB 3.14Å; V55-L59 WeakPolarHBondContact O-CG 3.02Å; V55-L59 PolarHBondContact O-N 2.88Å |
| 56 | M | 76.8 | Confident | 74.2 | Confident | 93 Ų | 93 | 81.4 Ų | 81.4 | 46% | 0.458 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.4 | -40.3 | 177.7 | -74.4 | -67.3 | 130.7 | 0 | 0 | 112.4 | F22 Q52 I53 L59 S60 | F22-M56 HydrophobicContact CE1-CG 4.04Å; F22-M56 HydrophobicContact CZ-CE 4.11Å; F22-M56 HydrophobicContact CZ-CG 4.3Å; Q52-M56 WeakPolarHBondContact O-CB 3.39Å; Q52-M56 WeakPolarHBondContact O-CG 3.46Å; Q52-M56 PolarHBondContact O-N 3.42Å; I53-M56 PolarHBondContact O-N 2.94Å; M56-L59 HydrophobicContact CE-CD1 4.08Å; M56-S60 WeakPolarHBondContact O-CB 3.14Å; M56-S60 PolarHBondContact O-N 3.22Å |
| 57 | C | 79.1 | Confident | 75.7 | Confident | 63 Ų | 63 | 83.1 Ų | 83.1 | 43% | 0.426 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -67.5 | -44.9 | 175.2 | -74.1 | 0 | 0 | 0 | 0 | 112 | I53 A54 V55 L59 S60 L61 | I53-C57 WeakPolarHBondContact O-CB 3.49Å; I53-C57 PolarHBondContact O-N 3.37Å; I53-C57 PolarHBondContact O-SG 3.41Å; A54-C57 PolarHBondContact O-N 3.5Å; V55-C57 VanDerWaalsContact C-N 3.34Å; V55-C57 PolarHBondContact O-N 3.22Å; C57-L59 VanDerWaalsContact C-N 3.32Å; C57-L59 PolarHBondContact O-N 2.73Å; C57-S60 PolarHBondContact O-N 2.89Å; C57-L61 VanDerWaalsContact O-CB 3.27Å; C57-L61 WeakPolarHBondContact O-CB 3.45Å; C57-L61 WeakPolarHBondContact O-CG 3.18Å; C57-L61 PolarHBondContact O-N 2.73Å |
| 58 | V | 84.4 | Confident | 76.7 | Confident | 86 Ų | 86 | 83.2 Ų | 83.2 | 52% | 0.521 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -63.4 | -41.2 | 177.9 | 169.7 | 0 | 0 | 0 | 0 | 110.5 | A54 V55 T62 | A54-V58 VanDerWaalsContact O-CB 3.24Å; A54-V58 WeakPolarHBondContact O-CB 3.42Å; A54-V58 WeakPolarHBondContact O-CG2 3.13Å; A54-V58 PolarHBondContact O-N 2.87Å; V55-V58 PolarHBondContact O-N 3.34Å; V58-T62 WeakPolarHBondContact O-CB 3.19Å; V58-T62 WeakPolarHBondContact O-CG2 3.04Å; V58-T62 PolarHBondContact O-N 3.23Å; V58-T62 PolarHBondContact O-OG1 3.35Å |
| 59 | L | 86.1 | Confident | 77.4 | Confident | 90 Ų | 90 | 82.7 Ų | 82.7 | 47% | 0.471 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63 | -46.5 | 174 | -69.6 | 173 | 0 | 0 | 0 | 111.5 | V55 M56 C57 T62 V63 | V55-L59 HydrophobicContact CG1-CD1 3.75Å; V55-L59 HydrophobicContact CG1-CG 4.22Å; V55-L59 VanDerWaalsContact O-CB 3.31Å; V55-L59 WeakPolarHBondContact O-CB 3.14Å; V55-L59 WeakPolarHBondContact O-CG 3.02Å; V55-L59 PolarHBondContact O-N 2.88Å; M56-L59 HydrophobicContact CE-CD1 4.08Å; C57-L59 VanDerWaalsContact C-N 3.32Å; C57-L59 PolarHBondContact O-N 2.73Å; L59-T62 WeakPolarHBondContact CA-OG1 3.48Å; L59-T62 PolarHBondContact O-N 3.29Å; L59-T62 PolarHBondContact O-OG1 3.33Å; L59-V63 WeakPolarHBondContact O-CB 3.27Å; L59-V63 WeakPolarHBondContact O-CG2 3.07Å; L59-V63 PolarHBondContact O-N 2.78Å |
| 60 | S | 73.6 | Confident | 78.2 | Confident | 70 Ų | 70 | 84.4 Ų | 84.4 | 49% | 0.49 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.4 | -45 | 177.5 | -176.8 | 0 | 0 | 0 | 0 | 112.1 | M56 C57 T62 V63 V64 | M56-S60 WeakPolarHBondContact O-CB 3.14Å; M56-S60 PolarHBondContact O-N 3.22Å; C57-S60 PolarHBondContact O-N 2.89Å; S60-T62 PolarHBondContact O-N 2.8Å; S60-V63 PolarHBondContact O-N 3.06Å; S60-V64 WeakPolarHBondContact O-CB 3.34Å; S60-V64 VanDerWaalsContact O-CG2 3.23Å; S60-V64 WeakPolarHBondContact O-CG2 3.23Å; S60-V64 PolarHBondContact O-N 3.29Å |
| 61 | L | 85.8 | Confident | 78.6 | Confident | 96 Ų | 96 | 81.8 Ų | 81.8 | 50% | 0.503 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.9 | -44.8 | 177.2 | -72.6 | 174.3 | 0 | 0 | 0 | 111.1 | C57 V64 F65 | C57-L61 VanDerWaalsContact O-CB 3.27Å; C57-L61 WeakPolarHBondContact O-CB 3.45Å; C57-L61 WeakPolarHBondContact O-CG 3.18Å; C57-L61 PolarHBondContact O-N 2.73Å; L61-V64 PolarHBondContact O-N 2.71Å; L61-F65 HydrophobicContact CB-CD2 4.28Å; L61-F65 HydrophobicContact CB-CE2 4.39Å; L61-F65 VanDerWaalsContact O-CB 3.27Å; L61-F65 WeakPolarHBondContact O-CB 3.45Å; L61-F65 WeakPolarHBondContact O-CD2 3.25Å; L61-F65 WeakPolarHBondContact O-CG 3.03Å; L61-F65 PolarHBondContact O-N 3.09Å |
| 62 | T | 85.8 | Confident | 78.3 | Confident | 82 Ų | 82 | 80.6 Ų | 80.6 | 50% | 0.503 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -66.4 | -37.5 | 178 | 45.1 | 0 | 0 | 0 | 0 | 112.8 | V58 L59 S60 G66 | V58-T62 WeakPolarHBondContact O-CB 3.19Å; V58-T62 WeakPolarHBondContact O-CG2 3.04Å; V58-T62 PolarHBondContact O-N 3.23Å; V58-T62 PolarHBondContact O-OG1 3.35Å; L59-T62 WeakPolarHBondContact CA-OG1 3.48Å; L59-T62 PolarHBondContact O-N 3.29Å; L59-T62 PolarHBondContact O-OG1 3.33Å; S60-T62 PolarHBondContact O-N 2.8Å; T62-G66 PolarHBondContact O-N 3.44Å |
| 63 | V | 87.3 | Confident | 78.9 | Confident | 88 Ų | 88 | 82.4 Ų | 82.4 | 53% | 0.533 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.9 | -48.4 | 173.1 | 170.6 | 0 | 0 | 0 | 0 | 110.6 | L59 S60 G66 I67 | L59-V63 WeakPolarHBondContact O-CB 3.27Å; L59-V63 WeakPolarHBondContact O-CG2 3.07Å; L59-V63 PolarHBondContact O-N 2.78Å; S60-V63 PolarHBondContact O-N 3.06Å; V63-G66 PolarHBondContact O-N 3.49Å; V63-I67 HydrophobicContact CG1-CD1 3.73Å; V63-I67 HydrophobicContact CG1-CG1 4.5Å; V63-I67 VanDerWaalsContact O-CG1 3.25Å; V63-I67 WeakPolarHBondContact O-CG1 3.28Å; V63-I67 PolarHBondContact O-N 3.35Å |
| 64 | V | 82.8 | Confident | 78.5 | Confident | 61 Ų | 61 | 84.3 Ų | 84.3 | 37% | 0.37 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -61.6 | -45.4 | 177.4 | 170.2 | 0 | 0 | 0 | 0 | 110.6 | S60 L61 G66 I67 F68 | S60-V64 WeakPolarHBondContact O-CB 3.34Å; S60-V64 VanDerWaalsContact O-CG2 3.23Å; S60-V64 WeakPolarHBondContact O-CG2 3.23Å; S60-V64 PolarHBondContact O-N 3.29Å; L61-V64 PolarHBondContact O-N 2.71Å; V64-G66 PolarHBondContact O-N 2.69Å; V64-I67 CarbonylContact O-C 3.59Å; V64-I67 PolarHBondContact O-N 3.43Å; V64-F68 HydrophobicContact CG1-CD2 3.38Å; V64-F68 HydrophobicContact CG1-CE2 3.29Å; V64-F68 WeakPolarHBondContact O-CB 3.27Å; V64-F68 WeakPolarHBondContact O-CD2 3.21Å; V64-F68 PolarHBondContact O-N 2.79Å |
| 65 | F | 81.4 | Confident | 77.7 | Confident | 119 Ų | 119 | 87.1 Ų | 87.1 | 52% | 0.522 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.5 | -40.8 | 173.9 | -83.1 | -63.3 | 0 | 0 | 0 | 112.2 | L61 F68 F69 | L61-F65 HydrophobicContact CB-CD2 4.28Å; L61-F65 HydrophobicContact CB-CE2 4.39Å; L61-F65 VanDerWaalsContact O-CB 3.27Å; L61-F65 WeakPolarHBondContact O-CB 3.45Å; L61-F65 WeakPolarHBondContact O-CD2 3.25Å; L61-F65 WeakPolarHBondContact O-CG 3.03Å; L61-F65 PolarHBondContact O-N 3.09Å; F65-F68 CarbonylContact O-C 3.5Å; F65-F68 PolarHBondContact O-N 3.47Å; F65-F69 HydrophobicContact CB-CD2 4.45Å; F65-F69 HydrophobicContact CB-CE2 4.42Å; F65-F69 HydrophobicContact CD1-CE2 4.35Å; F65-F69 WeakPolarHBondContact O-CD2 3.34Å; F65-F69 PolarHBondContact O-N 2.88Å |
| 66 | G | 84.1 | Confident | 77 | Confident | 40 Ų | 40 | 89.3 Ų | 89.3 | 41% | 0.412 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | T62 V63 V64 F68 F69 L70 | T62-G66 PolarHBondContact O-N 3.44Å; V63-G66 PolarHBondContact O-N 3.49Å; V64-G66 PolarHBondContact O-N 2.69Å; G66-F68 VanDerWaalsContact C-N 3.35Å; G66-F69 PolarHBondContact O-N 3.42Å; G66-L70 VanDerWaalsContact O-CB 3.28Å; G66-L70 WeakPolarHBondContact O-CB 3.36Å; G66-L70 PolarHBondContact O-N 2.98Å |
| 67 | I | 82.6 | Confident | 76.3 | Confident | 110 Ų | 110 | 93 Ų | 93 | 56% | 0.564 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -70 | -32.8 | 173.6 | -62.6 | 164.5 | 0 | 0 | 0 | 110.8 | V63 V64 G71 | V63-I67 HydrophobicContact CG1-CD1 3.73Å; V63-I67 HydrophobicContact CG1-CG1 4.5Å; V63-I67 VanDerWaalsContact O-CG1 3.25Å; V63-I67 WeakPolarHBondContact O-CG1 3.28Å; V63-I67 PolarHBondContact O-N 3.35Å; V64-I67 CarbonylContact O-C 3.59Å; V64-I67 PolarHBondContact O-N 3.43Å; I67-G71 WeakPolarHBondContact O-CA 3.37Å; I67-G71 PolarHBondContact O-N 2.96Å |
| 68 | F | 76.7 | Confident | 75.1 | Confident | 125 Ų | 125 | 92.1 Ų | 92.1 | 55% | 0.548 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -74 | -33.8 | 173 | -87.3 | -65.2 | 0 | 0 | 0 | 112.2 | V64 F65 G66 C72 | V64-F68 HydrophobicContact CG1-CD2 3.38Å; V64-F68 HydrophobicContact CG1-CE2 3.29Å; V64-F68 WeakPolarHBondContact O-CB 3.27Å; V64-F68 WeakPolarHBondContact O-CD2 3.21Å; V64-F68 PolarHBondContact O-N 2.79Å; F65-F68 CarbonylContact O-C 3.5Å; F65-F68 PolarHBondContact O-N 3.47Å; G66-F68 VanDerWaalsContact C-N 3.35Å; F68-C72 WeakPolarHBondContact O-CA 3.09Å; F68-C72 WeakPolarHBondContact O-CB 3.4Å; F68-C72 PolarHBondContact O-N 3.33Å; F68-C72 PolarHBondContact O-SG 2.87Å |
| 69 | F | 71.8 | Confident | 73.7 | Confident | 134 Ų | 134 | 93.8 Ų | 93.8 | 59% | 0.588 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -72 | -43.5 | 173.8 | -81.6 | -68 | 0 | 0 | 0 | 110.1 | F65 G66 G71 N73 | F65-F69 HydrophobicContact CB-CD2 4.45Å; F65-F69 HydrophobicContact CB-CE2 4.42Å; F65-F69 HydrophobicContact CD1-CE2 4.35Å; F65-F69 WeakPolarHBondContact O-CD2 3.34Å; F65-F69 PolarHBondContact O-N 2.88Å; G66-F69 PolarHBondContact O-N 3.42Å; F69-G71 VanDerWaalsContact C-N 3.33Å; F69-N73 WeakPolarHBondContact O-CB 3.43Å; F69-N73 PolarHBondContact O-N 3.41Å; F69-N73 PolarHBondContact O-ND2 2.9Å |
| 70 | L | 76.5 | Confident | 72.2 | Confident | 111 Ų | 111 | 92.8 Ų | 92.8 | 58% | 0.581 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.2 | -43.4 | 173.2 | -173.4 | 58.5 | 0 | 0 | 0 | 110.5 | G66 N73 L74 | G66-L70 VanDerWaalsContact O-CB 3.28Å; G66-L70 WeakPolarHBondContact O-CB 3.36Å; G66-L70 PolarHBondContact O-N 2.98Å; L70-N73 PolarHBondContact O-N 3.29Å; L70-L74 HydrophobicContact CD1-CD1 4.14Å; L70-L74 HydrophobicContact CD1-CG 4.36Å; L70-L74 HydrophobicContact CG-CD1 3.92Å; L70-L74 WeakPolarHBondContact O-CB 3.47Å; L70-L74 WeakPolarHBondContact O-CD1 3.36Å; L70-L74 WeakPolarHBondContact O-CG 3.31Å; L70-L74 PolarHBondContact O-N 2.85Å |
| 71 | G | 71.4 | Confident | 71.1 | Confident | 22 Ų | 22 | 95.5 Ų | 95.5 | 23% | 0.227 | 52% | 0.521 | C | S | . | . | H | α-helix | trans | -63.5 | -51.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | I67 F69 L74 L75 | I67-G71 WeakPolarHBondContact O-CA 3.37Å; I67-G71 PolarHBondContact O-N 2.96Å; F69-G71 VanDerWaalsContact C-N 3.33Å; G71-L74 CarbonylContact O-C 3.45Å; G71-L74 WeakPolarHBondContact O-CA 3.41Å; G71-L74 PolarHBondContact O-N 2.86Å; G71-L74 VanDerWaalsContact O-N 3.16Å; G71-L75 WeakPolarHBondContact O-CA 3.15Å; G71-L75 VanDerWaalsContact O-CB 3.24Å; G71-L75 WeakPolarHBondContact O-CB 3.48Å; G71-L75 WeakPolarHBondContact O-CG 3.15Å; G71-L75 PolarHBondContact O-N 2.91Å |
| 72 | C | 70.4 | Confident | 69.5 | Low | 66 Ų | 66 | 96.2 Ų | 96.2 | 45% | 0.446 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -67.2 | -35.3 | 175.6 | -66.7 | 0 | 0 | 0 | 0 | 112.5 | F68 L74 L75 I76 | F68-C72 WeakPolarHBondContact O-CA 3.09Å; F68-C72 WeakPolarHBondContact O-CB 3.4Å; F68-C72 PolarHBondContact O-N 3.33Å; F68-C72 PolarHBondContact O-SG 2.87Å; C72-L74 VanDerWaalsContact C-N 3.3Å; C72-L75 PolarHBondContact O-N 3.48Å; C72-I76 VanDerWaalsContact O-CB 3.29Å; C72-I76 WeakPolarHBondContact O-CB 3.09Å; C72-I76 WeakPolarHBondContact O-CG2 3.24Å; C72-I76 PolarHBondContact O-N 3.42Å |
| 73 | N | 68.3 | Low | 67.8 | Low | 100 Ų | 100 | 97.5 Ų | 97.5 | 54% | 0.535 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -68.6 | -30.8 | 171 | -82.3 | -77.7 | 0 | 0 | 0 | 111.8 | F69 L70 I76 K77 | F69-N73 WeakPolarHBondContact O-CB 3.43Å; F69-N73 PolarHBondContact O-N 3.41Å; F69-N73 PolarHBondContact O-ND2 2.9Å; L70-N73 PolarHBondContact O-N 3.29Å; N73-I76 WeakPolarHBondContact O-CG2 3.36Å; N73-K77 WeakPolarHBondContact O-CB 3.22Å; N73-K77 PolarHBondContact O-N 3.49Å |
| 74 | L | 64.1 | Low | 65.5 | Low | 96 Ų | 96 | 99.6 Ų | 99.6 | 50% | 0.503 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -80.3 | -29.2 | 172.4 | -69.8 | 171.7 | 0 | 0 | 0 | 111.9 | L70 G71 C72 K77 S78 | L70-L74 HydrophobicContact CD1-CD1 4.14Å; L70-L74 HydrophobicContact CD1-CG 4.36Å; L70-L74 HydrophobicContact CG-CD1 3.92Å; L70-L74 WeakPolarHBondContact O-CB 3.47Å; L70-L74 WeakPolarHBondContact O-CD1 3.36Å; L70-L74 WeakPolarHBondContact O-CG 3.31Å; L70-L74 PolarHBondContact O-N 2.85Å; G71-L74 CarbonylContact O-C 3.45Å; G71-L74 WeakPolarHBondContact O-CA 3.41Å; G71-L74 PolarHBondContact O-N 2.86Å; G71-L74 VanDerWaalsContact O-N 3.16Å; C72-L74 VanDerWaalsContact C-N 3.3Å; L74-K77 CarbonylContact O-C 3.39Å; L74-S78 WeakPolarHBondContact O-CA 3.4Å; L74-S78 WeakPolarHBondContact O-CB 3.19Å; L74-S78 PolarHBondContact O-N 3.5Å; L74-S78 PolarHBondContact O-OG 3.14Å |
| 75 | L | 60.9 | Low | 63.8 | Low | 104 Ų | 104 | 102.2 Ų | 102.2 | 55% | 0.545 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -77.5 | -41.3 | 176.9 | -71.9 | 169.2 | 0 | 0 | 0 | 110.3 | G71 C72 K77 S78 E79 | G71-L75 WeakPolarHBondContact O-CA 3.15Å; G71-L75 VanDerWaalsContact O-CB 3.24Å; G71-L75 WeakPolarHBondContact O-CB 3.48Å; G71-L75 WeakPolarHBondContact O-CG 3.15Å; G71-L75 PolarHBondContact O-N 2.91Å; C72-L75 PolarHBondContact O-N 3.48Å; L75-K77 PolarHBondContact O-N 3.36Å; L75-S78 VanDerWaalsContact CA-OG 3.29Å; L75-S78 WeakPolarHBondContact CA-OG 3.27Å; L75-S78 CarbonylContact O-C 3.53Å; L75-S78 PolarHBondContact O-N 2.77Å; L75-S78 PolarHBondContact O-OG 3.35Å; L75-E79 WeakPolarHBondContact O-CA 3.24Å; L75-E79 VanDerWaalsContact O-CB 3.25Å; L75-E79 WeakPolarHBondContact O-CB 3.44Å; L75-E79 PolarHBondContact O-N 2.74Å |
| 76 | I | 66.3 | Low | 62 | Low | 119 Ų | 119 | 101.9 Ų | 101.9 | 61% | 0.61 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.5 | -30.4 | 171.2 | -151.8 | 76 | 0 | 0 | 0 | 111 | C72 N73 | C72-I76 VanDerWaalsContact O-CB 3.29Å; C72-I76 WeakPolarHBondContact O-CB 3.09Å; C72-I76 WeakPolarHBondContact O-CG2 3.24Å; C72-I76 PolarHBondContact O-N 3.42Å; N73-I76 WeakPolarHBondContact O-CG2 3.36Å |
| 77 | K | 63.6 | Low | 60 | Low | 171 Ų | 171 | 103.3 Ų | 103.3 | 74% | 0.743 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -81 | -23.2 | 173.4 | -170.1 | 172.9 | 173.5 | 87.6 | 0 | 113.1 | N73 L74 L75 | N73-K77 WeakPolarHBondContact O-CB 3.22Å; N73-K77 PolarHBondContact O-N 3.49Å; L74-K77 CarbonylContact O-C 3.39Å; L75-K77 PolarHBondContact O-N 3.36Å |
| 78 | S | 54.1 | Low | 58.1 | Low | 44 Ų | 44 | 102.5 Ų | 102.5 | 31% | 0.308 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -101.3 | -8 | 176.8 | 60.7 | 0 | 0 | 0 | 0 | 114.2 | L74 L75 G80 M81 I82 | L74-S78 WeakPolarHBondContact O-CA 3.4Å; L74-S78 WeakPolarHBondContact O-CB 3.19Å; L74-S78 PolarHBondContact O-N 3.5Å; L74-S78 PolarHBondContact O-OG 3.14Å; L75-S78 VanDerWaalsContact CA-OG 3.29Å; L75-S78 WeakPolarHBondContact CA-OG 3.27Å; L75-S78 CarbonylContact O-C 3.53Å; L75-S78 PolarHBondContact O-N 2.77Å; L75-S78 PolarHBondContact O-OG 3.35Å; S78-G80 PolarHBondContact O-N 3.46Å; S78-M81 WeakPolarHBondContact O-CA 3.14Å; S78-M81 PolarHBondContact O-N 2.89Å; S78-I82 PolarHBondContact O-N 3.07Å |
| 79 | E | 53.7 | Low | 56.7 | Low | 122 Ų | 122 | 107.6 Ų | 107.6 | 57% | 0.57 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -60.6 | -26.1 | 164.9 | -168 | 173.8 | 119.6 | 0 | 0 | 110.3 | L75 M81 | L75-E79 WeakPolarHBondContact O-CA 3.24Å; L75-E79 VanDerWaalsContact O-CB 3.25Å; L75-E79 WeakPolarHBondContact O-CB 3.44Å; L75-E79 PolarHBondContact O-N 2.74Å; E79-M81 VanDerWaalsContact C-N 3.26Å; E79-M81 PolarHBondContact O-N 3.36Å |
| 80 | G | 55.9 | Low | 55.8 | Low | 68 Ų | 68 | 110.8 Ų | 110.8 | 70% | 0.701 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -71 | -8 | 167.6 | 0 | 0 | 0 | 0 | 0 | 115.7 | S78 | S78-G80 PolarHBondContact O-N 3.46Å |
| 81 | M | 49 | Very low | 54 | Low | 128 Ų | 128 | 109.4 Ų | 109.4 | 63% | 0.631 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -123.8 | -18.8 | -179.1 | -137.3 | -179 | 88.8 | 0 | 0 | 114.7 | S78 E79 L85 | S78-M81 WeakPolarHBondContact O-CA 3.14Å; S78-M81 PolarHBondContact O-N 2.89Å; E79-M81 VanDerWaalsContact C-N 3.26Å; E79-M81 PolarHBondContact O-N 3.36Å; M81-L85 PolarHBondContact O-N 2.62Å |
| 82 | I | 53.8 | Low | 52.7 | Low | 110 Ų | 110 | 111.9 Ų | 111.9 | 56% | 0.564 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -88.9 | -22.6 | 170.3 | 61.1 | 168 | 0 | 0 | 0 | 113.8 | S78 F84 L85 V86 | S78-I82 PolarHBondContact O-N 3.07Å; I82-F84 PolarHBondContact O-N 2.86Å; I82-L85 PolarHBondContact O-N 3.02Å; I82-V86 PolarHBondContact O-N 2.95Å |
| 83 | N | 49.3 | Very low | 51.6 | Low | 110 Ų | 110 | 116.3 Ų | 116.3 | 59% | 0.588 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -70.2 | -16.3 | 165.2 | -170.5 | 46.7 | 0 | 0 | 0 | 112.3 | T87 | N83-T87 PolarHBondContact O-OG1 3.19Å |
| 84 | F | 38.8 | Very low | 50.1 | Low | 132 Ų | 132 | 118.6 Ų | 118.6 | 58% | 0.579 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -81.7 | -36.5 | 172.3 | -168.5 | -104.4 | 0 | 0 | 0 | 111.6 | I82 T87 D88 | I82-F84 PolarHBondContact O-N 2.86Å; F84-T87 PolarHBondContact O-N 2.83Å; F84-D88 PolarHBondContact O-N 3.23Å; F84-D88 VanDerWaalsContact O-N 3.07Å |
| 85 | L | 46.7 | Very low | 49 | Very low | 115 Ų | 115 | 119.2 Ų | 119.2 | 60% | 0.602 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -83.2 | -20.1 | 177.7 | -90.6 | 155.1 | 0 | 0 | 0 | 115.2 | M81 I82 T87 D88 | M81-L85 PolarHBondContact O-N 2.62Å; I82-L85 PolarHBondContact O-N 3.02Å; L85-T87 VanDerWaalsContact C-N 3.27Å; L85-D88 HydrophobicContact CD2-CB 4.47Å |
| 86 | V | 43.1 | Very low | 48.4 | Very low | 112 Ų | 112 | 123.6 Ų | 123.6 | 68% | 0.679 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | -19.4 | 166.8 | 96 | 0 | 0 | 0 | 0 | 112 | I82 | I82-V86 PolarHBondContact O-N 2.95Š|
| 87 | T | 43.6 | Very low | 47.1 | Very low | 70 Ų | 70 | 122.9 Ų | 122.9 | 43% | 0.429 | 63% | 0.628 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.7 | -19.5 | 172.9 | -68.8 | 0 | 0 | 0 | 0 | 112.7 | N83 F84 L85 R89 R90 P91 | N83-T87 PolarHBondContact O-OG1 3.19Å; F84-T87 PolarHBondContact O-N 2.83Å; L85-T87 VanDerWaalsContact C-N 3.27Å; T87-R89 PolarHBondContact O-N 2.75Å; T87-R90 PolarHBondContact O-N 3.33Å; T87-P91 HydrophobicContact CG2-CG 3.96Å; T87-P91 WeakPolarHBondContact O-CD 3.23Å |
| 88 | D | 42.6 | Very low | 46 | Very low | 93 Ų | 93 | 120.3 Ų | 120.3 | 50% | 0.497 | 63% | 0.626 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.3 | 10.9 | -178.6 | -123 | -40.9 | 0 | 0 | 0 | 114.5 | F84 L85 R90 | F84-D88 PolarHBondContact O-N 3.23Å; F84-D88 VanDerWaalsContact O-N 3.07Å; L85-D88 HydrophobicContact CD2-CB 4.47Å; D88-R90 VanDerWaalsContact C-N 3.27Å |
| 89 | R | 46.8 | Very low | 45.9 | Very low | 232 Ų | 232 | 126 Ų | 126 | 88% | 0.875 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -15.2 | 166.4 | -128.1 | -87.3 | 176.1 | 92.7 | -2.4 | 112.4 | T87 | T87-R89 PolarHBondContact O-N 2.75Š|
| 90 | R | 53.1 | Low | 45.5 | Very low | 201 Ų | 201 | 126 Ų | 126 | 76% | 0.758 | 66% | 0.659 | S | S | * | * | trans | 166.3 | 113.4 | 160.4 | -111.4 | -104.3 | -156.8 | 161.7 | 1.8 | 110.8 | T87 D88 S92 | T87-R90 PolarHBondContact O-N 3.33Å; D88-R90 VanDerWaalsContact C-N 3.27Å; R90-S92 PolarHBondContact NH1-OG 3.15Å | ||
| 91 | P | 37.8 | Very low | 44.6 | Very low | 82 Ų | 82 | 125 Ų | 125 | 53% | 0.532 | 65% | 0.648 | S | S | . | * | trans | -127.5 | 74.7 | 141 | 33.9 | -17.6 | 0 | 0 | 0 | 107.6 | T87 K93 | T87-P91 HydrophobicContact CG2-CG 3.96Å; T87-P91 WeakPolarHBondContact O-CD 3.23Å; P91-K93 PolarHBondContact O-N 3.44Å | ||
| 92 | S | 45.6 | Very low | 44.1 | Very low | 75 Ų | 75 | 124 Ų | 124 | 52% | 0.524 | 66% | 0.661 | S | S | . | * | trans | -62.4 | 122.7 | 153.7 | 158.4 | 0 | 0 | 0 | 0 | 106.8 | R90 | R90-S92 PolarHBondContact NH1-OG 3.15Š| ||
| 93 | K | 46.8 | Very low | 43.3 | Very low | 158 Ų | 158 | 131.7 Ų | 131.7 | 69% | 0.687 | 69% | 0.685 | S | S | * | * | trans | 68.5 | 130 | 179.7 | -101.7 | 179.9 | 63.1 | 168.8 | 0 | 111.9 | P91 | P91-K93 PolarHBondContact O-N 3.44Š| ||
| 94 | E | 36.3 | Very low | 43 | Very low | 148 Ų | 148 | 132.8 Ų | 132.8 | 69% | 0.692 | 69% | 0.69 | S | S | * | * | cis | -177.9 | 144.7 | 36.7 | 46.2 | -145.8 | 151.8 | 0 | 0 | 110.2 | ||||
| 95 | V | 41 | Very low | 43.2 | Very low | 110 Ų | 110 | 132.8 Ų | 132.8 | 67% | 0.667 | 70% | 0.696 | S | S | * | * | trans | 77.9 | 89.8 | 140.6 | 170.3 | 0 | 0 | 0 | 0 | 118.4 | T97 | V95-T97 HydrophobicContact CG1-CG2 3.85Å; V95-T97 WeakPolarHBondContact CG1-OG1 3.44Å; V95-T97 PolarHBondContact O-N 3.5Å | ||
| 96 | E | 47.7 | Very low | 43.1 | Very low | 196 Ų | 196 | 133.8 Ų | 133.8 | 92% | 0.916 | 70% | 0.701 | S | S | * | * | -43.5 | 107.8 | 128.9 | 176.2 | -166.3 | 148.6 | 0 | 0 | 110.5 | |||||
| 97 | T | 40.4 | Very low | 43.1 | Very low | 104 Ų | 104 | 135.1 Ų | 135.1 | 64% | 0.638 | 70% | 0.702 | S | S | * | * | trans | -158.5 | 122.1 | 153.5 | 46.9 | 0 | 0 | 0 | 0 | 111.7 | V95 | V95-T97 HydrophobicContact CG1-CG2 3.85Å; V95-T97 WeakPolarHBondContact CG1-OG1 3.44Å; V95-T97 PolarHBondContact O-N 3.5Å | ||
| 98 | V | 39 | Very low | 43 | Very low | 116 Ų | 116 | 139.2 Ų | 139.2 | 70% | 0.703 | 72% | 0.719 | S | S | * | * | 74 | 92 | 128.9 | 179.4 | 0 | 0 | 0 | 0 | 113.9 | V100 | V98-V100 HydrophobicContact CG1-CB 4.47Š| |||
| 99 | I | 53.3 | Low | 43 | Very low | 164 Ų | 164 | 142.3 Ų | 142.3 | 84% | 0.841 | 73% | 0.734 | S | S | * | * | 21.4 | 94.2 | 89.2 | -53 | 173.7 | 0 | 0 | 0 | 111.6 | |||||
| 100 | V | 44.3 | Very low | 42.8 | Very low | 122 Ų | 122 | 135.9 Ų | 135.9 | 74% | 0.739 | 72% | 0.724 | S | S | * | * | trans | 173.4 | 131.7 | 143.8 | 151.4 | 0 | 0 | 0 | 0 | 107.5 | V98 | V98-V100 HydrophobicContact CG1-CB 4.47Š| ||
| 101 | G | 36.9 | Very low | 42 | Very low | 46 Ų | 46 | 130.8 Ų | 130.8 | 47% | 0.474 | 72% | 0.721 | S | S | . | * | trans | 141.2 | 40.4 | 160.1 | 0 | 0 | 0 | 0 | 0 | 116.5 | Y103 | G101-Y103 PolarHBondContact O-N 3.49Š| ||
| 102 | A | 39.8 | Very low | 42.3 | Very low | 109 Ų | 109 | 134.9 Ų | 134.9 | 90% | 0.901 | 74% | 0.737 | S | S | * | * | trans | -72.2 | 107 | 147.2 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 103 | Y | 36.9 | Very low | 42 | Very low | 271 Ų | 271 | 140.4 Ų | 140.4 | 100% | 1.063 | 76% | 0.756 | S | S | * | * | trans | -147.2 | 0 | 154.9 | 20.6 | -100.7 | 0 | 0 | 0 | 108.3 | G101 | G101-Y103 PolarHBondContact O-N 3.49Š|
Retrieved 103 of 103 residues in 65.5 ms
(Link to these results)