| 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 | 43.8 | Very low | 52.7 | Low | 235 Ų | 235 | 162.2 Ų | 162.2 | 100% | 1.158 | 81% | 0.806 | S | S | * | * | 0 | 104.8 | 0 | -73.8 | -71.6 | -175.4 | 0 | 0 | 106.1 | |||||
| 2 | Y | 47.9 | Very low | 52.5 | Low | 233 Ų | 233 | 158.3 Ų | 158.3 | 91% | 0.914 | 79% | 0.79 | S | S | * | * | trans | -87.4 | 120.4 | 179.8 | -72.5 | -87 | 0 | 0 | 0 | 108 | I4 | Y2-I4 PolarHBondContact O-N 3.32Š| ||
| 3 | E | 51.4 | Low | 52.1 | Low | 195 Ų | 195 | 154.9 Ų | 154.9 | 91% | 0.911 | 78% | 0.776 | S | S | * | * | trans | -78.2 | 115 | 174.3 | -62.7 | -153.1 | 127.6 | 0 | 0 | 109.3 | ||||
| 4 | I | 57.2 | Low | 52 | Low | 133 Ų | 133 | 157.5 Ų | 157.5 | 68% | 0.682 | 77% | 0.774 | S | S | * | * | trans | -85.2 | 114.1 | 171.3 | -61.4 | -178.7 | 0 | 0 | 0 | 107 | Y2 H6 | Y2-I4 PolarHBondContact O-N 3.32Å; I4-H6 PolarHBondContact O-CD2 3.32Å; I4-H6 VanDerWaalsContact O-CD2 3.32Å; I4-H6 PolarHBondContact O-N 3.25Å | ||
| 5 | Q | 54.3 | Low | 52 | Low | 194 Ų | 194 | 154.9 Ų | 154.9 | 91% | 0.907 | 77% | 0.765 | S | S | * | * | trans | -77.7 | 103.9 | 176.5 | -156.6 | 169.1 | 9.6 | 0 | 0 | 108.6 | ||||
| 6 | H | 51.7 | Low | 52.1 | Low | 151 Ų | 151 | 151.3 Ų | 151.3 | 70% | 0.699 | 75% | 0.754 | S | S | * | * | trans | -80 | 135.3 | 175.2 | -70.9 | -94.4 | 0 | 0 | 0 | 110.4 | I4 V8 | I4-H6 PolarHBondContact O-CD2 3.32Å; I4-H6 VanDerWaalsContact O-CD2 3.32Å; I4-H6 PolarHBondContact O-N 3.25Å; H6-V8 PolarHBondContact O-N 3.15Å | ||
| 7 | P | 61 | Low | 52.1 | Low | 111 Ų | 111 | 147.7 Ų | 147.7 | 72% | 0.721 | 74% | 0.742 | S | S | * | * | trans | -68.3 | 130.2 | 176.3 | 27.4 | -32.5 | 0 | 0 | 0 | 110.4 | I9 | P7-I9 PolarHBondContact O-N 3.41Š| ||
| 8 | V | 55.5 | Low | 52 | Low | 127 Ų | 127 | 146.1 Ų | 146.1 | 77% | 0.77 | 74% | 0.736 | S | S | * | * | trans | -63.8 | 105.6 | 174.2 | 173.7 | 0 | 0 | 0 | 0 | 108.8 | H6 I10 | H6-V8 PolarHBondContact O-N 3.15Å; V8-I10 HydrophobicContact CG1-CG1 3.91Å; V8-I10 PolarHBondContact O-N 2.96Å; V8-I10 VanDerWaalsContact O-N 3.16Å | ||
| 9 | I | 55.2 | Low | 52.2 | Low | 156 Ų | 156 | 145.4 Ų | 145.4 | 80% | 0.8 | 73% | 0.733 | S | S | * | * | trans | -74.6 | 99.1 | 167.9 | -58.6 | 176.9 | 0 | 0 | 0 | 106.7 | P7 N11 | P7-I9 PolarHBondContact O-N 3.41Å; I9-N11 PolarHBondContact O-N 3.18Å | ||
| 10 | I | 53.5 | Low | 52.6 | Low | 137 Ų | 137 | 144.8 Ų | 144.8 | 70% | 0.703 | 73% | 0.731 | S | S | * | * | trans | -72.3 | 106.8 | 171.6 | -57.3 | 177.8 | 0 | 0 | 0 | 107.3 | V8 N12 | V8-I10 HydrophobicContact CG1-CG1 3.91Å; V8-I10 PolarHBondContact O-N 2.96Å; V8-I10 VanDerWaalsContact O-N 3.16Å; I10-N12 PolarHBondContact O-N 2.98Å; I10-N12 VanDerWaalsContact O-N 3.15Å | ||
| 11 | N | 48.9 | Very low | 52.5 | Low | 112 Ų | 112 | 143.2 Ų | 143.2 | 60% | 0.599 | 72% | 0.721 | S | S | * | * | trans | -65.3 | 102.6 | 173.8 | 177.3 | 11.9 | 0 | 0 | 0 | 110.1 | I9 N13 | I9-N11 PolarHBondContact O-N 3.18Å; N11-N13 PolarHBondContact O-N 3.23Å; N11-N13 WeakPolarHBondContact OD1-CB 3.43Å; N11-N13 PolarHBondContact OD1-N 3.16Å | ||
| 12 | N | 49.3 | Very low | 53 | Low | 116 Ų | 116 | 136.6 Ų | 136.6 | 62% | 0.62 | 70% | 0.696 | S | S | * | * | trans | -80.1 | 49.1 | 178.6 | -122.4 | 37.4 | 0 | 0 | 0 | 112.2 | I10 Y14 | I10-N12 PolarHBondContact O-N 2.98Å; I10-N12 VanDerWaalsContact O-N 3.15Å; N12-Y14 PolarHBondContact O-N 3.43Å; N12-Y14 VanDerWaalsContact O-N 3.16Å | ||
| 13 | N | 48.5 | Very low | 53.4 | Low | 114 Ų | 114 | 133.5 Ų | 133.5 | 61% | 0.61 | 69% | 0.69 | S | S | * | * | G | 310 helix | trans | -73.2 | 4 | 176.6 | -116.5 | 18.4 | 0 | 0 | 0 | 113.7 | N11 N15 | N11-N13 PolarHBondContact O-N 3.23Å; N11-N13 WeakPolarHBondContact OD1-CB 3.43Å; N11-N13 PolarHBondContact OD1-N 3.16Å; N13-N15 VanDerWaalsContact C-N 3.3Å |
| 14 | Y | 50.5 | Low | 53.5 | Low | 191 Ų | 191 | 131.2 Ų | 131.2 | 75% | 0.749 | 68% | 0.683 | S | S | * | * | G | 310 helix | trans | -76.7 | -12.5 | 173.7 | -81.6 | -86.1 | 0 | 0 | 0 | 113.5 | N12 V16 | N12-Y14 PolarHBondContact O-N 3.43Å; N12-Y14 VanDerWaalsContact O-N 3.16Å; Y14-V16 PolarHBondContact O-N 3.27Å |
| 15 | N | 52.3 | Low | 53.4 | Low | 119 Ų | 119 | 130.5 Ų | 130.5 | 64% | 0.636 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -73.6 | -5.3 | 179.3 | -105.3 | 17 | 0 | 0 | 0 | 115.2 | N13 | N13-N15 VanDerWaalsContact C-N 3.3Š|
| 16 | V | 53.5 | Low | 53.1 | Low | 96 Ų | 96 | 130.2 Ų | 130.2 | 58% | 0.582 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -102.6 | -23 | -177.7 | -176.3 | 0 | 0 | 0 | 0 | 112.3 | Y14 | Y14-V16 PolarHBondContact O-N 3.27Š|
| 17 | V | 51.1 | Low | 53.2 | Low | 91 Ų | 91 | 129.9 Ų | 129.9 | 55% | 0.552 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.6 | -28.4 | -178.3 | -179.6 | 0 | 0 | 0 | 0 | 111.8 | I19 L20 | V17-I19 PolarHBondContact O-N 3.05Å; V17-L20 PolarHBondContact O-N 3.45Å |
| 18 | D | 51.3 | Low | 53 | Low | 118 Ų | 118 | 132.5 Ų | 132.5 | 63% | 0.631 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -1.7 | 178.4 | -101.8 | -15.5 | 0 | 0 | 0 | 114.8 | ||
| 19 | I | 54.9 | Low | 53 | Low | 133 Ų | 133 | 128.3 Ų | 128.3 | 68% | 0.682 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | -19.3 | 173.9 | -55 | 172.5 | 0 | 0 | 0 | 110.9 | V17 | V17-I19 PolarHBondContact O-N 3.05Š|
| 20 | L | 59.6 | Low | 53.3 | Low | 134 Ų | 134 | 125.8 Ų | 125.8 | 70% | 0.702 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -91.7 | -8.1 | -176.8 | -90.9 | 94.4 | 0 | 0 | 0 | 114.8 | V17 | V17-L20 PolarHBondContact O-N 3.45Š|
| 21 | H | 51.5 | Low | 53.6 | Low | 112 Ų | 112 | 120.5 Ų | 120.5 | 52% | 0.519 | 63% | 0.634 | S | S | . | * | trans | -125.8 | 83.4 | -179 | -61.1 | 128.2 | 0 | 0 | 0 | 110.9 | E23 | H21-E23 PolarHBondContact O-N 3.16Š| ||
| 22 | P | 55.2 | Low | 54 | Low | 96 Ų | 96 | 118 Ų | 118 | 62% | 0.623 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | 6.4 | -174.2 | 28.9 | -34.8 | 0 | 0 | 0 | 114.9 | ||
| 23 | E | 55.3 | Low | 54.4 | Low | 168 Ų | 168 | 115 Ų | 115 | 79% | 0.785 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | -8 | -161.8 | -39.6 | -163 | -165.3 | 0 | 0 | 112.7 | H21 | H21-E23 PolarHBondContact O-N 3.16Š|
| 24 | N | 52.6 | Low | 54.9 | Low | 146 Ų | 146 | 118.2 Ų | 118.2 | 78% | 0.781 | 62% | 0.624 | S | S | * | * | S | Bend | trans | -123.8 | 20 | -175.6 | -64.5 | -35.7 | 0 | 0 | 0 | 113.8 | E26 | N24-E26 PolarHBondContact O-N 3.46Š|
| 25 | I | 55.2 | Low | 55.4 | Low | 119 Ų | 119 | 115.5 Ų | 115.5 | 61% | 0.61 | 62% | 0.617 | S | S | * | * | trans | -95.8 | 94.8 | -178 | -28.8 | 174.6 | 0 | 0 | 0 | 109.1 | F27 | I25-F27 PolarHBondContact O-N 2.9Å; I25-F27 VanDerWaalsContact O-N 3.12Å | ||
| 26 | E | 49 | Very low | 55.9 | Low | 187 Ų | 187 | 116.7 Ų | 116.7 | 87% | 0.874 | 62% | 0.62 | S | S | * | * | trans | -51.7 | 119.1 | 159.9 | -86.9 | -178.9 | 144.4 | 0 | 0 | 108.5 | N24 D28 | N24-E26 PolarHBondContact O-N 3.46Å; E26-D28 VanDerWaalsContact C-N 3.34Å; E26-D28 PolarHBondContact O-N 3.12Å | ||
| 27 | F | 54.3 | Low | 56.6 | Low | 144 Ų | 144 | 117.3 Ų | 117.3 | 63% | 0.632 | 62% | 0.619 | S | S | * | * | trans | -78.5 | 73.4 | -160.6 | -177.3 | -102.4 | 0 | 0 | 0 | 111.8 | I25 S31 | I25-F27 PolarHBondContact O-N 2.9Å; I25-F27 VanDerWaalsContact O-N 3.12Å; F27-S31 WeakPolarHBondContact CE1-OG 3.18Å; F27-S31 WeakPolarHBondContact CZ-OG 2.97Å | ||
| 28 | D | 55 | Low | 57.6 | Low | 167 Ų | 167 | 118.7 Ų | 118.7 | 89% | 0.893 | 62% | 0.622 | S | S | * | * | trans | -113.7 | 51.5 | 175.6 | -151.2 | 15 | 0 | 0 | 0 | 112 | E26 | E26-D28 VanDerWaalsContact C-N 3.34Å; E26-D28 PolarHBondContact O-N 3.12Å | ||
| 29 | G | 56.6 | Low | 58.6 | Low | 38 Ų | 38 | 114.5 Ų | 114.5 | 39% | 0.392 | 61% | 0.607 | S | S | . | * | S | Bend | trans | -128 | -178.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | S31 | G29-S31 PolarHBondContact O-N 3.05Š|
| 30 | P | 61.8 | Low | 59.8 | Low | 104 Ų | 104 | 111.6 Ų | 111.6 | 68% | 0.675 | 60% | 0.598 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.2 | 8 | -159.5 | 25 | -36.2 | 0 | 0 | 0 | 118 | A32 A33 R34 | P30-A32 VanDerWaalsContact C-N 3.31Å; P30-A33 PolarHBondContact O-N 3.45Å; P30-R34 PolarHBondContact O-N 2.62Å |
| 31 | S | 59.1 | Low | 60.9 | Low | 25 Ų | 25 | 112 Ų | 112 | 18% | 0.175 | 60% | 0.595 | C | S | . | * | H | α-helix | trans | -62.3 | -32.5 | 167.2 | -179.3 | 0 | 0 | 0 | 0 | 113.8 | F27 G29 A33 R34 K35 | F27-S31 WeakPolarHBondContact CE1-OG 3.18Å; F27-S31 WeakPolarHBondContact CZ-OG 2.97Å; G29-S31 PolarHBondContact O-N 3.05Å; S31-A33 VanDerWaalsContact C-N 3.33Å; S31-R34 PolarHBondContact O-N 3.44Å; S31-K35 WeakPolarHBondContact O-CB 3.33Å; S31-K35 WeakPolarHBondContact O-CG 3.2Å; S31-K35 PolarHBondContact O-N 2.83Å; S31-K35 WeakPolarHBondContact OG-CD 3.48Å; S31-K35 WeakPolarHBondContact OG-CE 3.06Å |
| 32 | A | 57.2 | Low | 62.5 | Low | 61 Ų | 61 | 109.3 Ų | 109.3 | 50% | 0.504 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -61.4 | -47 | 176.4 | 0 | 0 | 0 | 0 | 0 | 110 | P30 K35 M36 | P30-A32 VanDerWaalsContact C-N 3.31Å; A32-K35 PolarHBondContact O-N 3.02Å; A32-M36 WeakPolarHBondContact O-CB 3.26Å; A32-M36 VanDerWaalsContact O-CG 3.26Å; A32-M36 WeakPolarHBondContact O-CG 3.21Å; A32-M36 PolarHBondContact O-N 2.93Å |
| 33 | A | 58.6 | Low | 64 | Low | 52 Ų | 52 | 111 Ų | 111 | 43% | 0.43 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -62.8 | -44.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | P30 S31 M36 I37 | P30-A33 PolarHBondContact O-N 3.45Å; S31-A33 VanDerWaalsContact C-N 3.33Å; A33-M36 WeakPolarHBondContact O-CB 3.49Å; A33-M36 PolarHBondContact O-N 3.42Å; A33-I37 VanDerWaalsContact O-CG1 3.26Å; A33-I37 WeakPolarHBondContact O-CG1 3.49Å; A33-I37 PolarHBondContact O-N 3.47Å |
| 34 | R | 58.7 | Low | 65.7 | Low | 181 Ų | 181 | 109.7 Ų | 109.7 | 68% | 0.683 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.8 | -40 | 175.8 | -71.9 | -172.8 | -176.7 | -163.2 | 2.5 | 112.6 | P30 S31 M36 I37 I38 | P30-R34 PolarHBondContact O-N 2.62Å; S31-R34 PolarHBondContact O-N 3.44Å; R34-M36 VanDerWaalsContact C-N 3.34Å; R34-I37 PolarHBondContact O-N 3.33Å; R34-I38 WeakPolarHBondContact O-CD1 3.46Å; R34-I38 WeakPolarHBondContact O-CG1 3.5Å; R34-I38 PolarHBondContact O-N 2.85Å |
| 35 | K | 60.5 | Low | 67.5 | Low | 135 Ų | 135 | 105.1 Ų | 105.1 | 59% | 0.587 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -64.2 | -38.6 | 174.4 | -74.7 | 173.9 | 178.4 | 179.4 | 0 | 111.2 | S31 A32 I38 G39 | S31-K35 WeakPolarHBondContact O-CB 3.33Å; S31-K35 WeakPolarHBondContact O-CG 3.2Å; S31-K35 PolarHBondContact O-N 2.83Å; S31-K35 WeakPolarHBondContact OG-CD 3.48Å; S31-K35 WeakPolarHBondContact OG-CE 3.06Å; A32-K35 PolarHBondContact O-N 3.02Å; K35-I38 PolarHBondContact O-N 3.36Å; K35-G39 PolarHBondContact O-N 3.07Å |
| 36 | M | 62.5 | Low | 69.2 | Low | 143 Ų | 143 | 104 Ų | 104 | 70% | 0.704 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.8 | -41.9 | 173.9 | -74.6 | 174.9 | 72.6 | 0 | 0 | 112.4 | A32 A33 R34 G39 S40 | A32-M36 WeakPolarHBondContact O-CB 3.26Å; A32-M36 VanDerWaalsContact O-CG 3.26Å; A32-M36 WeakPolarHBondContact O-CG 3.21Å; A32-M36 PolarHBondContact O-N 2.93Å; A33-M36 WeakPolarHBondContact O-CB 3.49Å; A33-M36 PolarHBondContact O-N 3.42Å; R34-M36 VanDerWaalsContact C-N 3.34Å; M36-G39 PolarHBondContact O-N 3.02Å; M36-S40 WeakPolarHBondContact O-CB 3.48Å; M36-S40 PolarHBondContact O-N 3.35Å; M36-S40 PolarHBondContact O-OG 3.47Å |
| 37 | I | 68.8 | Low | 71.3 | Confident | 110 Ų | 110 | 101.7 Ų | 101.7 | 56% | 0.564 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.8 | -40.3 | 178.1 | -64.8 | 162.2 | 0 | 0 | 0 | 111.3 | A33 R34 S40 F41 | A33-I37 VanDerWaalsContact O-CG1 3.26Å; A33-I37 WeakPolarHBondContact O-CG1 3.49Å; A33-I37 PolarHBondContact O-N 3.47Å; R34-I37 PolarHBondContact O-N 3.33Å; I37-S40 WeakPolarHBondContact CA-OG 3.33Å; I37-S40 PolarHBondContact O-N 2.97Å; I37-S40 PolarHBondContact O-OG 3.32Å; I37-F41 WeakPolarHBondContact O-CB 3.47Å; I37-F41 PolarHBondContact O-N 3.29Å |
| 38 | I | 71.1 | Confident | 73.2 | Confident | 119 Ų | 119 | 97.1 Ų | 97.1 | 61% | 0.61 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -69.3 | -37.9 | 178.3 | -69.1 | 157.6 | 0 | 0 | 0 | 110.9 | R34 K35 S42 | R34-I38 WeakPolarHBondContact O-CD1 3.46Å; R34-I38 WeakPolarHBondContact O-CG1 3.5Å; R34-I38 PolarHBondContact O-N 2.85Å; K35-I38 PolarHBondContact O-N 3.36Å; I38-S42 PolarHBondContact O-N 3.45Å; I38-S42 VanDerWaalsContact O-N 3.1Å; I38-S42 PolarHBondContact O-OG 2.94Å |
| 39 | G | 73 | Confident | 75 | Confident | 31 Ų | 31 | 97 Ų | 97 | 32% | 0.32 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66.9 | -37.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | K35 M36 S42 M43 | K35-G39 PolarHBondContact O-N 3.07Å; M36-G39 PolarHBondContact O-N 3.02Å; G39-S42 PolarHBondContact O-OG 2.89Å; G39-M43 WeakPolarHBondContact O-CB 3.26Å; G39-M43 WeakPolarHBondContact O-CG 3.39Å; G39-M43 PolarHBondContact O-N 3.43Å; G39-M43 VanDerWaalsContact O-N 3.12Å |
| 40 | S | 79.1 | Confident | 76.8 | Confident | 72 Ų | 72 | 100.4 Ų | 100.4 | 50% | 0.503 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -70.9 | -37.8 | 177.2 | 65 | 0 | 0 | 0 | 0 | 112 | M36 I37 M43 F44 | M36-S40 WeakPolarHBondContact O-CB 3.48Å; M36-S40 PolarHBondContact O-N 3.35Å; M36-S40 PolarHBondContact O-OG 3.47Å; I37-S40 WeakPolarHBondContact CA-OG 3.33Å; I37-S40 PolarHBondContact O-N 2.97Å; I37-S40 PolarHBondContact O-OG 3.32Å; S40-M43 PolarHBondContact O-N 3.49Å; S40-F44 WeakPolarHBondContact O-CB 3.47Å; S40-F44 PolarHBondContact O-N 3.29Å |
| 41 | F | 84.8 | Confident | 78.3 | Confident | 143 Ų | 143 | 99.9 Ų | 99.9 | 63% | 0.627 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.4 | -44.7 | 175.6 | -174.2 | -100.6 | 0 | 0 | 0 | 112 | I37 M43 F44 V45 | I37-F41 WeakPolarHBondContact O-CB 3.47Å; I37-F41 PolarHBondContact O-N 3.29Å; F41-M43 PolarHBondContact O-N 3.1Å; F41-F44 PolarHBondContact O-N 2.98Å; F41-V45 HydrophobicContact CD1-CG2 4.28Å; F41-V45 HydrophobicContact CE1-CG2 3.88Å; F41-V45 HydrophobicContact CZ-CG2 4.02Å; F41-V45 WeakPolarHBondContact O-CG2 3.19Å; F41-V45 PolarHBondContact O-N 2.95Å; F41-V45 VanDerWaalsContact O-N 3.07Å |
| 42 | S | 84.4 | Confident | 80 | Confident | 54 Ų | 54 | 103.8 Ų | 103.8 | 38% | 0.378 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.4 | -41.3 | 177.6 | 64.7 | 0 | 0 | 0 | 0 | 112 | I38 G39 F44 V45 I46 | I38-S42 PolarHBondContact O-N 3.45Å; I38-S42 VanDerWaalsContact O-N 3.1Å; I38-S42 PolarHBondContact O-OG 2.94Å; G39-S42 PolarHBondContact O-OG 2.89Å; S42-F44 PolarHBondContact O-N 3.04Å; S42-V45 PolarHBondContact O-N 2.92Å; S42-I46 WeakPolarHBondContact O-CD1 3.33Å; S42-I46 VanDerWaalsContact O-CG1 3.29Å; S42-I46 WeakPolarHBondContact O-CG1 3.29Å; S42-I46 PolarHBondContact O-N 3.31Å |
| 43 | M | 85.7 | Confident | 81.8 | Confident | 132 Ų | 132 | 107.2 Ų | 107.2 | 65% | 0.65 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.1 | -41.9 | 175.1 | -71.9 | -67.8 | -178 | 0 | 0 | 112.3 | G39 S40 F41 V45 I46 F47 | G39-M43 WeakPolarHBondContact O-CB 3.26Å; G39-M43 WeakPolarHBondContact O-CG 3.39Å; G39-M43 PolarHBondContact O-N 3.43Å; G39-M43 VanDerWaalsContact O-N 3.12Å; S40-M43 PolarHBondContact O-N 3.49Å; F41-M43 PolarHBondContact O-N 3.1Å; M43-V45 PolarHBondContact O-N 3.48Å; M43-I46 PolarHBondContact O-N 3.27Å; M43-F47 VanDerWaalsContact O-CB 3.28Å; M43-F47 WeakPolarHBondContact O-CB 3.27Å; M43-F47 PolarHBondContact O-N 3.49Å |
| 44 | F | 91 | Very high | 83.6 | Confident | 141 Ų | 141 | 112.4 Ų | 112.4 | 62% | 0.618 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -60.4 | -45.2 | 176.5 | 177 | -99.2 | 0 | 0 | 0 | 112 | S40 F41 S42 F47 S48 | S40-F44 WeakPolarHBondContact O-CB 3.47Å; S40-F44 PolarHBondContact O-N 3.29Å; F41-F44 PolarHBondContact O-N 2.98Å; S42-F44 PolarHBondContact O-N 3.04Å; F44-F47 PolarHBondContact O-N 3.12Å; F44-S48 WeakPolarHBondContact O-CB 3.45Å; F44-S48 PolarHBondContact O-N 3.02Å |
| 45 | V | 91.3 | Very high | 85.3 | Confident | 50 Ų | 50 | 107.4 Ų | 107.4 | 30% | 0.303 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62.9 | -49.1 | 178.7 | 173.8 | 0 | 0 | 0 | 0 | 110.8 | F41 S42 M43 F47 S48 Y49 | F41-V45 HydrophobicContact CD1-CG2 4.28Å; F41-V45 HydrophobicContact CE1-CG2 3.88Å; F41-V45 HydrophobicContact CZ-CG2 4.02Å; F41-V45 WeakPolarHBondContact O-CG2 3.19Å; F41-V45 PolarHBondContact O-N 2.95Å; F41-V45 VanDerWaalsContact O-N 3.07Å; S42-V45 PolarHBondContact O-N 2.92Å; M43-V45 PolarHBondContact O-N 3.48Å; V45-F47 VanDerWaalsContact C-N 3.34Å; V45-F47 PolarHBondContact O-N 3.28Å; V45-S48 PolarHBondContact O-N 3.44Å; V45-Y49 HydrophobicContact CG1-CD2 3.71Å; V45-Y49 HydrophobicContact CG1-CE2 3.64Å; V45-Y49 VanDerWaalsContact O-CD2 3.27Å; V45-Y49 WeakPolarHBondContact O-CD2 3.42Å; V45-Y49 PolarHBondContact O-N 3.02Å |
| 46 | I | 91.3 | Very high | 87 | Confident | 95 Ų | 95 | 106.5 Ų | 106.5 | 49% | 0.487 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.2 | -45.3 | 179.4 | -65.4 | 162.7 | 0 | 0 | 0 | 110.8 | S42 M43 S48 Y49 L50 | S42-I46 WeakPolarHBondContact O-CD1 3.33Å; S42-I46 VanDerWaalsContact O-CG1 3.29Å; S42-I46 WeakPolarHBondContact O-CG1 3.29Å; S42-I46 PolarHBondContact O-N 3.31Å; M43-I46 PolarHBondContact O-N 3.27Å; I46-S48 PolarHBondContact O-N 2.96Å; I46-Y49 PolarHBondContact O-N 3.32Å; I46-L50 HydrophobicContact CG2-CD1 4.2Å; I46-L50 WeakPolarHBondContact O-CG 3.47Å; I46-L50 PolarHBondContact O-N 3.46Å |
| 47 | F | 92.8 | Very high | 88.5 | Confident | 138 Ų | 138 | 102.2 Ų | 102.2 | 61% | 0.605 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.3 | -43.1 | 178.5 | -173.8 | -100 | 0 | 0 | 0 | 111.9 | M43 F44 V45 Y49 L50 Q51 | M43-F47 VanDerWaalsContact O-CB 3.28Å; M43-F47 WeakPolarHBondContact O-CB 3.27Å; M43-F47 PolarHBondContact O-N 3.49Å; F44-F47 PolarHBondContact O-N 3.12Å; V45-F47 VanDerWaalsContact C-N 3.34Å; V45-F47 PolarHBondContact O-N 3.28Å; F47-Y49 PolarHBondContact O-N 2.98Å; F47-L50 PolarHBondContact O-N 3.43Å; F47-Q51 WeakPolarHBondContact O-CB 3.48Å; F47-Q51 PolarHBondContact O-N 2.94Å |
| 48 | S | 93.5 | Very high | 89.7 | Confident | 49 Ų | 49 | 99 Ų | 99 | 34% | 0.343 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.9 | -42.4 | 175.7 | -177 | 0 | 0 | 0 | 0 | 112.2 | F44 V45 I46 Q51 L52 | F44-S48 WeakPolarHBondContact O-CB 3.45Å; F44-S48 PolarHBondContact O-N 3.02Å; V45-S48 PolarHBondContact O-N 3.44Å; I46-S48 PolarHBondContact O-N 2.96Å; S48-Q51 PolarHBondContact O-N 3.35Å; S48-L52 WeakPolarHBondContact O-CG 3.42Å; S48-L52 PolarHBondContact O-N 3.43Å |
| 49 | Y | 93.9 | Very high | 90.7 | Very high | 164 Ų | 164 | 98.3 Ų | 98.3 | 64% | 0.643 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.8 | -44.6 | 175.7 | -89.7 | -73.2 | 0 | 0 | 0 | 112.7 | V45 I46 F47 Q51 L52 F53 | V45-Y49 HydrophobicContact CG1-CD2 3.71Å; V45-Y49 HydrophobicContact CG1-CE2 3.64Å; V45-Y49 VanDerWaalsContact O-CD2 3.27Å; V45-Y49 WeakPolarHBondContact O-CD2 3.42Å; V45-Y49 PolarHBondContact O-N 3.02Å; I46-Y49 PolarHBondContact O-N 3.32Å; F47-Y49 PolarHBondContact O-N 2.98Å; Y49-Q51 VanDerWaalsContact C-N 3.31Å; Y49-Q51 PolarHBondContact O-N 2.98Å; Y49-L52 PolarHBondContact O-N 2.9Å; Y49-F53 WeakPolarHBondContact O-CB 3.41Å; Y49-F53 PolarHBondContact O-N 3.45Å |
| 50 | L | 93.6 | Very high | 91.7 | Very high | 110 Ų | 110 | 104.1 Ų | 104.1 | 58% | 0.576 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62 | -40.2 | 177.1 | -70.5 | 171.6 | 0 | 0 | 0 | 111.6 | I46 F47 F53 Y54 | I46-L50 HydrophobicContact CG2-CD1 4.2Å; I46-L50 WeakPolarHBondContact O-CG 3.47Å; I46-L50 PolarHBondContact O-N 3.46Å; F47-L50 PolarHBondContact O-N 3.43Å; L50-F53 PolarHBondContact O-N 2.89Å; L50-Y54 WeakPolarHBondContact O-CB 3.35Å; L50-Y54 PolarHBondContact O-N 3.35Å |
| 51 | Q | 94.2 | Very high | 92.3 | Very high | 93 Ų | 93 | 104.7 Ų | 104.7 | 44% | 0.435 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.8 | -45.2 | 176.7 | -170.7 | 68 | 19.4 | 0 | 0 | 111.9 | F47 S48 Y49 F53 Y54 I55 | F47-Q51 WeakPolarHBondContact O-CB 3.48Å; F47-Q51 PolarHBondContact O-N 2.94Å; S48-Q51 PolarHBondContact O-N 3.35Å; Y49-Q51 VanDerWaalsContact C-N 3.31Å; Y49-Q51 PolarHBondContact O-N 2.98Å; Q51-F53 VanDerWaalsContact C-N 3.34Å; Q51-Y54 PolarHBondContact O-N 3.33Å; Q51-I55 HydrophobicContact CG-CD1 4.31Å; Q51-I55 WeakPolarHBondContact O-CG1 3.28Å; Q51-I55 PolarHBondContact O-N 3.47Å |
| 52 | L | 94.2 | Very high | 92.6 | Very high | 107 Ų | 107 | 100.9 Ų | 100.9 | 56% | 0.56 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.1 | -42.2 | 176.4 | -74.6 | 173.7 | 0 | 0 | 0 | 111.5 | S48 Y49 I55 L56 | S48-L52 WeakPolarHBondContact O-CG 3.42Å; S48-L52 PolarHBondContact O-N 3.43Å; Y49-L52 PolarHBondContact O-N 2.9Å; L52-I55 PolarHBondContact O-N 2.9Å; L52-L56 WeakPolarHBondContact O-CB 3.3Å; L52-L56 PolarHBondContact O-N 3.34Å |
| 53 | F | 95.4 | Very high | 92.9 | Very high | 132 Ų | 132 | 103.4 Ų | 103.4 | 58% | 0.579 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62.2 | -43.5 | 175.6 | -176.3 | -102.2 | 0 | 0 | 0 | 111.6 | Y49 L50 Q51 I55 L56 V57 | Y49-F53 WeakPolarHBondContact O-CB 3.41Å; Y49-F53 PolarHBondContact O-N 3.45Å; L50-F53 PolarHBondContact O-N 2.89Å; Q51-F53 VanDerWaalsContact C-N 3.34Å; F53-I55 PolarHBondContact O-N 3.48Å; F53-L56 WeakPolarHBondContact O-CB 3.34Å; F53-L56 PolarHBondContact O-N 3.38Å; F53-V57 HydrophobicContact CD1-CG2 4.11Å; F53-V57 HydrophobicContact CE1-CG2 3.7Å; F53-V57 HydrophobicContact CE2-CG2 4.19Å; F53-V57 HydrophobicContact CZ-CG2 3.74Å; F53-V57 WeakPolarHBondContact O-CG2 3.36Å; F53-V57 PolarHBondContact O-N 3.5Å |
| 54 | Y | 95 | Very high | 93 | Very high | 161 Ų | 161 | 101.3 Ų | 101.3 | 63% | 0.631 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -58.8 | -46 | 175.7 | 179.4 | -95.8 | 0 | 0 | 0 | 112 | L50 Q51 L56 V57 A58 | L50-Y54 WeakPolarHBondContact O-CB 3.35Å; L50-Y54 PolarHBondContact O-N 3.35Å; Q51-Y54 PolarHBondContact O-N 3.33Å; Y54-L56 PolarHBondContact O-N 3.36Å; Y54-V57 PolarHBondContact O-N 3.22Å; Y54-A58 WeakPolarHBondContact O-CB 3.39Å; Y54-A58 PolarHBondContact O-N 3.25Å |
| 55 | I | 95.1 | Very high | 92.5 | Very high | 77 Ų | 77 | 100.9 Ų | 100.9 | 40% | 0.395 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.4 | -42.3 | 176.7 | -66 | 165.4 | 0 | 0 | 0 | 110.8 | Q51 L52 F53 V57 A58 I59 | Q51-I55 HydrophobicContact CG-CD1 4.31Å; Q51-I55 WeakPolarHBondContact O-CG1 3.28Å; Q51-I55 PolarHBondContact O-N 3.47Å; L52-I55 PolarHBondContact O-N 2.9Å; F53-I55 PolarHBondContact O-N 3.48Å; I55-V57 PolarHBondContact O-N 2.87Å; I55-A58 PolarHBondContact O-N 2.85Å; I55-I59 HydrophobicContact CG2-CD1 3.75Å; I55-I59 HydrophobicContact CG2-CG1 4.34Å; I55-I59 VanDerWaalsContact O-CG1 3.3Å; I55-I59 WeakPolarHBondContact O-CG1 3.33Å; I55-I59 PolarHBondContact O-N 3.32Å |
| 56 | L | 95.4 | Very high | 91.9 | Very high | 116 Ų | 116 | 102.3 Ų | 102.3 | 61% | 0.607 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -59.2 | -47 | 176.9 | -169.5 | 98.7 | 0 | 0 | 0 | 111.3 | L52 F53 Y54 I59 Y60 | L52-L56 WeakPolarHBondContact O-CB 3.3Å; L52-L56 PolarHBondContact O-N 3.34Å; F53-L56 WeakPolarHBondContact O-CB 3.34Å; F53-L56 PolarHBondContact O-N 3.38Å; Y54-L56 PolarHBondContact O-N 3.36Å; L56-I59 PolarHBondContact O-N 2.9Å; L56-Y60 WeakPolarHBondContact O-CB 3.29Å; L56-Y60 PolarHBondContact O-N 3.45Å |
| 57 | V | 94.4 | Very high | 90.7 | Very high | 52 Ų | 52 | 105.6 Ų | 105.6 | 32% | 0.315 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.2 | -41.4 | 176.9 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | F53 Y54 I55 Y60 L61 | F53-V57 HydrophobicContact CD1-CG2 4.11Å; F53-V57 HydrophobicContact CE1-CG2 3.7Å; F53-V57 HydrophobicContact CE2-CG2 4.19Å; F53-V57 HydrophobicContact CZ-CG2 3.74Å; F53-V57 WeakPolarHBondContact O-CG2 3.36Å; F53-V57 PolarHBondContact O-N 3.5Å; Y54-V57 PolarHBondContact O-N 3.22Å; I55-V57 PolarHBondContact O-N 2.87Å; V57-Y60 PolarHBondContact O-N 2.87Å; V57-L61 HydrophobicContact CG1-CD1 3.86Å; V57-L61 HydrophobicContact CG1-CG 4.37Å; V57-L61 WeakPolarHBondContact O-CB 3.31Å; V57-L61 WeakPolarHBondContact O-CG 3.35Å; V57-L61 PolarHBondContact O-N 2.88Å |
| 58 | A | 93.9 | Very high | 88.9 | Confident | 43 Ų | 43 | 108.3 Ų | 108.3 | 36% | 0.355 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.2 | -43.3 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112 | Y54 I55 A62 | Y54-A58 WeakPolarHBondContact O-CB 3.39Å; Y54-A58 PolarHBondContact O-N 3.25Å; I55-A58 PolarHBondContact O-N 2.85Å; A58-A62 VanDerWaalsContact O-CB 3.29Å; A58-A62 WeakPolarHBondContact O-CB 3.21Å; A58-A62 PolarHBondContact O-N 3.5Å |
| 59 | I | 93.5 | Very high | 88.7 | Confident | 105 Ų | 105 | 111.3 Ų | 111.3 | 54% | 0.538 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -66.5 | -43.7 | 175.5 | -67.1 | 168 | 0 | 0 | 0 | 110.6 | I55 L56 L61 A62 L63 | I55-I59 HydrophobicContact CG2-CD1 3.75Å; I55-I59 HydrophobicContact CG2-CG1 4.34Å; I55-I59 VanDerWaalsContact O-CG1 3.3Å; I55-I59 WeakPolarHBondContact O-CG1 3.33Å; I55-I59 PolarHBondContact O-N 3.32Å; L56-I59 PolarHBondContact O-N 2.9Å; I59-L61 VanDerWaalsContact C-N 3.34Å; I59-L61 PolarHBondContact O-N 3.35Å; I59-A62 PolarHBondContact O-N 3.03Å; I59-L63 VanDerWaalsContact O-CB 3.31Å; I59-L63 WeakPolarHBondContact O-CB 3.39Å; I59-L63 PolarHBondContact O-N 3.49Å |
| 60 | Y | 93.6 | Very high | 88.4 | Confident | 153 Ų | 153 | 108.5 Ų | 108.5 | 60% | 0.6 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -58.6 | -46.6 | 177.1 | 176 | -96.6 | 0 | 0 | 0 | 111.3 | L56 V57 L63 H64 | L56-Y60 WeakPolarHBondContact O-CB 3.29Å; L56-Y60 PolarHBondContact O-N 3.45Å; V57-Y60 PolarHBondContact O-N 2.87Å; Y60-L63 PolarHBondContact O-N 3.47Å; Y60-H64 WeakPolarHBondContact O-CB 3.48Å; Y60-H64 PolarHBondContact O-N 2.86Å |
| 61 | L | 90.9 | Very high | 88.1 | Confident | 84 Ų | 84 | 108.4 Ų | 108.4 | 44% | 0.44 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.5 | -45.7 | 175.6 | -74.3 | 167.9 | 0 | 0 | 0 | 111.4 | V57 I59 L63 H64 H65 | V57-L61 HydrophobicContact CG1-CD1 3.86Å; V57-L61 HydrophobicContact CG1-CG 4.37Å; V57-L61 WeakPolarHBondContact O-CB 3.31Å; V57-L61 WeakPolarHBondContact O-CG 3.35Å; V57-L61 PolarHBondContact O-N 2.88Å; I59-L61 VanDerWaalsContact C-N 3.34Å; I59-L61 PolarHBondContact O-N 3.35Å; L61-L63 PolarHBondContact O-N 2.82Å; L61-H64 PolarHBondContact O-N 3.47Å; L61-H65 WeakPolarHBondContact O-CB 3.33Å; L61-H65 PolarHBondContact O-N 2.96Å; L61-H65 PolarHBondContact O-ND1 3.23Å |
| 62 | A | 91.4 | Very high | 87.8 | Confident | 63 Ų | 63 | 109.3 Ų | 109.3 | 52% | 0.521 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62 | -43 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A58 I59 H65 A66 | A58-A62 VanDerWaalsContact O-CB 3.29Å; A58-A62 WeakPolarHBondContact O-CB 3.21Å; A58-A62 PolarHBondContact O-N 3.5Å; I59-A62 PolarHBondContact O-N 3.03Å; A62-H65 PolarHBondContact O-N 3.44Å; A62-A66 WeakPolarHBondContact O-CB 3.46Å; A62-A66 PolarHBondContact O-N 2.88Å |
| 63 | L | 90.5 | Very high | 87.4 | Confident | 107 Ų | 107 | 109.4 Ų | 109.4 | 56% | 0.56 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.8 | -41.7 | 177.8 | -169.6 | 66.4 | 0 | 0 | 0 | 111.2 | I59 Y60 L61 H65 A66 H67 | I59-L63 VanDerWaalsContact O-CB 3.31Å; I59-L63 WeakPolarHBondContact O-CB 3.39Å; I59-L63 PolarHBondContact O-N 3.49Å; Y60-L63 PolarHBondContact O-N 3.47Å; L61-L63 PolarHBondContact O-N 2.82Å; L63-H65 PolarHBondContact O-N 3.26Å; L63-A66 PolarHBondContact O-N 2.87Å; L63-H67 WeakPolarHBondContact O-CB 3.32Å; L63-H67 PolarHBondContact O-N 3.45Å |
| 64 | H | 87.6 | Confident | 86.8 | Confident | 87 Ų | 87 | 107.9 Ų | 107.9 | 40% | 0.403 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.3 | -38.3 | 176.2 | -170.9 | -78.1 | 0 | 0 | 0 | 112.2 | Y60 L61 H68 | Y60-H64 WeakPolarHBondContact O-CB 3.48Å; Y60-H64 PolarHBondContact O-N 2.86Å; L61-H64 PolarHBondContact O-N 3.47Å; H64-H68 AromaticContact CE1-CD2 3.35Å; H64-H68 PolarHBondContact CE1-CD2 3.35Å; H64-H68 AromaticContact CE1-NE2 3.53Å; H64-H68 AromaticContact ND1-CD2 3.72Å; H64-H68 AromaticContact NE2-CD2 3.95Å; H64-H68 AromaticContact NE2-NE2 3.86Å; H64-H68 PolarHBondContact O-N 2.75Å |
| 65 | H | 80.5 | Confident | 86.2 | Confident | 133 Ų | 133 | 104.1 Ų | 104.1 | 62% | 0.616 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -74.4 | -24.5 | 174.7 | -74.3 | 83.7 | 0 | 0 | 0 | 113.2 | L61 A62 L63 | L61-H65 WeakPolarHBondContact O-CB 3.33Å; L61-H65 PolarHBondContact O-N 2.96Å; L61-H65 PolarHBondContact O-ND1 3.23Å; A62-H65 PolarHBondContact O-N 3.44Å; L63-H65 PolarHBondContact O-N 3.26Å |
| 66 | A | 78.7 | Confident | 85.6 | Confident | 80 Ų | 80 | 106.2 Ų | 106.2 | 66% | 0.661 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -82.3 | -22.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | A62 L63 | A62-A66 WeakPolarHBondContact O-CB 3.46Å; A62-A66 PolarHBondContact O-N 2.88Å; L63-A66 PolarHBondContact O-N 2.87Å |
| 67 | H | 67.5 | Low | 84.7 | Confident | 163 Ų | 163 | 105.4 Ų | 105.4 | 76% | 0.755 | 56% | 0.556 | S | S | * | * | trans | -95.8 | -0.8 | 179.5 | -107.8 | -84.9 | 0 | 0 | 0 | 114.4 | L63 | L63-H67 WeakPolarHBondContact O-CB 3.32Å; L63-H67 PolarHBondContact O-N 3.45Å | ||
| 68 | H | 54.3 | Low | 83.9 | Confident | 195 Ų | 195 | 110.3 Ų | 110.3 | 90% | 0.903 | 58% | 0.577 | S | S | * | * | trans | -106.9 | 0 | 169.4 | -93.5 | -73.8 | 0 | 0 | 0 | 110.4 | H64 | H64-H68 AromaticContact CE1-CD2 3.35Å; H64-H68 PolarHBondContact CE1-CD2 3.35Å; H64-H68 AromaticContact CE1-NE2 3.53Å; H64-H68 AromaticContact ND1-CD2 3.72Å; H64-H68 AromaticContact NE2-CD2 3.95Å; H64-H68 AromaticContact NE2-NE2 3.86Å; H64-H68 PolarHBondContact O-N 2.75Å |
Retrieved 68 of 68 residues in 23 ms
(Link to these results)