| 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 | 48.7 | Very low | 54.3 | Low | 234 Ų | 234 | 112.4 Ų | 112.4 | 100% | 1.153 | 58% | 0.582 | S | S | * | * | 0 | 52.9 | 0 | -65.5 | 170.6 | 167.5 | 0 | 0 | 110.8 | |||||
| 2 | M | 50.7 | Low | 54 | Low | 154 Ų | 154 | 108.6 Ų | 108.6 | 76% | 0.759 | 59% | 0.591 | S | S | * | * | trans | -117.3 | -21 | -171.4 | -156.5 | 143.5 | 167 | 0 | 0 | 113 | ||||
| 3 | T | 53.3 | Low | 53.8 | Low | 89 Ų | 89 | 103.7 Ų | 103.7 | 55% | 0.546 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69.8 | -33.9 | -177.4 | -39.4 | 0 | 0 | 0 | 0 | 113.5 | L5 L6 I7 | T3-L5 PolarHBondContact O-N 3.08Å; T3-L6 PolarHBondContact O-N 2.83Å; T3-I7 HydrophobicContact CG2-CD1 4.36Å; T3-I7 WeakPolarHBondContact O-CG1 3.46Å; T3-I7 PolarHBondContact O-N 3.12Å |
| 4 | L | 51 | Low | 53.5 | Low | 129 Ų | 129 | 103.9 Ų | 103.9 | 68% | 0.675 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -65.7 | -36.2 | -178.8 | -77.1 | 133.3 | 0 | 0 | 0 | 113 | L6 I7 Q8 | L4-L6 VanDerWaalsContact C-N 3.28Å; L4-L6 PolarHBondContact O-N 3.28Å; L4-I7 PolarHBondContact O-N 2.78Å; L4-Q8 PolarHBondContact O-N 2.91Å |
| 5 | L | 54.3 | Low | 53.1 | Low | 128 Ų | 128 | 103.7 Ų | 103.7 | 67% | 0.67 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -67.4 | -31.5 | -177.6 | -163.1 | 72.7 | 0 | 0 | 0 | 112.2 | T3 S9 | T3-L5 PolarHBondContact O-N 3.08Å; L5-S9 PolarHBondContact O-N 3.32Å; L5-S9 PolarHBondContact O-OG 3.27Å |
| 6 | L | 54.6 | Low | 52.6 | Low | 75 Ų | 75 | 100.2 Ų | 100.2 | 39% | 0.393 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -76 | -33.4 | 179.7 | -64.7 | 168.5 | 0 | 0 | 0 | 112 | T3 L4 S9 C10 F42 V46 | T3-L6 PolarHBondContact O-N 2.83Å; L4-L6 VanDerWaalsContact C-N 3.28Å; L4-L6 PolarHBondContact O-N 3.28Å; L6-S9 WeakPolarHBondContact CA-OG 3.42Å; L6-S9 PolarHBondContact O-OG 2.79Å; L6-S9 VanDerWaalsContact O-OG 3.1Å; L6-C10 PolarHBondContact O-SG 3.44Å; L6-C10 VanDerWaalsContact O-SG 3.4Å; L6-F42 HydrophobicContact CD2-CZ 4.34Å; L6-V46 HydrophobicContact CB-CG1 4.33Å |
| 7 | I | 57.8 | Low | 52.5 | Low | 41 Ų | 41 | 101.5 Ų | 101.5 | 21% | 0.21 | 60% | 0.603 | C | S | . | * | H | α-helix | trans | -73.5 | -37.2 | 177.9 | -60.2 | 160.1 | 0 | 0 | 0 | 110.8 | T3 L4 C10 H11 V46 N50 | T3-I7 HydrophobicContact CG2-CD1 4.36Å; T3-I7 WeakPolarHBondContact O-CG1 3.46Å; T3-I7 PolarHBondContact O-N 3.12Å; L4-I7 PolarHBondContact O-N 2.78Å; I7-C10 WeakPolarHBondContact O-CB 3.4Å; I7-C10 PolarHBondContact O-N 3.45Å; I7-H11 PolarHBondContact O-N 3.15Å; I7-H11 VanDerWaalsContact O-N 3.15Å; I7-V46 HydrophobicContact CB-CG1 4.46Å; I7-V46 HydrophobicContact CG1-CG1 3.58Å; I7-N50 HydrophobicContact CD1-CB 3.94Å |
| 8 | Q | 56.3 | Low | 52.3 | Low | 138 Ų | 138 | 103 Ų | 103 | 65% | 0.645 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -66.9 | -35.7 | 177.8 | -110.4 | 166.6 | -32.6 | 0 | 0 | 113.3 | L4 C10 H11 G12 | L4-Q8 PolarHBondContact O-N 2.91Å; Q8-C10 PolarHBondContact O-N 2.86Å; Q8-H11 PolarHBondContact O-N 3.41Å; Q8-G12 PolarHBondContact O-N 2.82Å; Q8-G12 VanDerWaalsContact O-N 3.14Å |
| 9 | S | 54.3 | Low | 52 | Low | 72 Ų | 72 | 104.1 Ų | 104.1 | 50% | 0.503 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -66.7 | -23.2 | 175.3 | 21 | 0 | 0 | 0 | 0 | 111.9 | L5 L6 G13 | L5-S9 PolarHBondContact O-N 3.32Å; L5-S9 PolarHBondContact O-OG 3.27Å; L6-S9 WeakPolarHBondContact CA-OG 3.42Å; L6-S9 PolarHBondContact O-OG 2.79Å; L6-S9 VanDerWaalsContact O-OG 3.1Å; S9-G13 PolarHBondContact O-N 2.88Å |
| 10 | C | 57.8 | Low | 51.8 | Low | 16 Ų | 16 | 107.9 Ų | 107.9 | 11% | 0.108 | 63% | 0.634 | C | S | . | * | H | α-helix | trans | -81.6 | -38.9 | 175.1 | -71.9 | 0 | 0 | 0 | 0 | 114.3 | L6 I7 Q8 G12 G13 S14 C43 | L6-C10 PolarHBondContact O-SG 3.44Å; L6-C10 VanDerWaalsContact O-SG 3.4Å; I7-C10 WeakPolarHBondContact O-CB 3.4Å; I7-C10 PolarHBondContact O-N 3.45Å; Q8-C10 PolarHBondContact O-N 2.86Å; C10-G12 VanDerWaalsContact C-N 3.27Å; C10-G12 PolarHBondContact O-N 2.84Å; C10-G13 PolarHBondContact O-N 3.34Å; C10-S14 PolarHBondContact O-N 2.87Å; C10-C43 WeakPolarHBondContact CA-SG 3.46Å; C10-C43 HydrophobicContact CB-CB 3.38Å; C10-C43 WeakPolarHBondContact CB-SG 3.17Å; C10-C43 WeakPolarHBondContact SG-CA 3.29Å; C10-C43 WeakPolarHBondContact SG-CB 3.42Å; C10-C43 CovalentContact SG-SG 2.03Å; C10-C43 PolarHBondContact SG-SG 3.34Å |
| 11 | H | 58.5 | Low | 51.1 | Low | 160 Ų | 160 | 110.3 Ų | 110.3 | 74% | 0.741 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -65.1 | -31.4 | 172.1 | -112.4 | 111.4 | 0 | 0 | 0 | 112.6 | I7 Q8 | I7-H11 PolarHBondContact O-N 3.15Å; I7-H11 VanDerWaalsContact O-N 3.15Å; Q8-H11 PolarHBondContact O-N 3.41Å |
| 12 | G | 51 | Low | 50.7 | Low | 67 Ų | 67 | 102.7 Ų | 102.7 | 69% | 0.691 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -16.4 | 174 | 0 | 0 | 0 | 0 | 0 | 114.9 | Q8 C10 | Q8-G12 PolarHBondContact O-N 2.82Å; Q8-G12 VanDerWaalsContact O-N 3.14Å; C10-G12 VanDerWaalsContact C-N 3.27Å; C10-G12 PolarHBondContact O-N 2.84Å |
| 13 | G | 51.2 | Low | 50.4 | Low | 45 Ų | 45 | 102.4 Ų | 102.4 | 46% | 0.464 | 63% | 0.627 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.4 | -17 | -177.8 | 0 | 0 | 0 | 0 | 0 | 115 | S9 C10 S15 G16 | S9-G13 PolarHBondContact O-N 2.88Å; C10-G13 PolarHBondContact O-N 3.34Å; G13-S15 PolarHBondContact O-N 2.9Å; G13-G16 PolarHBondContact O-N 2.9Å |
| 14 | S | 49 | Very low | 50 | Low | 106 Ų | 106 | 105.5 Ų | 105.5 | 74% | 0.741 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.2 | -12 | -177.3 | -156.4 | 0 | 0 | 0 | 0 | 113.9 | C10 G16 | C10-S14 PolarHBondContact O-N 2.87Å; S14-G16 VanDerWaalsContact C-N 3.26Å; S14-G16 PolarHBondContact O-N 3.35Å |
| 15 | S | 48.2 | Very low | 49.6 | Very low | 102 Ų | 102 | 104.6 Ų | 104.6 | 71% | 0.713 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.4 | 9 | 174.5 | -57 | 0 | 0 | 0 | 0 | 114 | G13 T17 | G13-S15 PolarHBondContact O-N 2.9Å; S15-T17 PolarHBondContact O-N 3.1Å |
| 16 | G | 45.6 | Very low | 49 | Very low | 47 Ų | 47 | 103.6 Ų | 103.6 | 49% | 0.485 | 64% | 0.64 | S | S | . | * | trans | -75.7 | 74.5 | 168.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | G13 S14 T18 | G13-G16 PolarHBondContact O-N 2.9Å; S14-G16 VanDerWaalsContact C-N 3.26Å; S14-G16 PolarHBondContact O-N 3.35Å; G16-T18 PolarHBondContact O-N 3.13Å; G16-T18 VanDerWaalsContact O-N 3.15Å | ||
| 17 | T | 50.8 | Low | 48.6 | Very low | 122 Ų | 122 | 107.5 Ų | 107.5 | 75% | 0.748 | 66% | 0.661 | S | S | * | * | trans | -41 | 115.1 | 176 | 48.7 | 0 | 0 | 0 | 0 | 111.5 | S15 P19 | S15-T17 PolarHBondContact O-N 3.1Å; T17-P19 WeakPolarHBondContact O-CD 2.98Å | ||
| 18 | T | 48 | Very low | 47.9 | Very low | 129 Ų | 129 | 109 Ų | 109 | 79% | 0.791 | 69% | 0.687 | S | S | * | * | trans | -58.9 | 122.9 | 153.3 | 25.4 | 0 | 0 | 0 | 0 | 105.7 | G16 E20 | G16-T18 PolarHBondContact O-N 3.13Å; G16-T18 VanDerWaalsContact O-N 3.15Å; T18-E20 PolarHBondContact O-N 3.48Å | ||
| 19 | P | 46.8 | Very low | 47.4 | Very low | 123 Ų | 123 | 107.7 Ų | 107.7 | 80% | 0.799 | 69% | 0.69 | S | S | * | * | trans | -64 | 99 | 169.3 | 24.9 | -30.3 | 0 | 0 | 0 | 107.1 | T17 N21 | T17-P19 WeakPolarHBondContact O-CD 2.98Å; P19-N21 PolarHBondContact O-N 2.86Å; P19-N21 VanDerWaalsContact O-N 3.09Å | ||
| 20 | E | 48.1 | Very low | 47.3 | Very low | 181 Ų | 181 | 108.5 Ų | 108.5 | 85% | 0.846 | 70% | 0.696 | S | S | * | * | trans | -26.3 | 108.6 | 144.4 | -172.2 | 175.2 | 94 | 0 | 0 | 109.4 | T18 | T18-E20 PolarHBondContact O-N 3.48Š| ||
| 21 | N | 37.1 | Very low | 47.2 | Very low | 159 Ų | 159 | 114.8 Ų | 114.8 | 85% | 0.85 | 72% | 0.722 | S | S | * | * | S | Bend | trans | 35.3 | 100.9 | 144.6 | -164.5 | 45.7 | 0 | 0 | 0 | 117.3 | P19 | P19-N21 PolarHBondContact O-N 2.86Å; P19-N21 VanDerWaalsContact O-N 3.09Å |
| 22 | G | 39.7 | Very low | 46.8 | Very low | 74 Ų | 74 | 116.2 Ų | 116.2 | 76% | 0.763 | 72% | 0.721 | S | S | * | * | trans | 116.1 | 74.7 | 150.5 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 23 | N | 45.1 | Very low | 46.9 | Very low | 148 Ų | 148 | 116.6 Ų | 116.6 | 79% | 0.791 | 71% | 0.713 | S | S | * | * | trans | -161.4 | 134.8 | 145.1 | -154.3 | -1.5 | 0 | 0 | 0 | 111.7 | T25 | N23-T25 VanDerWaalsContact C-N 3.31Å; N23-T25 PolarHBondContact O-N 3.32Å | ||
| 24 | N | 44.6 | Very low | 47.1 | Very low | 154 Ų | 154 | 123.9 Ų | 123.9 | 82% | 0.824 | 73% | 0.726 | S | S | * | * | trans | -78.1 | 70.7 | -176.9 | -166.3 | 15.5 | 0 | 0 | 0 | 110.5 | ||||
| 25 | T | 43.7 | Very low | 47.6 | Very low | 109 Ų | 109 | 120.4 Ų | 120.4 | 67% | 0.669 | 70% | 0.704 | S | S | * | * | trans | -103.8 | 97.8 | 178.4 | -55.6 | 0 | 0 | 0 | 0 | 111.2 | N23 | N23-T25 VanDerWaalsContact C-N 3.31Å; N23-T25 PolarHBondContact O-N 3.32Å | ||
| 26 | T | 40.8 | Very low | 48.1 | Very low | 108 Ų | 108 | 120.2 Ų | 120.2 | 66% | 0.663 | 69% | 0.694 | S | S | * | * | trans | -51.3 | 129.5 | 159.2 | -43.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 27 | N | 46.4 | Very low | 48.8 | Very low | 157 Ų | 157 | 119.7 Ų | 119.7 | 84% | 0.84 | 69% | 0.689 | S | S | * | * | S | Bend | trans | 118.7 | 80.8 | 169.7 | -57.5 | -31 | 0 | 0 | 0 | 115.5 | ||
| 28 | G | 42.4 | Very low | 49.3 | Very low | 73 Ų | 73 | 117.5 Ų | 117.5 | 75% | 0.753 | 68% | 0.679 | S | S | * | * | trans | 77.1 | 77.9 | 150 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 29 | P | 46.8 | Very low | 49.9 | Very low | 110 Ų | 110 | 114.7 Ų | 114.7 | 71% | 0.714 | 66% | 0.664 | S | S | * | * | trans | -125.3 | 58.8 | -177.5 | 41.3 | -26.2 | 0 | 0 | 0 | 114.4 | ||||
| 30 | S | 52.3 | Low | 50.7 | Low | 89 Ų | 89 | 110.4 Ų | 110.4 | 62% | 0.622 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -124.2 | -38.1 | 176.7 | 85 | 0 | 0 | 0 | 0 | 115.8 | R34 | S30-R34 WeakPolarHBondContact O-CB 3.33Å; S30-R34 PolarHBondContact O-N 2.87Å; S30-R34 VanDerWaalsContact O-N 3.14Å |
| 31 | F | 55.8 | Low | 51.6 | Low | 148 Ų | 148 | 107 Ų | 107 | 65% | 0.649 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -70.7 | -48.7 | -176.5 | -178.4 | -97.5 | 0 | 0 | 0 | 111.8 | R34 A35 | F31-R34 PolarHBondContact O-N 3.45Å; F31-A35 HydrophobicContact CE1-CB 4.49Å; F31-A35 VanDerWaalsContact O-CB 3.29Å; F31-A35 WeakPolarHBondContact O-CB 3.34Å; F31-A35 PolarHBondContact O-N 2.85Å |
| 32 | W | 48.6 | Very low | 53 | Low | 189 Ų | 189 | 104.4 Ų | 104.4 | 72% | 0.716 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -68.7 | -39.8 | -177.5 | -68.7 | 105.3 | 0 | 0 | 0 | 112.5 | R34 A35 L36 | W32-R34 VanDerWaalsContact C-N 3.35Å; W32-R34 PolarHBondContact O-N 3.36Å; W32-A35 PolarHBondContact O-N 2.87Å; W32-L36 VanDerWaalsContact O-CB 3.24Å; W32-L36 WeakPolarHBondContact O-CB 3.21Å; W32-L36 WeakPolarHBondContact O-CG 3.37Å; W32-L36 PolarHBondContact O-N 3.28Å |
| 33 | S | 53.6 | Low | 54.3 | Low | 76 Ų | 76 | 102 Ų | 102 | 53% | 0.531 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -65 | -37.5 | 174.3 | -52.2 | 0 | 0 | 0 | 0 | 112.3 | G37 | S33-G37 PolarHBondContact O-N 3.09Å |
| 34 | R | 55.4 | Low | 55.3 | Low | 198 Ų | 198 | 98.5 Ų | 98.5 | 75% | 0.747 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -68.4 | -42 | 171.6 | -87.1 | -177.8 | 162.5 | -157.4 | -3.6 | 112.4 | S30 F31 W32 G37 S38 | S30-R34 WeakPolarHBondContact O-CB 3.33Å; S30-R34 PolarHBondContact O-N 2.87Å; S30-R34 VanDerWaalsContact O-N 3.14Å; F31-R34 PolarHBondContact O-N 3.45Å; W32-R34 VanDerWaalsContact C-N 3.35Å; W32-R34 PolarHBondContact O-N 3.36Å; R34-G37 PolarHBondContact O-N 2.78Å; R34-S38 VanDerWaalsContact O-CB 3.31Å; R34-S38 WeakPolarHBondContact O-CB 3.21Å; R34-S38 PolarHBondContact O-N 3.29Å; R34-S38 PolarHBondContact O-OG 3.39Å |
| 35 | A | 58.9 | Low | 56.5 | Low | 32 Ų | 32 | 96.2 Ų | 96.2 | 26% | 0.264 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65.1 | -44.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | F31 W32 S38 S39 | F31-A35 HydrophobicContact CE1-CB 4.49Å; F31-A35 VanDerWaalsContact O-CB 3.29Å; F31-A35 WeakPolarHBondContact O-CB 3.34Å; F31-A35 PolarHBondContact O-N 2.85Å; W32-A35 PolarHBondContact O-N 2.87Å; A35-S38 PolarHBondContact O-N 3.42Å; A35-S39 WeakPolarHBondContact O-CB 3.25Å; A35-S39 PolarHBondContact O-N 3.38Å; A35-S39 PolarHBondContact O-OG 2.92Å |
| 36 | L | 58.6 | Low | 57.7 | Low | 98 Ų | 98 | 92.1 Ų | 92.1 | 51% | 0.513 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.9 | -40.4 | 175.2 | -69.7 | 171.4 | 0 | 0 | 0 | 111.8 | W32 S39 G40 | W32-L36 VanDerWaalsContact O-CB 3.24Å; W32-L36 WeakPolarHBondContact O-CB 3.21Å; W32-L36 WeakPolarHBondContact O-CG 3.37Å; W32-L36 PolarHBondContact O-N 3.28Å; L36-S39 PolarHBondContact O-N 3.15Å; L36-G40 PolarHBondContact O-N 3.2Å |
| 37 | G | 61 | Low | 59.2 | Low | 36 Ų | 36 | 93 Ų | 93 | 37% | 0.371 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62.6 | -45.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | S33 R34 G40 I41 | S33-G37 PolarHBondContact O-N 3.09Å; R34-G37 PolarHBondContact O-N 2.78Å; G37-G40 PolarHBondContact O-N 3.18Å; G37-I41 VanDerWaalsContact O-CG1 3.31Å; G37-I41 WeakPolarHBondContact O-CG1 3.27Å; G37-I41 PolarHBondContact O-N 3.42Å |
| 38 | S | 60.9 | Low | 60.5 | Low | 77 Ų | 77 | 89.6 Ų | 89.6 | 54% | 0.538 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -64.4 | -40.1 | 175.1 | -66.7 | 0 | 0 | 0 | 0 | 112.2 | R34 A35 I41 F42 | R34-S38 VanDerWaalsContact O-CB 3.31Å; R34-S38 WeakPolarHBondContact O-CB 3.21Å; R34-S38 PolarHBondContact O-N 3.29Å; R34-S38 PolarHBondContact O-OG 3.39Å; A35-S38 PolarHBondContact O-N 3.42Å; S38-I41 PolarHBondContact O-N 2.9Å; S38-F42 WeakPolarHBondContact O-CB 3.36Å; S38-F42 PolarHBondContact O-N 3.31Å |
| 39 | S | 61.3 | Low | 61.9 | Low | 69 Ų | 69 | 88.2 Ų | 88.2 | 48% | 0.483 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.6 | -39.4 | 173.4 | -65.4 | 0 | 0 | 0 | 0 | 111.7 | A35 L36 F42 C43 | A35-S39 WeakPolarHBondContact O-CB 3.25Å; A35-S39 PolarHBondContact O-N 3.38Å; A35-S39 PolarHBondContact O-OG 2.92Å; L36-S39 PolarHBondContact O-N 3.15Å; S39-F42 PolarHBondContact O-N 3.26Å; S39-C43 WeakPolarHBondContact O-CB 3.32Å; S39-C43 PolarHBondContact O-N 2.8Å; S39-C43 PolarHBondContact O-SG 3.41Å |
| 40 | G | 63.3 | Low | 62.9 | Low | 34 Ų | 34 | 86.1 Ų | 86.1 | 35% | 0.351 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -61.9 | -47 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | L36 G37 F42 C43 T44 | L36-G40 PolarHBondContact O-N 3.2Å; G37-G40 PolarHBondContact O-N 3.18Å; G40-F42 PolarHBondContact O-N 3.18Å; G40-C43 WeakPolarHBondContact O-CB 3.41Å; G40-C43 PolarHBondContact O-N 3.44Å; G40-C43 VanDerWaalsContact O-N 3.13Å; G40-T44 PolarHBondContact O-N 2.85Å; G40-T44 PolarHBondContact O-OG1 2.99Å; G40-T44 VanDerWaalsContact O-OG1 3.1Å |
| 41 | I | 67.8 | Low | 63.9 | Low | 109 Ų | 109 | 86.2 Ų | 86.2 | 56% | 0.559 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -60.7 | -45.3 | 175.3 | -67.3 | 163.6 | 0 | 0 | 0 | 110.8 | G37 S38 C43 T44 L45 | G37-I41 VanDerWaalsContact O-CG1 3.31Å; G37-I41 WeakPolarHBondContact O-CG1 3.27Å; G37-I41 PolarHBondContact O-N 3.42Å; S38-I41 PolarHBondContact O-N 2.9Å; I41-C43 PolarHBondContact O-N 2.9Å; I41-T44 PolarHBondContact O-N 2.94Å; I41-L45 HydrophobicContact CG2-CD1 3.99Å; I41-L45 HydrophobicContact CG2-CG 4.33Å; I41-L45 WeakPolarHBondContact O-CB 3.38Å; I41-L45 VanDerWaalsContact O-CG 3.29Å; I41-L45 WeakPolarHBondContact O-CG 3.49Å; I41-L45 PolarHBondContact O-N 3.15Å |
| 42 | F | 66.6 | Low | 64.7 | Low | 104 Ų | 104 | 83 Ų | 83 | 46% | 0.456 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -56.4 | -42.8 | 175.3 | 177.9 | -97.6 | 0 | 0 | 0 | 110.9 | L6 S38 S39 G40 L45 V46 | L6-F42 HydrophobicContact CD2-CZ 4.34Å; S38-F42 WeakPolarHBondContact O-CB 3.36Å; S38-F42 PolarHBondContact O-N 3.31Å; S39-F42 PolarHBondContact O-N 3.26Å; G40-F42 PolarHBondContact O-N 3.18Å; F42-L45 PolarHBondContact O-N 3.19Å; F42-V46 HydrophobicContact CD1-CG2 4.19Å; F42-V46 HydrophobicContact CE1-CG2 3.78Å; F42-V46 HydrophobicContact CE2-CG2 4.27Å; F42-V46 HydrophobicContact CZ-CG2 3.83Å; F42-V46 VanDerWaalsContact O-CG2 3.29Å; F42-V46 WeakPolarHBondContact O-CG2 3.4Å; F42-V46 PolarHBondContact O-N 3.4Å |
| 43 | C | 65.8 | Low | 65.5 | Low | 23 Ų | 23 | 77.9 Ų | 77.9 | 16% | 0.155 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -67.4 | -42.8 | 178.2 | -72.8 | 0 | 0 | 0 | 0 | 114.2 | C10 S39 G40 I41 L45 V46 E47 | C10-C43 WeakPolarHBondContact CA-SG 3.46Å; C10-C43 HydrophobicContact CB-CB 3.38Å; C10-C43 WeakPolarHBondContact CB-SG 3.17Å; C10-C43 WeakPolarHBondContact SG-CA 3.29Å; C10-C43 WeakPolarHBondContact SG-CB 3.42Å; C10-C43 CovalentContact SG-SG 2.03Å; C10-C43 PolarHBondContact SG-SG 3.34Å; S39-C43 WeakPolarHBondContact O-CB 3.32Å; S39-C43 PolarHBondContact O-N 2.8Å; S39-C43 PolarHBondContact O-SG 3.41Å; G40-C43 WeakPolarHBondContact O-CB 3.41Å; G40-C43 PolarHBondContact O-N 3.44Å; G40-C43 VanDerWaalsContact O-N 3.13Å; I41-C43 PolarHBondContact O-N 2.9Å; C43-L45 VanDerWaalsContact C-N 3.31Å; C43-L45 PolarHBondContact O-N 2.03Å; C43-V46 PolarHBondContact O-N 3.1Å; C43-E47 WeakPolarHBondContact O-CB 3.42Å; C43-E47 PolarHBondContact O-N 3.44Å |
| 44 | T | 66.9 | Low | 66.3 | Low | 75 Ų | 75 | 79.6 Ų | 79.6 | 46% | 0.46 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -60.3 | -41.9 | 172 | -56.2 | 0 | 0 | 0 | 0 | 111.3 | G40 I41 E47 I48 | G40-T44 PolarHBondContact O-N 2.85Å; G40-T44 PolarHBondContact O-OG1 2.99Å; G40-T44 VanDerWaalsContact O-OG1 3.1Å; I41-T44 PolarHBondContact O-N 2.94Å; T44-E47 PolarHBondContact O-N 3.39Å; T44-I48 HydrophobicContact CG2-CD1 3.72Å; T44-I48 HydrophobicContact CG2-CG1 4.34Å; T44-I48 WeakPolarHBondContact O-CB 3.29Å; T44-I48 WeakPolarHBondContact O-CG1 3.36Å; T44-I48 PolarHBondContact O-N 2.96Å |
| 45 | L | 69.3 | Low | 67 | Low | 107 Ų | 107 | 78.1 Ų | 78.1 | 56% | 0.56 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -63.6 | -42.1 | 176.7 | -73 | 171.6 | 0 | 0 | 0 | 112 | I41 F42 C43 A49 | I41-L45 HydrophobicContact CG2-CD1 3.99Å; I41-L45 HydrophobicContact CG2-CG 4.33Å; I41-L45 WeakPolarHBondContact O-CB 3.38Å; I41-L45 VanDerWaalsContact O-CG 3.29Å; I41-L45 WeakPolarHBondContact O-CG 3.49Å; I41-L45 PolarHBondContact O-N 3.15Å; F42-L45 PolarHBondContact O-N 3.19Å; C43-L45 VanDerWaalsContact C-N 3.31Å; C43-L45 PolarHBondContact O-N 2.03Å; L45-A49 WeakPolarHBondContact O-CB 3.39Å; L45-A49 PolarHBondContact O-N 3.14Å |
| 46 | V | 70 | Confident | 67.4 | Low | 23 Ų | 23 | 83.8 Ų | 83.8 | 14% | 0.139 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -65.1 | -42.3 | 176.4 | 169.1 | 0 | 0 | 0 | 0 | 111 | L6 I7 F42 C43 A49 N50 | L6-V46 HydrophobicContact CB-CG1 4.33Å; I7-V46 HydrophobicContact CB-CG1 4.46Å; I7-V46 HydrophobicContact CG1-CG1 3.58Å; F42-V46 HydrophobicContact CD1-CG2 4.19Å; F42-V46 HydrophobicContact CE1-CG2 3.78Å; F42-V46 HydrophobicContact CE2-CG2 4.27Å; F42-V46 HydrophobicContact CZ-CG2 3.83Å; F42-V46 VanDerWaalsContact O-CG2 3.29Å; F42-V46 WeakPolarHBondContact O-CG2 3.4Å; F42-V46 PolarHBondContact O-N 3.4Å; C43-V46 PolarHBondContact O-N 3.1Å; V46-A49 PolarHBondContact O-N 3.31Å; V46-N50 WeakPolarHBondContact O-CB 3.31Å; V46-N50 PolarHBondContact O-N 3.41Å |
| 47 | E | 70.9 | Confident | 67.5 | Low | 126 Ų | 126 | 88 Ų | 88 | 59% | 0.589 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -64.7 | -47.8 | 177.3 | -171.9 | 172.3 | 176.8 | 0 | 0 | 111.6 | C43 T44 A49 N50 V51 | C43-E47 WeakPolarHBondContact O-CB 3.42Å; C43-E47 PolarHBondContact O-N 3.44Å; T44-E47 PolarHBondContact O-N 3.39Å; E47-A49 VanDerWaalsContact C-N 3.33Å; E47-A49 PolarHBondContact O-N 3.49Å; E47-N50 PolarHBondContact O-N 3.42Å; E47-N50 VanDerWaalsContact O-N 3.15Å; E47-V51 WeakPolarHBondContact O-CG2 2.89Å; E47-V51 PolarHBondContact O-N 3.24Å |
| 48 | I | 73.7 | Confident | 67 | Low | 85 Ų | 85 | 87.8 Ų | 87.8 | 44% | 0.436 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -59 | -45.6 | 174.1 | -69.7 | 169.2 | 0 | 0 | 0 | 110.4 | T44 N50 V51 I52 | T44-I48 HydrophobicContact CG2-CD1 3.72Å; T44-I48 HydrophobicContact CG2-CG1 4.34Å; T44-I48 WeakPolarHBondContact O-CB 3.29Å; T44-I48 WeakPolarHBondContact O-CG1 3.36Å; T44-I48 PolarHBondContact O-N 2.96Å; I48-N50 VanDerWaalsContact C-N 3.26Å; I48-N50 PolarHBondContact O-N 3.34Å; I48-V51 PolarHBondContact O-N 3.36Å; I48-I52 HydrophobicContact CG2-CD1 3.55Å; I48-I52 HydrophobicContact CG2-CG1 4.22Å; I48-I52 WeakPolarHBondContact O-CB 3.22Å; I48-I52 WeakPolarHBondContact O-CG1 2.93Å; I48-I52 PolarHBondContact O-N 3.31Å |
| 49 | A | 72 | Confident | 66.4 | Low | 44 Ų | 44 | 94 Ų | 94 | 36% | 0.364 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.3 | -35 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | L45 V46 E47 N53 | L45-A49 WeakPolarHBondContact O-CB 3.39Å; L45-A49 PolarHBondContact O-N 3.14Å; V46-A49 PolarHBondContact O-N 3.31Å; E47-A49 VanDerWaalsContact C-N 3.33Å; E47-A49 PolarHBondContact O-N 3.49Å; A49-N53 WeakPolarHBondContact O-CB 3.17Å; A49-N53 PolarHBondContact O-N 2.79Å; A49-N53 PolarHBondContact O-ND2 2.78Å |
| 50 | N | 69.1 | Low | 65.6 | Low | 66 Ų | 66 | 97.7 Ų | 97.7 | 35% | 0.353 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -72.1 | -42 | 175.7 | -170.1 | 58.5 | 0 | 0 | 0 | 112 | I7 V46 E47 I48 N53 N54 | I7-N50 HydrophobicContact CD1-CB 3.94Å; V46-N50 WeakPolarHBondContact O-CB 3.31Å; V46-N50 PolarHBondContact O-N 3.41Å; E47-N50 PolarHBondContact O-N 3.42Å; E47-N50 VanDerWaalsContact O-N 3.15Å; I48-N50 VanDerWaalsContact C-N 3.26Å; I48-N50 PolarHBondContact O-N 3.34Å; N50-N53 PolarHBondContact O-N 3.28Å; N50-N54 WeakPolarHBondContact O-CB 3.37Å; N50-N54 PolarHBondContact O-N 3Å |
| 51 | V | 72.5 | Confident | 65.7 | Low | 92 Ų | 92 | 100.9 Ų | 100.9 | 56% | 0.558 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -60.6 | -45.8 | 173.3 | 171.7 | 0 | 0 | 0 | 0 | 110.6 | E47 I48 N54 F55 | E47-V51 WeakPolarHBondContact O-CG2 2.89Å; E47-V51 PolarHBondContact O-N 3.24Å; I48-V51 PolarHBondContact O-N 3.36Å; V51-N54 PolarHBondContact O-N 3.39Å; V51-F55 WeakPolarHBondContact O-CB 3.31Å; V51-F55 PolarHBondContact O-N 3.33Å |
| 52 | I | 72.7 | Confident | 65.6 | Low | 80 Ų | 80 | 100.4 Ų | 100.4 | 41% | 0.41 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.4 | -46.8 | 176.4 | -71 | 172.7 | 0 | 0 | 0 | 110.7 | I48 N54 F55 F56 | I48-I52 HydrophobicContact CG2-CD1 3.55Å; I48-I52 HydrophobicContact CG2-CG1 4.22Å; I48-I52 WeakPolarHBondContact O-CB 3.22Å; I48-I52 WeakPolarHBondContact O-CG1 2.93Å; I48-I52 PolarHBondContact O-N 3.31Å; I52-N54 VanDerWaalsContact C-N 3.3Å; I52-N54 PolarHBondContact O-N 2.85Å; I52-F55 WeakPolarHBondContact O-CB 3.33Å; I52-F55 PolarHBondContact O-N 3.47Å; I52-F55 VanDerWaalsContact O-N 3.12Å; I52-F56 HydrophobicContact CG2-CD2 3.55Å; I52-F56 HydrophobicContact CG2-CE2 3.65Å; I52-F56 VanDerWaalsContact O-CD2 3.25Å; I52-F56 WeakPolarHBondContact O-CD2 3.34Å; I52-F56 PolarHBondContact O-N 3.14Å |
| 53 | N | 65.7 | Low | 65.5 | Low | 82 Ų | 82 | 100.2 Ų | 100.2 | 44% | 0.439 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.9 | -39.3 | 176.2 | -93.3 | -86.5 | 0 | 0 | 0 | 111.8 | A49 N50 F55 F56 Y57 | A49-N53 WeakPolarHBondContact O-CB 3.17Å; A49-N53 PolarHBondContact O-N 2.79Å; A49-N53 PolarHBondContact O-ND2 2.78Å; N50-N53 PolarHBondContact O-N 3.28Å; N53-F55 VanDerWaalsContact C-N 3.31Å; N53-F56 PolarHBondContact O-N 2.88Å; N53-Y57 HydrophobicContact CB-CD2 4.45Å; N53-Y57 WeakPolarHBondContact O-CA 3.18Å; N53-Y57 VanDerWaalsContact O-CB 3.27Å; N53-Y57 WeakPolarHBondContact O-CB 3.24Å; N53-Y57 PolarHBondContact O-N 3.38Å; N53-Y57 WeakPolarHBondContact OD1-CD2 3.29Å |
| 54 | N | 69 | Low | 65.5 | Low | 111 Ų | 111 | 104.8 Ų | 104.8 | 59% | 0.594 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -67.1 | -34.2 | 175 | -160.6 | -89.4 | 0 | 0 | 0 | 111.4 | N50 V51 I52 G58 | N50-N54 WeakPolarHBondContact O-CB 3.37Å; N50-N54 PolarHBondContact O-N 3Å; V51-N54 PolarHBondContact O-N 3.39Å; I52-N54 VanDerWaalsContact C-N 3.3Å; I52-N54 PolarHBondContact O-N 2.85Å; N54-G58 WeakPolarHBondContact O-CA 3.44Å; N54-G58 PolarHBondContact O-N 3.47Å |
| 55 | F | 71.8 | Confident | 65.4 | Low | 168 Ų | 168 | 106.6 Ų | 106.6 | 74% | 0.737 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -68.8 | -40.1 | 175 | -170.5 | -96.3 | 0 | 0 | 0 | 113 | V51 I52 N53 | V51-F55 WeakPolarHBondContact O-CB 3.31Å; V51-F55 PolarHBondContact O-N 3.33Å; I52-F55 WeakPolarHBondContact O-CB 3.33Å; I52-F55 PolarHBondContact O-N 3.47Å; I52-F55 VanDerWaalsContact O-N 3.12Å; N53-F55 VanDerWaalsContact C-N 3.31Å |
| 56 | F | 66 | Low | 65.2 | Low | 150 Ų | 150 | 106.6 Ų | 106.6 | 66% | 0.658 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -85.6 | -33.5 | -179 | -76.9 | -71.6 | 0 | 0 | 0 | 114.1 | I52 N53 | I52-F56 HydrophobicContact CG2-CD2 3.55Å; I52-F56 HydrophobicContact CG2-CE2 3.65Å; I52-F56 VanDerWaalsContact O-CD2 3.25Å; I52-F56 WeakPolarHBondContact O-CD2 3.34Å; I52-F56 PolarHBondContact O-N 3.14Å; N53-F56 PolarHBondContact O-N 2.88Å |
| 57 | Y | 61.1 | Low | 64.8 | Low | 188 Ų | 188 | 112.6 Ų | 112.6 | 74% | 0.737 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -117.7 | -12.3 | -173.4 | -61 | -80.1 | 0 | 0 | 0 | 113.9 | N53 K59 | N53-Y57 HydrophobicContact CB-CD2 4.45Å; N53-Y57 WeakPolarHBondContact O-CA 3.18Å; N53-Y57 VanDerWaalsContact O-CB 3.27Å; N53-Y57 WeakPolarHBondContact O-CB 3.24Å; N53-Y57 PolarHBondContact O-N 3.38Å; N53-Y57 WeakPolarHBondContact OD1-CD2 3.29Å; Y57-K59 PolarHBondContact O-N 2.93Å |
| 58 | G | 49.9 | Very low | 64.4 | Low | 31 Ų | 31 | 111.5 Ų | 111.5 | 32% | 0.32 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -80.7 | 103.7 | 170 | 0 | 0 | 0 | 0 | 0 | 109.1 | N54 G60 | N54-G58 WeakPolarHBondContact O-CA 3.44Å; N54-G58 PolarHBondContact O-N 3.47Å; G58-G60 PolarHBondContact O-N 2.78Å; G58-G60 VanDerWaalsContact O-N 3.08Å |
| 59 | K | 49.3 | Very low | 63.6 | Low | 206 Ų | 206 | 113.8 Ų | 113.8 | 90% | 0.896 | 63% | 0.632 | S | S | * | * | trans | -44.6 | 112.6 | 166.9 | -69.6 | 173.8 | 169.3 | 161.1 | 0 | 110.2 | Y57 | Y57-K59 PolarHBondContact O-N 2.93Š| ||
| 60 | G | 43.9 | Very low | 62.8 | Low | 147 Ų | 147 | 120.1 Ų | 120.1 | 100% | 1.515 | 66% | 0.656 | S | S | * | * | trans | -62.1 | 0 | 140.1 | 0 | 0 | 0 | 0 | 0 | 110 | G58 | G58-G60 PolarHBondContact O-N 2.78Å; G58-G60 VanDerWaalsContact O-N 3.08Å |
Retrieved 60 of 60 residues in 70.3 ms
(Link to these results)