| 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 | 73.1 | Confident | 92.6 | Very high | 184 Ų | 184 | 115.6 Ų | 115.6 | 91% | 0.906 | 63% | 0.628 | S | S | * | * | 0 | -34.4 | 0 | -166.4 | 147.6 | -79.6 | 0 | 0 | 112.3 | Y3 F4 L5 | M1-Y3 VanDerWaalsContact C-N 3.29Å; M1-Y3 PolarHBondContact O-N 2.88Å; M1-F4 PolarHBondContact O-N 3.03Å; M1-L5 HydrophobicContact CG-CD1 4.24Å; M1-L5 HydrophobicContact CG-CG 4.26Å; M1-L5 PolarHBondContact O-N 3.47Å; M1-L5 VanDerWaalsContact O-N 3.12Å | |||
| 2 | E | 91.1 | Very high | 92.7 | Very high | 159 Ų | 159 | 109.7 Ų | 109.7 | 74% | 0.743 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -50 | -40.7 | 175.5 | -169.7 | 176.7 | -176.9 | 0 | 0 | 114.8 | F4 L5 T6 | E2-F4 PolarHBondContact O-N 2.95Å; E2-L5 PolarHBondContact O-N 3.14Å; E2-T6 WeakPolarHBondContact O-CB 3.35Å; E2-T6 PolarHBondContact O-N 3.42Å; E2-T6 PolarHBondContact O-OG1 3.34Å |
| 3 | Y | 93.7 | Very high | 92.9 | Very high | 181 Ų | 181 | 108.2 Ų | 108.2 | 71% | 0.71 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -53.4 | -53.1 | 172.5 | 169.2 | -100.1 | 0 | 0 | 0 | 112.5 | M1 L5 T6 A7 | M1-Y3 VanDerWaalsContact C-N 3.29Å; M1-Y3 PolarHBondContact O-N 2.88Å; Y3-L5 PolarHBondContact O-N 2.86Å; Y3-T6 PolarHBondContact O-N 3.18Å; Y3-A7 PolarHBondContact O-N 3.15Å; Y3-A7 VanDerWaalsContact O-N 3.08Å |
| 4 | F | 95.5 | Very high | 93.1 | Very high | 140 Ų | 140 | 110.5 Ų | 110.5 | 61% | 0.614 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -64.4 | -41.5 | -179.3 | -86 | -74.2 | 0 | 0 | 0 | 111.7 | M1 E2 A7 L8 | M1-F4 PolarHBondContact O-N 3.03Å; E2-F4 PolarHBondContact O-N 2.95Å; F4-A7 PolarHBondContact O-N 3.02Å; F4-L8 WeakPolarHBondContact O-CB 3.33Å; F4-L8 VanDerWaalsContact O-CG 3.23Å; F4-L8 WeakPolarHBondContact O-CG 3.25Å; F4-L8 PolarHBondContact O-N 3.41Å |
| 5 | L | 95.3 | Very high | 93.2 | Very high | 91 Ų | 91 | 112.7 Ų | 112.7 | 48% | 0.476 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -65.2 | -40.4 | 179.5 | -65.2 | 176.2 | 0 | 0 | 0 | 112.2 | M1 E2 Y3 L8 N9 | M1-L5 HydrophobicContact CG-CD1 4.24Å; M1-L5 HydrophobicContact CG-CG 4.26Å; M1-L5 PolarHBondContact O-N 3.47Å; M1-L5 VanDerWaalsContact O-N 3.12Å; E2-L5 PolarHBondContact O-N 3.14Å; Y3-L5 PolarHBondContact O-N 2.86Å; L5-L8 PolarHBondContact O-N 3.29Å; L5-N9 WeakPolarHBondContact O-CB 3.35Å; L5-N9 VanDerWaalsContact O-CG 3.23Å; L5-N9 PolarHBondContact O-N 3.3Å; L5-N9 PolarHBondContact O-ND2 3.08Å |
| 6 | T | 96.6 | Very high | 93.3 | Very high | 83 Ų | 83 | 110.8 Ų | 110.8 | 51% | 0.509 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -62.8 | -44.8 | 175.7 | -55.6 | 0 | 0 | 0 | 0 | 111.2 | E2 Y3 N9 S10 | E2-T6 WeakPolarHBondContact O-CB 3.35Å; E2-T6 PolarHBondContact O-N 3.42Å; E2-T6 PolarHBondContact O-OG1 3.34Å; Y3-T6 PolarHBondContact O-N 3.18Å; T6-N9 PolarHBondContact O-N 2.84Å; T6-S10 PolarHBondContact O-N 3.27Å; T6-S10 VanDerWaalsContact O-N 3.1Å; T6-S10 PolarHBondContact O-OG 3.36Å |
| 7 | A | 95.1 | Very high | 93.5 | Very high | 49 Ų | 49 | 109.2 Ų | 109.2 | 41% | 0.405 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -62.5 | -42.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y3 F4 S10 | Y3-A7 PolarHBondContact O-N 3.15Å; Y3-A7 VanDerWaalsContact O-N 3.08Å; F4-A7 PolarHBondContact O-N 3.02Å; A7-S10 PolarHBondContact O-N 3.48Å |
| 8 | L | 95.7 | Very high | 93.7 | Very high | 80 Ų | 80 | 111.7 Ų | 111.7 | 42% | 0.419 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -65.5 | -42.2 | 177.6 | -70.3 | 171.1 | 0 | 0 | 0 | 112.1 | F4 L5 S10 G11 A12 | F4-L8 WeakPolarHBondContact O-CB 3.33Å; F4-L8 VanDerWaalsContact O-CG 3.23Å; F4-L8 WeakPolarHBondContact O-CG 3.25Å; F4-L8 PolarHBondContact O-N 3.41Å; L5-L8 PolarHBondContact O-N 3.29Å; L8-S10 PolarHBondContact O-N 2.81Å; L8-G11 PolarHBondContact O-N 3.17Å; L8-A12 HydrophobicContact CD2-CB 3.8Å; L8-A12 PolarHBondContact O-N 2.94Å; L8-A12 VanDerWaalsContact O-N 3.15Å |
| 9 | N | 94.8 | Very high | 93.9 | Very high | 140 Ų | 140 | 111 Ų | 111 | 75% | 0.749 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -68.8 | -16.7 | 177.3 | -73.3 | -24 | 0 | 0 | 0 | 113.7 | L5 T6 G11 | L5-N9 WeakPolarHBondContact O-CB 3.35Å; L5-N9 VanDerWaalsContact O-CG 3.23Å; L5-N9 PolarHBondContact O-N 3.3Å; L5-N9 PolarHBondContact O-ND2 3.08Å; T6-N9 PolarHBondContact O-N 2.84Å; N9-G11 PolarHBondContact O-N 3.36Å; N9-G11 VanDerWaalsContact O-N 3.12Å |
| 10 | S | 94.6 | Very high | 94 | Very high | 99 Ų | 99 | 111.9 Ų | 111.9 | 69% | 0.692 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | 15.3 | 176.2 | -58.2 | 0 | 0 | 0 | 0 | 113.2 | T6 A7 L8 | T6-S10 PolarHBondContact O-N 3.27Å; T6-S10 VanDerWaalsContact O-N 3.1Å; T6-S10 PolarHBondContact O-OG 3.36Å; A7-S10 PolarHBondContact O-N 3.48Å; L8-S10 PolarHBondContact O-N 2.81Å |
| 11 | G | 92.8 | Very high | 94.2 | Very high | 66 Ų | 66 | 109 Ų | 109 | 68% | 0.68 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 97.6 | 32.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | L8 N9 | L8-G11 PolarHBondContact O-N 3.17Å; N9-G11 PolarHBondContact O-N 3.36Å; N9-G11 VanDerWaalsContact O-N 3.12Å |
| 12 | A | 94.4 | Very high | 95.3 | Very high | 44 Ų | 44 | 105.5 Ų | 105.5 | 36% | 0.364 | 65% | 0.649 | S | S | . | * | trans | -63.3 | 130.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | L8 | L8-A12 HydrophobicContact CD2-CB 3.8Å; L8-A12 PolarHBondContact O-N 2.94Å; L8-A12 VanDerWaalsContact O-N 3.15Å | ||
| 13 | P | 95.4 | Very high | 95.6 | Very high | 91 Ų | 91 | 101.8 Ų | 101.8 | 59% | 0.591 | 63% | 0.634 | S | S | * | * | trans | -71.4 | 166.3 | -180 | 30.7 | -35.9 | 0 | 0 | 0 | 111.7 | H15 | P13-H15 PolarHBondContact O-N 3.27Å; P13-H15 VanDerWaalsContact O-N 3.08Å; P13-H15 PolarHBondContact O-ND1 3.12Å | ||
| 14 | P | 95 | Very high | 95.8 | Very high | 140 Ų | 140 | 100.6 Ų | 100.6 | 91% | 0.909 | 63% | 0.628 | S | S | * | * | trans | -59.2 | 115.7 | 167 | 25.9 | -33.5 | 0 | 0 | 0 | 109.3 | ||||
| 15 | H | 94.7 | Very high | 95.9 | Very high | 143 Ų | 143 | 96.8 Ų | 96.8 | 66% | 0.662 | 61% | 0.614 | S | S | * | * | trans | -133.5 | 149.2 | -177.3 | 61.4 | -69.3 | 0 | 0 | 0 | 110.2 | P13 | P13-H15 PolarHBondContact O-N 3.27Å; P13-H15 VanDerWaalsContact O-N 3.08Å; P13-H15 PolarHBondContact O-ND1 3.12Å | ||
| 16 | G | 95.5 | Very high | 96 | Very high | 82 Ų | 82 | 95.6 Ų | 95.6 | 85% | 0.845 | 61% | 0.607 | S | S | * | * | trans | -143.6 | 146 | 174.4 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 17 | G | 95.9 | Very high | 96.1 | Very high | 84 Ų | 84 | 91.9 Ų | 91.9 | 87% | 0.866 | 59% | 0.585 | S | S | * | * | trans | -129.1 | 161.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 18 | I | 97.5 | Very high | 96.2 | Very high | 155 Ų | 155 | 95 Ų | 95 | 80% | 0.795 | 59% | 0.594 | S | S | * | * | trans | -132.8 | 142.1 | 171 | -172.1 | 168.5 | 0 | 0 | 0 | 108.8 | L20 | I18-L20 HydrophobicContact CD1-CD2 4.33Å; I18-L20 HydrophobicContact CG1-CD2 4.5Å | ||
| 19 | A | 97.5 | Very high | 96.3 | Very high | 98 Ų | 98 | 98.5 Ų | 98.5 | 81% | 0.81 | 61% | 0.606 | S | S | * | * | trans | -123.1 | 126.8 | 173.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 20 | L | 96.6 | Very high | 96.4 | Very high | 129 Ų | 129 | 96.3 Ų | 96.3 | 68% | 0.675 | 60% | 0.597 | S | S | * | * | trans | -95.4 | 129.8 | 177.9 | -61.4 | 178.7 | 0 | 0 | 0 | 109.7 | I18 L22 | I18-L20 HydrophobicContact CD1-CD2 4.33Å; I18-L20 HydrophobicContact CG1-CD2 4.5Å; L20-L22 PolarHBondContact O-N 2.69Å | ||
| 21 | G | 96.8 | Very high | 96.6 | Very high | 51 Ų | 51 | 98.5 Ų | 98.5 | 53% | 0.526 | 60% | 0.601 | S | S | . | * | trans | -73 | 89.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | D23 R24 L25 | G21-D23 PolarHBondContact O-N 3.43Å; G21-R24 PolarHBondContact O-N 3.18Å; G21-L25 PolarHBondContact O-N 2.75Å | ||
| 22 | L | 97.3 | Very high | 96.8 | Very high | 111 Ų | 111 | 96.7 Ų | 96.7 | 58% | 0.581 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -56.1 | -47.9 | -172.8 | -179.1 | 61.3 | 0 | 0 | 0 | 112.5 | L20 R24 L25 I26 | L20-L22 PolarHBondContact O-N 2.69Å; L22-R24 VanDerWaalsContact C-N 3.26Å; L22-R24 PolarHBondContact O-N 3.39Å; L22-L25 WeakPolarHBondContact O-CB 3.42Å; L22-L25 PolarHBondContact O-N 2.75Å; L22-L25 VanDerWaalsContact O-N 3.1Å; L22-I26 HydrophobicContact CD1-CD1 4.36Å; L22-I26 HydrophobicContact CD1-CG1 4.02Å; L22-I26 HydrophobicContact CG-CG1 4.44Å; L22-I26 WeakPolarHBondContact O-CG1 3.45Å; L22-I26 PolarHBondContact O-N 3.47Å |
| 23 | D | 97.2 | Very high | 96.9 | Very high | 80 Ų | 80 | 104.6 Ų | 104.6 | 43% | 0.428 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -59.3 | -41.4 | -178.8 | -47 | -83.7 | 0 | 0 | 0 | 111.3 | G21 A27 V38 | G21-D23 PolarHBondContact O-N 3.43Å; D23-A27 WeakPolarHBondContact O-CB 3.24Å; D23-A27 PolarHBondContact O-N 2.85Å; D23-V38 WeakPolarHBondContact O-CG2 2.85Å |
| 24 | R | 97.2 | Very high | 96.8 | Very high | 156 Ų | 156 | 102.3 Ų | 102.3 | 59% | 0.589 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.4 | -41.1 | 177.4 | -176.3 | 60.3 | 64.3 | 104.8 | 6.2 | 111.5 | G21 L22 I26 A27 I28 I35 | G21-R24 PolarHBondContact O-N 3.18Å; L22-R24 VanDerWaalsContact C-N 3.26Å; L22-R24 PolarHBondContact O-N 3.39Å; R24-I26 VanDerWaalsContact C-N 3.35Å; R24-A27 PolarHBondContact O-N 3.47Å; R24-I28 HydrophobicContact CG-CD1 4.11Å; R24-I28 WeakPolarHBondContact O-CG1 3.36Å; R24-I28 PolarHBondContact O-N 2.93Å; R24-I35 HydrophobicContact CB-CG2 4.49Å |
| 25 | L | 97.7 | Very high | 96.9 | Very high | 60 Ų | 60 | 98.7 Ų | 98.7 | 31% | 0.314 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -60 | -46.9 | 178.8 | -178 | 64.3 | 0 | 0 | 0 | 110.9 | G21 L22 I28 F29 | G21-L25 PolarHBondContact O-N 2.75Å; L22-L25 WeakPolarHBondContact O-CB 3.42Å; L22-L25 PolarHBondContact O-N 2.75Å; L22-L25 VanDerWaalsContact O-N 3.1Å; L25-I28 PolarHBondContact O-N 3.24Å; L25-F29 HydrophobicContact CD1-CE1 3.97Å; L25-F29 HydrophobicContact CD1-CE2 4.31Å; L25-F29 HydrophobicContact CD1-CZ 3.81Å; L25-F29 HydrophobicContact CG-CE2 4.13Å; L25-F29 HydrophobicContact CG-CZ 4.14Å; L25-F29 PolarHBondContact O-N 3.01Å; L25-F29 VanDerWaalsContact O-N 3.08Å |
| 26 | I | 98 | Very high | 96.9 | Very high | 66 Ų | 66 | 97.5 Ų | 97.5 | 34% | 0.338 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65.9 | -43.5 | 177.9 | -61.8 | -57.9 | 0 | 0 | 0 | 111.2 | L22 R24 I28 F29 V30 V38 | L22-I26 HydrophobicContact CD1-CD1 4.36Å; L22-I26 HydrophobicContact CD1-CG1 4.02Å; L22-I26 HydrophobicContact CG-CG1 4.44Å; L22-I26 WeakPolarHBondContact O-CG1 3.45Å; L22-I26 PolarHBondContact O-N 3.47Å; R24-I26 VanDerWaalsContact C-N 3.35Å; I26-I28 PolarHBondContact O-N 3.32Å; I26-F29 HydrophobicContact CD1-CD2 4.4Å; I26-F29 PolarHBondContact O-N 3.16Å; I26-V30 HydrophobicContact CG2-CG1 4.43Å; I26-V30 WeakPolarHBondContact O-CG2 3.35Å; I26-V30 PolarHBondContact O-N 3.2Å; I26-V38 HydrophobicContact CG2-CB 4.05Å; I26-V38 HydrophobicContact CG2-CG1 3.99Å |
| 27 | A | 98 | Very high | 96.9 | Very high | 6 Ų | 6 | 98.9 Ų | 98.9 | 5% | 0.05 | 54% | 0.542 | C | S | . | . | H | α-helix | trans | -56.3 | -38.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | D23 R24 N31 A32 I35 V38 | D23-A27 WeakPolarHBondContact O-CB 3.24Å; D23-A27 PolarHBondContact O-N 2.85Å; R24-A27 PolarHBondContact O-N 3.47Å; A27-N31 CarbonylContact O-C 3.6Å; A27-N31 WeakPolarHBondContact O-CA 3.43Å; A27-N31 PolarHBondContact O-N 3.1Å; A27-N31 VanDerWaalsContact O-N 3.13Å; A27-A32 HydrophobicContact CB-CB 4.14Å; A27-A32 PolarHBondContact O-N 3.06Å; A27-I35 HydrophobicContact CB-CG2 4.16Å; A27-V38 HydrophobicContact CB-CG1 4.25Å; A27-V38 HydrophobicContact CB-CG2 4.17Å |
| 28 | I | 97.8 | Very high | 96.9 | Very high | 115 Ų | 115 | 96.9 Ų | 96.9 | 59% | 0.59 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -67.3 | -46.5 | 174.6 | -67.1 | 164.6 | 0 | 0 | 0 | 110.9 | R24 L25 I26 V30 N31 | R24-I28 HydrophobicContact CG-CD1 4.11Å; R24-I28 WeakPolarHBondContact O-CG1 3.36Å; R24-I28 PolarHBondContact O-N 2.93Å; L25-I28 PolarHBondContact O-N 3.24Å; I26-I28 PolarHBondContact O-N 3.32Å; I28-V30 VanDerWaalsContact C-N 3.29Å; I28-V30 PolarHBondContact O-N 3.07Å; I28-N31 PolarHBondContact O-N 3.37Å; I28-N31 VanDerWaalsContact O-N 3.15Å |
| 29 | F | 97.8 | Very high | 96.9 | Very high | 153 Ų | 153 | 92.7 Ų | 92.7 | 67% | 0.671 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -61.1 | -35.6 | -178.8 | -75.4 | -7.5 | 0 | 0 | 0 | 113.7 | L25 I26 | L25-F29 HydrophobicContact CD1-CE1 3.97Å; L25-F29 HydrophobicContact CD1-CE2 4.31Å; L25-F29 HydrophobicContact CD1-CZ 3.81Å; L25-F29 HydrophobicContact CG-CE2 4.13Å; L25-F29 HydrophobicContact CG-CZ 4.14Å; L25-F29 PolarHBondContact O-N 3.01Å; L25-F29 VanDerWaalsContact O-N 3.08Å; I26-F29 HydrophobicContact CD1-CD2 4.4Å; I26-F29 PolarHBondContact O-N 3.16Å |
| 30 | V | 97.8 | Very high | 96.8 | Very high | 93 Ų | 93 | 92.4 Ų | 92.4 | 56% | 0.564 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.3 | 4.6 | 179.3 | -51 | 0 | 0 | 0 | 0 | 113.1 | I26 I28 A32 V38 | I26-V30 HydrophobicContact CG2-CG1 4.43Å; I26-V30 WeakPolarHBondContact O-CG2 3.35Å; I26-V30 PolarHBondContact O-N 3.2Å; I28-V30 VanDerWaalsContact C-N 3.29Å; I28-V30 PolarHBondContact O-N 3.07Å; V30-A32 HydrophobicContact CG2-CB 3.78Å; V30-A32 PolarHBondContact O-N 3.01Å; V30-V38 HydrophobicContact CG2-CG1 3.8Å |
| 31 | N | 97.4 | Very high | 96.7 | Very high | 146 Ų | 146 | 93.8 Ų | 93.8 | 78% | 0.781 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.5 | 39.8 | -174.9 | -162.6 | 26.3 | 0 | 0 | 0 | 113.2 | A27 I28 | A27-N31 CarbonylContact O-C 3.6Å; A27-N31 WeakPolarHBondContact O-CA 3.43Å; A27-N31 PolarHBondContact O-N 3.1Å; A27-N31 VanDerWaalsContact O-N 3.13Å; I28-N31 PolarHBondContact O-N 3.37Å; I28-N31 VanDerWaalsContact O-N 3.15Å |
| 32 | A | 97.3 | Very high | 96.6 | Very high | 28 Ų | 28 | 94.9 Ų | 94.9 | 23% | 0.231 | 48% | 0.483 | C | S | . | . | trans | -69.2 | 141.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | A27 V30 S34 D37 V38 | A27-A32 HydrophobicContact CB-CB 4.14Å; A27-A32 PolarHBondContact O-N 3.06Å; V30-A32 HydrophobicContact CG2-CB 3.78Å; V30-A32 PolarHBondContact O-N 3.01Å; A32-S34 VanDerWaalsContact C-N 3.27Å; A32-S34 PolarHBondContact O-N 3.08Å; A32-D37 HydrophobicContact CB-CB 4.16Å; A32-V38 HydrophobicContact CB-CG1 4.02Å | ||
| 33 | K | 95.8 | Very high | 96.5 | Very high | 210 Ų | 210 | 94.8 Ų | 94.8 | 91% | 0.913 | 48% | 0.479 | S | S | * | . | S | Bend | trans | -72.6 | -25.2 | 177.4 | -67.5 | -176.2 | -179.8 | 179.1 | 0 | 112 | ||
| 34 | S | 94.9 | Very high | 96.3 | Very high | 42 Ų | 42 | 92.3 Ų | 92.3 | 29% | 0.294 | 47% | 0.469 | S | S | . | . | trans | -139.3 | 147.3 | 179.6 | -173.8 | 0 | 0 | 0 | 0 | 111.3 | A32 R36 D37 | A32-S34 VanDerWaalsContact C-N 3.27Å; A32-S34 PolarHBondContact O-N 3.08Å; S34-R36 PolarHBondContact O-N 3.13Å; S34-R36 VanDerWaalsContact O-N 3.16Å; S34-R36 WeakPolarHBondContact OG-CB 3.49Å; S34-R36 WeakPolarHBondContact OG-CG 3.3Å; S34-R36 PolarHBondContact OG-N 3.47Å; S34-D37 PolarHBondContact N-OD2 3.29Å; S34-D37 WeakPolarHBondContact O-CB 3.29Å; S34-D37 PolarHBondContact O-N 2.98Å; S34-D37 VanDerWaalsContact O-N 3.08Å | ||
| 35 | I | 96.1 | Very high | 96.1 | Very high | 65 Ų | 65 | 89.3 Ų | 89.3 | 33% | 0.333 | 48% | 0.477 | S | S | . | . | G | 310 helix | trans | -60.9 | -21.1 | 167.9 | 61.4 | 171.8 | 0 | 0 | 0 | 111.9 | R24 A27 D37 V38 I39 | R24-I35 HydrophobicContact CB-CG2 4.49Å; A27-I35 HydrophobicContact CB-CG2 4.16Å; I35-D37 PolarHBondContact O-N 3.19Å; I35-V38 WeakPolarHBondContact O-CG2 3.4Å; I35-V38 PolarHBondContact O-N 2.92Å; I35-I39 WeakPolarHBondContact O-CG1 3.43Å |
| 36 | R | 94.6 | Very high | 95.9 | Very high | 118 Ų | 118 | 91 Ų | 91 | 45% | 0.445 | 49% | 0.487 | S | S | . | . | G | 310 helix | trans | -64.4 | -24.8 | 176.4 | -61.4 | -173.7 | 168.4 | 173 | 1.3 | 112.3 | S34 V38 L42 | S34-R36 PolarHBondContact O-N 3.13Å; S34-R36 VanDerWaalsContact O-N 3.16Å; S34-R36 WeakPolarHBondContact OG-CB 3.49Å; S34-R36 WeakPolarHBondContact OG-CG 3.3Å; S34-R36 PolarHBondContact OG-N 3.47Å; R36-V38 VanDerWaalsContact C-N 3.27Å; R36-V38 PolarHBondContact O-N 3.38Å; R36-L42 HydrophobicContact CB-CD1 3.91Å; R36-L42 HydrophobicContact CB-CD2 4.29Å; R36-L42 VanDerWaalsContact CD-CD1 3.45Å; R36-L42 HydrophobicContact CG-CD1 3.57Å |
| 37 | D | 95.2 | Very high | 95.8 | Very high | 111 Ų | 111 | 89.3 Ų | 89.3 | 59% | 0.594 | 49% | 0.486 | S | S | * | . | G | 310 helix | trans | -82 | -8.3 | -177.2 | -52.1 | -30.1 | 0 | 0 | 0 | 112.3 | A32 S34 I35 | A32-D37 HydrophobicContact CB-CB 4.16Å; S34-D37 PolarHBondContact N-OD2 3.29Å; S34-D37 WeakPolarHBondContact O-CB 3.29Å; S34-D37 PolarHBondContact O-N 2.98Å; S34-D37 VanDerWaalsContact O-N 3.08Å; I35-D37 PolarHBondContact O-N 3.19Å |
| 38 | V | 96.9 | Very high | 95.6 | Very high | 42 Ų | 42 | 93.8 Ų | 93.8 | 26% | 0.255 | 50% | 0.504 | S | S | . | . | G | 310 helix | trans | -112.2 | 5.5 | 178.6 | -57.6 | 0 | 0 | 0 | 0 | 113.2 | D23 I26 A27 V30 A32 I35 R36 | D23-V38 WeakPolarHBondContact O-CG2 2.85Å; I26-V38 HydrophobicContact CG2-CB 4.05Å; I26-V38 HydrophobicContact CG2-CG1 3.99Å; A27-V38 HydrophobicContact CB-CG1 4.25Å; A27-V38 HydrophobicContact CB-CG2 4.17Å; V30-V38 HydrophobicContact CG2-CG1 3.8Å; A32-V38 HydrophobicContact CB-CG1 4.02Å; I35-V38 WeakPolarHBondContact O-CG2 3.4Å; I35-V38 PolarHBondContact O-N 2.92Å; R36-V38 VanDerWaalsContact C-N 3.27Å; R36-V38 PolarHBondContact O-N 3.38Å |
| 39 | I | 96.8 | Very high | 95.5 | Very high | 66 Ų | 66 | 89.5 Ų | 89.5 | 34% | 0.338 | 48% | 0.482 | S | S | . | . | trans | -112.1 | 121.8 | 177.4 | -59.7 | 171.7 | 0 | 0 | 0 | 108 | I35 F41 | I35-I39 WeakPolarHBondContact O-CG1 3.43Å; I39-F41 PolarHBondContact O-N 2.83Å | ||
| 40 | A | 95.8 | Very high | 95.2 | Very high | 93 Ų | 93 | 89 Ų | 89 | 77% | 0.769 | 49% | 0.486 | S | S | * | . | S | Bend | trans | -60.8 | -43.6 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 41 | F | 95.4 | Very high | 95 | Very high | 157 Ų | 157 | 90.8 Ų | 90.8 | 69% | 0.689 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -124.7 | 86.9 | 179.9 | -55.9 | -75 | 0 | 0 | 0 | 109.6 | I39 L51 | I39-F41 PolarHBondContact O-N 2.83Å; F41-L51 HydrophobicContact CD1-CD2 3.87Å; F41-L51 HydrophobicContact CE1-CD2 4Å |
| 42 | L | 93.2 | Very high | 94.9 | Very high | 74 Ų | 74 | 87.8 Ų | 87.8 | 39% | 0.387 | 48% | 0.481 | S | S | . | . | P | Polyproline II helix | trans | -75 | 150.7 | -176.3 | 125.4 | 95.4 | 0 | 0 | 0 | 111.2 | R36 | R36-L42 HydrophobicContact CB-CD1 3.91Å; R36-L42 HydrophobicContact CB-CD2 4.29Å; R36-L42 VanDerWaalsContact CD-CD1 3.45Å; R36-L42 HydrophobicContact CG-CD1 3.57Å |
| 43 | K | 95 | Very high | 94.6 | Very high | 110 Ų | 110 | 88.7 Ų | 88.7 | 48% | 0.478 | 49% | 0.493 | S | S | . | . | P | Polyproline II helix | trans | -96.9 | 140.2 | 167.2 | -64 | 173 | 72.1 | 68.4 | 0 | 111.1 | G47 K48 | K43-G47 WeakPolarHBondContact CE-O 3.45Å; K43-G47 PolarHBondContact NZ-O 2.88Å; K43-K48 CarbonylContact C-O 3.52Å; K43-K48 WeakPolarHBondContact CA-O 3.36Å |
| 44 | A | 93.6 | Very high | 94.6 | Very high | 27 Ų | 27 | 81 Ų | 81 | 22% | 0.223 | 46% | 0.464 | C | S | . | . | P | Polyproline II helix | trans | -57.4 | 166.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | D46 G47 K48 L50 | A44-D46 VanDerWaalsContact CB-OD1 3.28Å; A44-D46 WeakPolarHBondContact CB-OD1 3.28Å; A44-D46 PolarHBondContact O-N 2.93Å; A44-G47 WeakPolarHBondContact O-CA 3.44Å; A44-G47 PolarHBondContact O-N 3.33Å; A44-K48 WeakPolarHBondContact CB-O 3.39Å; A44-K48 PolarHBondContact N-O 2.77Å; A44-L50 HydrophobicContact CB-CD1 4.21Å; A44-L50 HydrophobicContact CB-CG 4.19Å |
| 45 | A | 92.6 | Very high | 94.6 | Very high | 93 Ų | 93 | 83.6 Ų | 83.6 | 77% | 0.769 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61 | -27.3 | -176 | 0 | 0 | 0 | 0 | 0 | 113.5 | G47 | A45-G47 VanDerWaalsContact C-N 3.25Š|
| 46 | D | 94.8 | Very high | 94.5 | Very high | 97 Ų | 97 | 85.2 Ų | 85.2 | 52% | 0.519 | 49% | 0.493 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | 10.7 | 174.1 | 67.8 | -21.6 | 0 | 0 | 0 | 113.1 | A44 K48 | A44-D46 VanDerWaalsContact CB-OD1 3.28Å; A44-D46 WeakPolarHBondContact CB-OD1 3.28Å; A44-D46 PolarHBondContact O-N 2.93Å; D46-K48 VanDerWaalsContact C-N 3.33Å; D46-K48 PolarHBondContact O-N 3.47Å; D46-K48 PolarHBondContact OD1-N 3.25Å; D46-K48 VanDerWaalsContact OD2-CD 3.29Å; D46-K48 WeakPolarHBondContact OD2-CD 3.18Å; D46-K48 VanDerWaalsContact OD2-CE 3.3Å; D46-K48 WeakPolarHBondContact OD2-CE 3.34Å; D46-K48 WeakPolarHBondContact OD2-CG 3.4Å; D46-K48 IonicContact OD2-NZ 2.75Å; D46-K48 PolarHBondContact OD2-NZ 3.1Å |
| 47 | G | 94.5 | Very high | 94.5 | Very high | 30 Ų | 30 | 88 Ų | 88 | 31% | 0.309 | 51% | 0.513 | S | S | . | . | S | Bend | trans | 76 | 16.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | K43 A44 A45 | K43-G47 WeakPolarHBondContact CE-O 3.45Å; K43-G47 PolarHBondContact NZ-O 2.88Å; A44-G47 WeakPolarHBondContact O-CA 3.44Å; A44-G47 PolarHBondContact O-N 3.33Å; A45-G47 VanDerWaalsContact C-N 3.25Å |
| 48 | K | 95.1 | Very high | 94.4 | Very high | 99 Ų | 99 | 86 Ų | 86 | 43% | 0.43 | 51% | 0.505 | S | S | . | . | trans | -91.3 | 144.2 | 175.6 | -60.6 | -170.3 | -175.3 | 123.9 | 0 | 111.9 | K43 A44 D46 L50 T54 | K43-K48 CarbonylContact C-O 3.52Å; K43-K48 WeakPolarHBondContact CA-O 3.36Å; A44-K48 WeakPolarHBondContact CB-O 3.39Å; A44-K48 PolarHBondContact N-O 2.77Å; D46-K48 VanDerWaalsContact C-N 3.33Å; D46-K48 PolarHBondContact O-N 3.47Å; D46-K48 PolarHBondContact OD1-N 3.25Å; D46-K48 VanDerWaalsContact OD2-CD 3.29Å; D46-K48 WeakPolarHBondContact OD2-CD 3.18Å; D46-K48 VanDerWaalsContact OD2-CE 3.3Å; D46-K48 WeakPolarHBondContact OD2-CE 3.34Å; D46-K48 WeakPolarHBondContact OD2-CG 3.4Å; D46-K48 IonicContact OD2-NZ 2.75Å; D46-K48 PolarHBondContact OD2-NZ 3.1Å; K48-L50 HydrophobicContact CB-CD2 4.48Å; K48-T54 CarbonylContact C-O 3.5Å; K48-T54 VanDerWaalsContact CA-O 3.24Å; K48-T54 WeakPolarHBondContact CA-O 3.33Å; K48-T54 WeakPolarHBondContact CB-O 3.47Å | ||
| 49 | D | 95.5 | Very high | 94.3 | Very high | 26 Ų | 26 | 89.7 Ų | 89.7 | 14% | 0.139 | 52% | 0.523 | C | S | . | . | B | Isolated β-bridge | trans | -91.6 | 110.6 | 162.6 | 177.7 | 1.7 | 0 | 0 | 0 | 108 | L51 C52 G53 T54 | D49-L51 VanDerWaalsContact C-N 3.31Å; D49-L51 WeakPolarHBondContact OD1-CB 3.41Å; D49-L51 PolarHBondContact OD1-N 3.4Å; D49-C52 PolarHBondContact OD1-N 3.36Å; D49-C52 WeakPolarHBondContact OD2-CB 3.45Å; D49-C52 PolarHBondContact OD2-SG 3.08Å; D49-G53 WeakPolarHBondContact O-CA 3.49Å; D49-G53 PolarHBondContact O-N 3.4Å; D49-T54 WeakPolarHBondContact CB-OG1 3.33Å; D49-T54 PolarHBondContact N-O 2.9Å; D49-T54 PolarHBondContact O-N 3.27Å |
| 50 | L | 91.6 | Very high | 94.2 | Very high | 141 Ų | 141 | 92.9 Ų | 92.9 | 74% | 0.738 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.6 | -22.3 | -178.3 | -59.9 | 177.3 | 0 | 0 | 0 | 112.7 | A44 K48 | A44-L50 HydrophobicContact CB-CD1 4.21Å; A44-L50 HydrophobicContact CB-CG 4.19Å; K48-L50 HydrophobicContact CB-CD2 4.48Å |
| 51 | L | 93.5 | Very high | 94.2 | Very high | 132 Ų | 132 | 95.7 Ų | 95.7 | 69% | 0.691 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.1 | -47.2 | 178.6 | 179.8 | 66.4 | 0 | 0 | 0 | 110.5 | F41 D49 | F41-L51 HydrophobicContact CD1-CD2 3.87Å; F41-L51 HydrophobicContact CE1-CD2 4Å; D49-L51 VanDerWaalsContact C-N 3.31Å; D49-L51 WeakPolarHBondContact OD1-CB 3.41Å; D49-L51 PolarHBondContact OD1-N 3.4Å |
| 52 | C | 94.1 | Very high | 94.2 | Very high | 82 Ų | 82 | 92.8 Ų | 92.8 | 55% | 0.554 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.4 | -7.8 | -178.3 | -57 | 0 | 0 | 0 | 0 | 113.5 | D49 T54 | D49-C52 PolarHBondContact OD1-N 3.36Å; D49-C52 WeakPolarHBondContact OD2-CB 3.45Å; D49-C52 PolarHBondContact OD2-SG 3.08Å; C52-T54 HydrophobicContact CB-CG2 3.82Å |
| 53 | G | 92.7 | Very high | 94.3 | Very high | 48 Ų | 48 | 94.5 Ų | 94.5 | 50% | 0.495 | 54% | 0.538 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 67.6 | 34 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | D49 T56 | D49-G53 WeakPolarHBondContact O-CA 3.49Å; D49-G53 PolarHBondContact O-N 3.4Å; G53-T56 VanDerWaalsContact O-CG2 3.25Å; G53-T56 WeakPolarHBondContact O-CG2 3.23Å |
| 54 | T | 94.9 | Very high | 94.1 | Very high | 49 Ų | 49 | 93.9 Ų | 93.9 | 30% | 0.301 | 55% | 0.547 | S | S | . | . | B | Isolated β-bridge | trans | -105.9 | 154.7 | -176.9 | 73.4 | 0 | 0 | 0 | 0 | 112.5 | K48 D49 C52 | K48-T54 CarbonylContact C-O 3.5Å; K48-T54 VanDerWaalsContact CA-O 3.24Å; K48-T54 WeakPolarHBondContact CA-O 3.33Å; K48-T54 WeakPolarHBondContact CB-O 3.47Å; D49-T54 WeakPolarHBondContact CB-OG1 3.33Å; D49-T54 PolarHBondContact N-O 2.9Å; D49-T54 PolarHBondContact O-N 3.27Å; C52-T54 HydrophobicContact CB-CG2 3.82Å |
| 55 | P | 95.4 | Very high | 93.5 | Very high | 96 Ų | 96 | 102.8 Ų | 102.8 | 62% | 0.623 | 58% | 0.584 | S | S | * | * | S | Bend | cis | -69.9 | 152.9 | -2.5 | 31.8 | -34.4 | 0 | 0 | 0 | 112.3 | ||
| 56 | T | 93.5 | Very high | 93.5 | Very high | 99 Ų | 99 | 103.3 Ų | 103.3 | 61% | 0.607 | 58% | 0.575 | S | S | * | * | trans | -111.4 | 161.9 | 173.3 | 57.3 | 0 | 0 | 0 | 0 | 109.9 | G53 | G53-T56 VanDerWaalsContact O-CG2 3.25Å; G53-T56 WeakPolarHBondContact O-CG2 3.23Å | ||
| 57 | M | 93.9 | Very high | 93.4 | Very high | 175 Ų | 175 | 103.6 Ų | 103.6 | 86% | 0.862 | 58% | 0.578 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 142.2 | 168.2 | -66.3 | -60 | -67.2 | 0 | 0 | 109.5 | ||
| 58 | V | 94.4 | Very high | 93.4 | Very high | 70 Ų | 70 | 107.7 Ų | 107.7 | 42% | 0.424 | 59% | 0.593 | S | S | . | * | P | Polyproline II helix | trans | -102.1 | 144.4 | 172.3 | 179.5 | 0 | 0 | 0 | 0 | 107.4 | I62 L63 | V58-I62 HydrophobicContact CG1-CB 3.81Å; V58-I62 HydrophobicContact CG1-CD1 4.2Å; V58-I62 HydrophobicContact CG1-CG2 3.76Å; V58-L63 HydrophobicContact CB-CD2 4.18Å; V58-L63 HydrophobicContact CB-CG 4.31Å; V58-L63 HydrophobicContact CG1-CD2 4.17Å; V58-L63 HydrophobicContact CG1-CG 4.22Å |
| 59 | D | 94.6 | Very high | 93.3 | Very high | 120 Ų | 120 | 108.2 Ų | 108.2 | 64% | 0.642 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -63.6 | 141.9 | 179.6 | -67.2 | -36.7 | 0 | 0 | 0 | 111.9 | E61 I62 L63 | D59-E61 PolarHBondContact O-N 3.12Å; D59-I62 HydrophobicContact CB-CD1 4.49Å; D59-I62 PolarHBondContact O-N 3.12Å; D59-L63 PolarHBondContact O-N 3.3Å; D59-L63 VanDerWaalsContact O-N 3.12Å |
| 60 | D | 95.4 | Very high | 93.1 | Very high | 132 Ų | 132 | 113.4 Ų | 113.4 | 71% | 0.706 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -59.2 | -30.4 | -178.7 | -70.4 | -29.6 | 0 | 0 | 0 | 112.5 | I62 L63 S64 | D60-I62 VanDerWaalsContact C-N 3.35Å; D60-I62 PolarHBondContact O-N 3.39Å; D60-L63 PolarHBondContact O-N 3.37Å; D60-S64 WeakPolarHBondContact O-CB 3.44Å; D60-S64 PolarHBondContact O-N 2.92Å; D60-S64 PolarHBondContact O-OG 3.47Å |
| 61 | E | 95.6 | Very high | 93.2 | Very high | 153 Ų | 153 | 111.5 Ų | 111.5 | 72% | 0.715 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -60.9 | -43.7 | 175.4 | -173.1 | 174.7 | -178.6 | 0 | 0 | 111.4 | D59 S64 | D59-E61 PolarHBondContact O-N 3.12Å; E61-S64 PolarHBondContact O-N 3.05Å; E61-S64 PolarHBondContact O-OG 3.15Å |
| 62 | I | 95.3 | Very high | 93.2 | Very high | 96 Ų | 96 | 110.1 Ų | 110.1 | 49% | 0.492 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -69.8 | -37.6 | 177.1 | -62.3 | 171.7 | 0 | 0 | 0 | 110.4 | V58 D59 D60 S64 Q65 | V58-I62 HydrophobicContact CG1-CB 3.81Å; V58-I62 HydrophobicContact CG1-CD1 4.2Å; V58-I62 HydrophobicContact CG1-CG2 3.76Å; D59-I62 HydrophobicContact CB-CD1 4.49Å; D59-I62 PolarHBondContact O-N 3.12Å; D60-I62 VanDerWaalsContact C-N 3.35Å; D60-I62 PolarHBondContact O-N 3.39Å; I62-S64 PolarHBondContact O-N 3.29Å; I62-Q65 PolarHBondContact O-N 3.08Å |
| 63 | L | 93.8 | Very high | 93.1 | Very high | 109 Ų | 109 | 112.2 Ų | 112.2 | 57% | 0.571 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -69.2 | -21.5 | 178 | -65.4 | 177.2 | 0 | 0 | 0 | 113.2 | V58 D59 D60 | V58-L63 HydrophobicContact CB-CD2 4.18Å; V58-L63 HydrophobicContact CB-CG 4.31Å; V58-L63 HydrophobicContact CG1-CD2 4.17Å; V58-L63 HydrophobicContact CG1-CG 4.22Å; D59-L63 PolarHBondContact O-N 3.3Å; D59-L63 VanDerWaalsContact O-N 3.12Å; D60-L63 PolarHBondContact O-N 3.37Å |
| 64 | S | 92.3 | Very high | 93.2 | Very high | 97 Ų | 97 | 117.6 Ų | 117.6 | 68% | 0.678 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | 0.4 | -179.5 | 72.1 | 0 | 0 | 0 | 0 | 115 | D60 E61 I62 | D60-S64 WeakPolarHBondContact O-CB 3.44Å; D60-S64 PolarHBondContact O-N 2.92Å; D60-S64 PolarHBondContact O-OG 3.47Å; E61-S64 PolarHBondContact O-N 3.05Å; E61-S64 PolarHBondContact O-OG 3.15Å; I62-S64 PolarHBondContact O-N 3.29Å |
| 65 | Q | 79.2 | Confident | 93 | Very high | 215 Ų | 215 | 123.8 Ų | 123.8 | 100% | 1.005 | 67% | 0.666 | S | S | * | * | trans | -82.8 | 0 | 175.5 | -62.5 | -173.5 | -15.8 | 0 | 0 | 112.2 | I62 | I62-Q65 PolarHBondContact O-N 3.08Š|
Retrieved 65 of 65 residues in 50.3 ms
(Link to these results)