| 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 | 40.8 | Very low | 42.3 | Very low | 236 Ų | 236 | 151.9 Ų | 151.9 | 100% | 1.163 | 80% | 0.8 | S | S | * | * | 0 | 99.6 | 0 | -53.6 | 172.7 | -169.3 | 0 | 0 | 106.9 | |||||
| 2 | C | 33.9 | Very low | 42.6 | Very low | 128 Ų | 128 | 159.3 Ų | 159.3 | 87% | 0.865 | 81% | 0.809 | S | S | * | * | trans | -91.9 | 100.3 | 174.1 | -69.2 | 0 | 0 | 0 | 0 | 107.4 | N4 | C2-N4 PolarHBondContact O-N 2.9Š| ||
| 3 | L | 40.4 | Very low | 42.6 | Very low | 170 Ų | 170 | 154.5 Ų | 154.5 | 89% | 0.89 | 80% | 0.797 | S | S | * | * | trans | -83.5 | 91.8 | 171.9 | -73 | 162.1 | 0 | 0 | 0 | 107.8 | ||||
| 4 | N | 38.2 | Very low | 42.7 | Very low | 126 Ų | 126 | 154.3 Ų | 154.3 | 67% | 0.674 | 80% | 0.798 | S | S | * | * | trans | -100.1 | 125.4 | 160.7 | -164.2 | -9.1 | 0 | 0 | 0 | 108.8 | C2 N6 | C2-N4 PolarHBondContact O-N 2.9Å; N4-N6 VanDerWaalsContact C-N 3.25Å; N4-N6 PolarHBondContact O-N 3.1Å; N4-N6 VanDerWaalsContact O-N 3.11Å | ||
| 5 | R | 43.2 | Very low | 42.9 | Very low | 245 Ų | 245 | 156.2 Ų | 156.2 | 93% | 0.925 | 80% | 0.798 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.5 | 11.1 | -158.2 | -110.1 | 175.8 | -174 | 172.8 | 1.7 | 115.4 | ||
| 6 | N | 49.2 | Very low | 43 | Very low | 146 Ų | 146 | 151.4 Ų | 151.4 | 78% | 0.781 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -138.8 | 3.3 | -152.4 | -106 | -24.6 | 0 | 0 | 0 | 119.4 | N4 | N4-N6 VanDerWaalsContact C-N 3.25Å; N4-N6 PolarHBondContact O-N 3.1Å; N4-N6 VanDerWaalsContact O-N 3.11Å |
| 7 | S | 41.6 | Very low | 43.2 | Very low | 104 Ų | 104 | 150.2 Ų | 150.2 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | S | Bend | trans | -162.2 | 117.6 | 177.6 | -166.8 | 0 | 0 | 0 | 0 | 113.5 | ||
| 8 | V | 41.7 | Very low | 43.3 | Very low | 117 Ų | 117 | 144.9 Ų | 144.9 | 71% | 0.709 | 75% | 0.754 | S | S | * | * | trans | 41.7 | 99.1 | 140 | -170.2 | 0 | 0 | 0 | 0 | 115.5 | S10 | V8-S10 PolarHBondContact O-N 2.75Å; V8-S10 PolarHBondContact O-OG 3.08Å | ||
| 9 | Y | 44.2 | Very low | 43.7 | Very low | 219 Ų | 219 | 140.5 Ų | 140.5 | 86% | 0.859 | 74% | 0.735 | S | S | * | * | trans | -32.5 | 99.9 | 162.5 | -157.7 | -93.8 | 0 | 0 | 0 | 111.4 | P11 | Y9-P11 WeakPolarHBondContact O-CD 3.21Š| ||
| 10 | S | 40.3 | Very low | 44.3 | Very low | 71 Ų | 71 | 138.1 Ų | 138.1 | 50% | 0.497 | 73% | 0.73 | S | S | . | * | trans | -105.6 | 95.3 | 177.5 | -76.8 | 0 | 0 | 0 | 0 | 108.5 | V8 R12 C13 | V8-S10 PolarHBondContact O-N 2.75Å; V8-S10 PolarHBondContact O-OG 3.08Å; S10-R12 PolarHBondContact O-N 2.8Å; S10-C13 PolarHBondContact O-N 2.91Å | ||
| 11 | P | 51.4 | Low | 44.7 | Very low | 109 Ų | 109 | 135 Ų | 135 | 71% | 0.708 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.3 | 6.3 | 178.7 | 27.1 | -34.2 | 0 | 0 | 0 | 113.6 | Y9 | Y9-P11 WeakPolarHBondContact O-CD 3.21Š|
| 12 | R | 46.7 | Very low | 45.3 | Very low | 241 Ų | 241 | 125.6 Ų | 125.6 | 91% | 0.909 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.5 | 2 | 178 | -70.2 | -171 | 156.4 | 179.7 | -5.3 | 114.3 | S10 | S10-R12 PolarHBondContact O-N 2.8Š|
| 13 | C | 42.1 | Very low | 46.3 | Very low | 97 Ų | 97 | 123.3 Ų | 123.3 | 66% | 0.655 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -109.7 | 5 | -179.3 | -72.8 | 0 | 0 | 0 | 0 | 115.2 | S10 | S10-C13 PolarHBondContact O-N 2.91Š|
| 14 | D | 44.8 | Very low | 47 | Very low | 151 Ų | 151 | 121.2 Ų | 121.2 | 81% | 0.807 | 65% | 0.645 | S | S | * | * | trans | -92.2 | -2.6 | -174.8 | -127.1 | -98.7 | 0 | 0 | 0 | 114.8 | A16 | D14-A16 PolarHBondContact O-N 3.3Š| ||
| 15 | F | 45.3 | Very low | 47.9 | Very low | 183 Ų | 183 | 120.2 Ų | 120.2 | 80% | 0.803 | 64% | 0.639 | S | S | * | * | trans | -91.5 | 45 | 166.4 | -78.5 | -85.1 | 0 | 0 | 0 | 111.6 | F17 | F15-F17 HydrophobicContact CD1-CD2 4.1Å; F15-F17 HydrophobicContact CD1-CE2 4.2Å; F15-F17 PolarHBondContact O-N 3.01Å | ||
| 16 | A | 44.4 | Very low | 48.4 | Very low | 79 Ų | 79 | 113 Ų | 113 | 65% | 0.653 | 61% | 0.614 | S | S | * | * | trans | -73.3 | 80.2 | 159.4 | 0 | 0 | 0 | 0 | 0 | 107.8 | D14 C18 | D14-A16 PolarHBondContact O-N 3.3Å; A16-C18 PolarHBondContact O-N 3.42Å | ||
| 17 | F | 45.8 | Very low | 48.9 | Very low | 131 Ų | 131 | 110.4 Ų | 110.4 | 58% | 0.575 | 60% | 0.603 | S | S | * | * | trans | -61 | 81.1 | 171.1 | -120.3 | -98.9 | 0 | 0 | 0 | 108.3 | F15 P19 W22 | F15-F17 HydrophobicContact CD1-CD2 4.1Å; F15-F17 HydrophobicContact CD1-CE2 4.2Å; F15-F17 PolarHBondContact O-N 3.01Å; F17-P19 WeakPolarHBondContact O-CD 3.13Å; F17-W22 AromaticContact CD1-CE2 3.71Å; F17-W22 AromaticContact CD1-CZ2 3.65Å; F17-W22 HydrophobicContact CD1-CZ2 3.65Å; F17-W22 AromaticContact CD1-NE1 3.25Å; F17-W22 HydrophobicContact CE1-CZ2 4.24Å; F17-W22 AromaticContact CE1-NE1 3.7Å | ||
| 18 | C | 44.7 | Very low | 49.8 | Very low | 55 Ų | 55 | 110.6 Ų | 110.6 | 37% | 0.372 | 60% | 0.595 | S | S | . | * | trans | -69.9 | 123 | -179.9 | -112.9 | 0 | 0 | 0 | 0 | 108.4 | A16 S20 S21 | A16-C18 PolarHBondContact O-N 3.42Å; C18-S20 PolarHBondContact O-N 3.08Å; C18-S21 PolarHBondContact O-N 3.17Å | ||
| 19 | P | 52.1 | Low | 50.5 | Low | 62 Ų | 62 | 109.5 Ų | 109.5 | 40% | 0.403 | 58% | 0.579 | S | S | . | * | G | 310 helix | trans | -67.8 | 2.3 | -178 | 26.3 | -33.5 | 0 | 0 | 0 | 113.9 | F17 S21 W22 C45 | F17-P19 WeakPolarHBondContact O-CD 3.13Å; P19-S21 VanDerWaalsContact C-N 3.35Å; P19-W22 WeakPolarHBondContact O-CB 3.35Å; P19-W22 PolarHBondContact O-N 2.91Å; P19-C45 HydrophobicContact CG-CB 4.46Å |
| 20 | S | 55 | Low | 51.3 | Low | 91 Ų | 91 | 102 Ų | 102 | 64% | 0.636 | 56% | 0.555 | S | S | * | * | G | 310 helix | trans | -73.5 | -20.2 | 175.6 | 23.3 | 0 | 0 | 0 | 0 | 114.2 | C18 | C18-S20 PolarHBondContact O-N 3.08Š|
| 21 | S | 53.9 | Low | 52.3 | Low | 75 Ų | 75 | 109.5 Ų | 109.5 | 52% | 0.524 | 57% | 0.573 | S | S | . | * | G | 310 helix | trans | -95.7 | -2.4 | 174.5 | -50.1 | 0 | 0 | 0 | 0 | 113.1 | C18 P19 L25 | C18-S21 PolarHBondContact O-N 3.17Å; P19-S21 VanDerWaalsContact C-N 3.35Å; S21-L25 PolarHBondContact O-N 3.45Å |
| 22 | W | 52.8 | Low | 52.8 | Low | 38 Ų | 38 | 109.6 Ų | 109.6 | 14% | 0.144 | 57% | 0.568 | C | S | . | * | H | α-helix | trans | -76.9 | -31.3 | -176.3 | -76.8 | 37.4 | 0 | 0 | 0 | 116.8 | F17 P19 L24 L25 F26 W39 L42 | F17-W22 AromaticContact CD1-CE2 3.71Å; F17-W22 AromaticContact CD1-CZ2 3.65Å; F17-W22 HydrophobicContact CD1-CZ2 3.65Å; F17-W22 AromaticContact CD1-NE1 3.25Å; F17-W22 HydrophobicContact CE1-CZ2 4.24Å; F17-W22 AromaticContact CE1-NE1 3.7Å; P19-W22 WeakPolarHBondContact O-CB 3.35Å; P19-W22 PolarHBondContact O-N 2.91Å; W22-L24 PolarHBondContact O-N 3.47Å; W22-L25 PolarHBondContact O-N 3.46Å; W22-F26 WeakPolarHBondContact O-CB 3.42Å; W22-F26 PolarHBondContact O-N 2.95Å; W22-W39 HydrophobicContact CE3-CD2 4.32Å; W22-W39 HydrophobicContact CE3-CH2 4.33Å; W22-W39 HydrophobicContact CE3-CZ2 4.02Å; W22-W39 AromaticContact CH2-CD2 3.99Å; W22-W39 HydrophobicContact CH2-CD2 3.99Å; W22-W39 AromaticContact CH2-CE2 3.96Å; W22-W39 AromaticContact CH2-CE3 3.51Å; W22-W39 HydrophobicContact CH2-CE3 3.51Å; W22-W39 AromaticContact CH2-CH2 2.93Å; W22-W39 HydrophobicContact CH2-CH2 2.93Å; W22-W39 AromaticContact CH2-CZ2 3.47Å; W22-W39 HydrophobicContact CH2-CZ2 3.47Å; W22-W39 VanDerWaalsContact CH2-CZ2 3.47Å; W22-W39 AromaticContact CH2-CZ3 2.99Å; W22-W39 HydrophobicContact CH2-CZ3 2.99Å; W22-W39 AromaticContact CZ2-CH2 3.69Å; W22-W39 HydrophobicContact CZ2-CH2 3.69Å; W22-W39 HydrophobicContact CZ2-CZ2 4.21Å; W22-W39 HydrophobicContact CZ2-CZ3 4.07Å; W22-W39 AromaticContact CZ3-CD2 3.35Å; W22-W39 HydrophobicContact CZ3-CD2 3.35Å; W22-W39 AromaticContact CZ3-CE2 3.32Å; W22-W39 AromaticContact CZ3-CE3 3.34Å; W22-W39 HydrophobicContact CZ3-CE3 3.34Å; W22-W39 HydrophobicContact CZ3-CG 4.17Å; W22-W39 AromaticContact CZ3-CH2 3.28Å; W22-W39 HydrophobicContact CZ3-CH2 3.28Å; W22-W39 AromaticContact CZ3-CZ2 3.28Å; W22-W39 HydrophobicContact CZ3-CZ2 3.28Å; W22-W39 AromaticContact CZ3-CZ3 3.33Å; W22-W39 HydrophobicContact CZ3-CZ3 3.33Å; W22-L42 HydrophobicContact CE3-CD1 3.98Å; W22-L42 HydrophobicContact CH2-CD1 3.22Å; W22-L42 HydrophobicContact CH2-CD2 3.79Å; W22-L42 HydrophobicContact CH2-CG 4.08Å; W22-L42 HydrophobicContact CZ2-CD1 4.36Å; W22-L42 HydrophobicContact CZ2-CD2 4.46Å; W22-L42 HydrophobicContact CZ3-CD1 3.03Å; W22-L42 HydrophobicContact CZ3-CD2 4.47Å; W22-L42 HydrophobicContact CZ3-CG 4.3Å |
| 23 | P | 54.5 | Low | 53.5 | Low | 80 Ų | 80 | 105 Ų | 105 | 52% | 0.519 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.4 | -33.7 | 178.6 | 21.9 | -30.2 | 0 | 0 | 0 | 110.9 | V27 | P23-V27 WeakPolarHBondContact O-CB 3.44Å; P23-V27 WeakPolarHBondContact O-CG2 3.46Å; P23-V27 PolarHBondContact O-N 2.84Å |
| 24 | L | 55.3 | Low | 54.4 | Low | 126 Ų | 126 | 103.5 Ų | 103.5 | 66% | 0.66 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -70.7 | -46.4 | 175.1 | -78 | 160.7 | 0 | 0 | 0 | 112.5 | W22 F26 V27 I28 | W22-L24 PolarHBondContact O-N 3.47Å; L24-F26 VanDerWaalsContact C-N 3.32Å; L24-F26 PolarHBondContact O-N 3.44Å; L24-V27 PolarHBondContact O-N 3.47Å; L24-I28 WeakPolarHBondContact O-CD1 3.38Å; L24-I28 WeakPolarHBondContact O-CG1 3.41Å; L24-I28 PolarHBondContact O-N 2.89Å |
| 25 | L | 56.1 | Low | 55.1 | Low | 104 Ų | 104 | 100.1 Ų | 100.1 | 55% | 0.545 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.4 | -38.7 | 175.7 | -90.4 | 150.4 | 0 | 0 | 0 | 112.2 | S21 W22 I28 Y29 | S21-L25 PolarHBondContact O-N 3.45Å; W22-L25 PolarHBondContact O-N 3.46Å; L25-I28 PolarHBondContact O-N 3.31Å; L25-Y29 WeakPolarHBondContact O-CB 3.18Å; L25-Y29 PolarHBondContact O-N 2.89Å |
| 26 | F | 54.7 | Low | 55.7 | Low | 95 Ų | 95 | 95.7 Ų | 95.7 | 42% | 0.417 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.3 | -43.7 | 175.9 | -179.1 | -97.3 | 0 | 0 | 0 | 111.4 | W22 L24 Y29 V30 | W22-F26 WeakPolarHBondContact O-CB 3.42Å; W22-F26 PolarHBondContact O-N 2.95Å; L24-F26 VanDerWaalsContact C-N 3.32Å; L24-F26 PolarHBondContact O-N 3.44Å; F26-Y29 PolarHBondContact O-N 3.44Å; F26-V30 HydrophobicContact CD1-CG2 4.27Å; F26-V30 HydrophobicContact CD2-CG2 4.4Å; F26-V30 HydrophobicContact CE1-CG2 3.96Å; F26-V30 HydrophobicContact CE2-CG2 4.09Å; F26-V30 HydrophobicContact CG-CG2 4.49Å; F26-V30 HydrophobicContact CZ-CG2 3.86Å; F26-V30 WeakPolarHBondContact O-CB 3.47Å; F26-V30 WeakPolarHBondContact O-CG2 3.44Å; F26-V30 PolarHBondContact O-N 2.79Å |
| 27 | V | 58.8 | Low | 56.4 | Low | 90 Ų | 90 | 94.9 Ų | 94.9 | 55% | 0.545 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.3 | -41.2 | 176.9 | 170.5 | 0 | 0 | 0 | 0 | 111.4 | P23 L24 R31 | P23-V27 WeakPolarHBondContact O-CB 3.44Å; P23-V27 WeakPolarHBondContact O-CG2 3.46Å; P23-V27 PolarHBondContact O-N 2.84Å; L24-V27 PolarHBondContact O-N 3.47Å; V27-R31 WeakPolarHBondContact O-CB 3.17Å; V27-R31 PolarHBondContact O-N 3.27Å; V27-R31 VanDerWaalsContact O-N 3.08Å |
| 28 | I | 61.2 | Low | 56.9 | Low | 108 Ų | 108 | 97.9 Ų | 97.9 | 55% | 0.554 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.8 | -45.8 | 176 | -65 | 163.2 | 0 | 0 | 0 | 110.4 | L24 L25 V30 R31 D32 | L24-I28 WeakPolarHBondContact O-CD1 3.38Å; L24-I28 WeakPolarHBondContact O-CG1 3.41Å; L24-I28 PolarHBondContact O-N 2.89Å; L25-I28 PolarHBondContact O-N 3.31Å; I28-V30 PolarHBondContact O-N 3.47Å; I28-R31 PolarHBondContact O-N 3.02Å; I28-D32 VanDerWaalsContact O-CB 3.31Å; I28-D32 WeakPolarHBondContact O-CB 3.22Å; I28-D32 PolarHBondContact O-N 3.18Å |
| 29 | Y | 57.4 | Low | 57.4 | Low | 95 Ų | 95 | 102.2 Ų | 102.2 | 37% | 0.373 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.6 | -39.1 | -178.7 | -168.4 | -89.2 | 0 | 0 | 0 | 112.7 | L25 F26 R31 D32 Y33 T35 V37 | L25-Y29 WeakPolarHBondContact O-CB 3.18Å; L25-Y29 PolarHBondContact O-N 2.89Å; F26-Y29 PolarHBondContact O-N 3.44Å; Y29-R31 VanDerWaalsContact C-N 3.33Å; Y29-D32 PolarHBondContact O-N 3.44Å; Y29-Y33 AromaticContact CD2-CD2 3.62Å; Y29-Y33 HydrophobicContact CD2-CD2 3.62Å; Y29-Y33 HydrophobicContact CD2-CE2 4.22Å; Y29-Y33 HydrophobicContact CD2-CG 4.36Å; Y29-Y33 AromaticContact CE2-CD2 3.67Å; Y29-Y33 HydrophobicContact CE2-CD2 3.67Å; Y29-Y33 HydrophobicContact CE2-CE2 4.27Å; Y29-Y33 HydrophobicContact CE2-CG 4.05Å; Y29-Y33 HydrophobicContact CG-CD2 4.2Å; Y29-Y33 WeakPolarHBondContact O-CB 3.31Å; Y29-Y33 PolarHBondContact O-N 3.28Å; Y29-T35 WeakPolarHBondContact CE1-O 3.48Å; Y29-V37 HydrophobicContact CD1-CG2 3.95Å; Y29-V37 HydrophobicContact CE1-CG2 3.36Å |
| 30 | V | 59.4 | Low | 57.3 | Low | 60 Ų | 60 | 108 Ų | 108 | 36% | 0.364 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -68 | -34.2 | 174.5 | 172.3 | 0 | 0 | 0 | 0 | 111.3 | F26 I28 G34 | F26-V30 HydrophobicContact CD1-CG2 4.27Å; F26-V30 HydrophobicContact CD2-CG2 4.4Å; F26-V30 HydrophobicContact CE1-CG2 3.96Å; F26-V30 HydrophobicContact CE2-CG2 4.09Å; F26-V30 HydrophobicContact CG-CG2 4.49Å; F26-V30 HydrophobicContact CZ-CG2 3.86Å; F26-V30 WeakPolarHBondContact O-CB 3.47Å; F26-V30 WeakPolarHBondContact O-CG2 3.44Å; F26-V30 PolarHBondContact O-N 2.79Å; I28-V30 PolarHBondContact O-N 3.47Å; V30-G34 PolarHBondContact O-N 2.93Å |
| 31 | R | 61.4 | Low | 56.9 | Low | 230 Ų | 230 | 110 Ų | 110 | 87% | 0.868 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -70.6 | -37.2 | 174.9 | -115.7 | -168.5 | 177.1 | -159.1 | 0 | 113.3 | V27 I28 Y29 | V27-R31 WeakPolarHBondContact O-CB 3.17Å; V27-R31 PolarHBondContact O-N 3.27Å; V27-R31 VanDerWaalsContact O-N 3.08Å; I28-R31 PolarHBondContact O-N 3.02Å; Y29-R31 VanDerWaalsContact C-N 3.33Å |
| 32 | D | 62.1 | Low | 56.8 | Low | 111 Ų | 111 | 111.3 Ų | 111.3 | 59% | 0.594 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -93.4 | -36.9 | -170.2 | -157.9 | -104.8 | 0 | 0 | 0 | 112.8 | I28 Y29 | I28-D32 VanDerWaalsContact O-CB 3.31Å; I28-D32 WeakPolarHBondContact O-CB 3.22Å; I28-D32 PolarHBondContact O-N 3.18Å; Y29-D32 PolarHBondContact O-N 3.44Å |
| 33 | Y | 62.5 | Low | 56.7 | Low | 145 Ų | 145 | 118.3 Ų | 118.3 | 57% | 0.569 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -113.8 | 0.4 | -172.2 | -66 | -80.1 | 0 | 0 | 0 | 114.8 | Y29 T35 | Y29-Y33 AromaticContact CD2-CD2 3.62Å; Y29-Y33 HydrophobicContact CD2-CD2 3.62Å; Y29-Y33 HydrophobicContact CD2-CE2 4.22Å; Y29-Y33 HydrophobicContact CD2-CG 4.36Å; Y29-Y33 AromaticContact CE2-CD2 3.67Å; Y29-Y33 HydrophobicContact CE2-CD2 3.67Å; Y29-Y33 HydrophobicContact CE2-CE2 4.27Å; Y29-Y33 HydrophobicContact CE2-CG 4.05Å; Y29-Y33 HydrophobicContact CG-CD2 4.2Å; Y29-Y33 WeakPolarHBondContact O-CB 3.31Å; Y29-Y33 PolarHBondContact O-N 3.28Å; Y33-T35 PolarHBondContact O-N 2.91Å; Y33-T35 PolarHBondContact O-OG1 3.06Å |
| 34 | G | 60 | Low | 56.2 | Low | 65 Ų | 65 | 119 Ų | 119 | 67% | 0.67 | 60% | 0.596 | S | S | * | * | trans | 59.2 | 5.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | V30 | V30-G34 PolarHBondContact O-N 2.93Š| ||
| 35 | T | 59.8 | Low | 55.9 | Low | 79 Ų | 79 | 117.5 Ų | 117.5 | 49% | 0.485 | 60% | 0.595 | S | S | . | * | trans | -122 | 112.5 | -172.3 | 24 | 0 | 0 | 0 | 0 | 110 | Y29 Y33 V37 | Y29-T35 WeakPolarHBondContact CE1-O 3.48Å; Y33-T35 PolarHBondContact O-N 2.91Å; Y33-T35 PolarHBondContact O-OG1 3.06Å; T35-V37 PolarHBondContact O-N 2.9Å; T35-V37 VanDerWaalsContact O-N 3.1Å | ||
| 36 | P | 58.1 | Low | 55.6 | Low | 90 Ų | 90 | 123.3 Ų | 123.3 | 58% | 0.584 | 61% | 0.609 | S | S | * | * | trans | -70.5 | 108.3 | 172.5 | 27.4 | -31.5 | 0 | 0 | 0 | 109.1 | K38 | P36-K38 PolarHBondContact O-N 2.72Å; P36-K38 VanDerWaalsContact O-N 3.08Å | ||
| 37 | V | 59.8 | Low | 55.3 | Low | 63 Ų | 63 | 129.1 Ų | 129.1 | 38% | 0.382 | 63% | 0.628 | S | S | . | * | trans | -60.4 | 114 | 168.7 | 180 | 0 | 0 | 0 | 0 | 107.8 | Y29 T35 W39 | Y29-V37 HydrophobicContact CD1-CG2 3.95Å; Y29-V37 HydrophobicContact CE1-CG2 3.36Å; T35-V37 PolarHBondContact O-N 2.9Å; T35-V37 VanDerWaalsContact O-N 3.1Å; V37-W39 VanDerWaalsContact C-N 3.32Å; V37-W39 HydrophobicContact CG1-CG 4.39Å; V37-W39 VanDerWaalsContact O-CD1 3.28Å; V37-W39 PolarHBondContact O-N 3.49Å | ||
| 38 | K | 55.6 | Low | 54.5 | Low | 193 Ų | 193 | 132.6 Ų | 132.6 | 84% | 0.839 | 64% | 0.638 | S | S | * | * | trans | -67 | 89.8 | 171.8 | -77.4 | -179.3 | 179.3 | 174.1 | 0 | 109 | P36 K40 | P36-K38 PolarHBondContact O-N 2.72Å; P36-K38 VanDerWaalsContact O-N 3.08Å; K38-K40 VanDerWaalsContact C-N 3.31Å; K38-K40 PolarHBondContact O-N 3.3Å | ||
| 39 | W | 54 | Low | 53.6 | Low | 146 Ų | 146 | 132.9 Ų | 132.9 | 55% | 0.553 | 65% | 0.65 | S | S | * | * | trans | -72.1 | 85.5 | 171.6 | -76.4 | 91.6 | 0 | 0 | 0 | 110.4 | W22 V37 L42 | W22-W39 HydrophobicContact CE3-CD2 4.32Å; W22-W39 HydrophobicContact CE3-CH2 4.33Å; W22-W39 HydrophobicContact CE3-CZ2 4.02Å; W22-W39 AromaticContact CH2-CD2 3.99Å; W22-W39 HydrophobicContact CH2-CD2 3.99Å; W22-W39 AromaticContact CH2-CE2 3.96Å; W22-W39 AromaticContact CH2-CE3 3.51Å; W22-W39 HydrophobicContact CH2-CE3 3.51Å; W22-W39 AromaticContact CH2-CH2 2.93Å; W22-W39 HydrophobicContact CH2-CH2 2.93Å; W22-W39 AromaticContact CH2-CZ2 3.47Å; W22-W39 HydrophobicContact CH2-CZ2 3.47Å; W22-W39 VanDerWaalsContact CH2-CZ2 3.47Å; W22-W39 AromaticContact CH2-CZ3 2.99Å; W22-W39 HydrophobicContact CH2-CZ3 2.99Å; W22-W39 AromaticContact CZ2-CH2 3.69Å; W22-W39 HydrophobicContact CZ2-CH2 3.69Å; W22-W39 HydrophobicContact CZ2-CZ2 4.21Å; W22-W39 HydrophobicContact CZ2-CZ3 4.07Å; W22-W39 AromaticContact CZ3-CD2 3.35Å; W22-W39 HydrophobicContact CZ3-CD2 3.35Å; W22-W39 AromaticContact CZ3-CE2 3.32Å; W22-W39 AromaticContact CZ3-CE3 3.34Å; W22-W39 HydrophobicContact CZ3-CE3 3.34Å; W22-W39 HydrophobicContact CZ3-CG 4.17Å; W22-W39 AromaticContact CZ3-CH2 3.28Å; W22-W39 HydrophobicContact CZ3-CH2 3.28Å; W22-W39 AromaticContact CZ3-CZ2 3.28Å; W22-W39 HydrophobicContact CZ3-CZ2 3.28Å; W22-W39 AromaticContact CZ3-CZ3 3.33Å; W22-W39 HydrophobicContact CZ3-CZ3 3.33Å; V37-W39 VanDerWaalsContact C-N 3.32Å; V37-W39 HydrophobicContact CG1-CG 4.39Å; V37-W39 VanDerWaalsContact O-CD1 3.28Å; V37-W39 PolarHBondContact O-N 3.49Å; W39-L42 HydrophobicContact CD2-CD1 4.19Å; W39-L42 HydrophobicContact CE3-CD1 3.57Å; W39-L42 HydrophobicContact CE3-CG 4.25Å; W39-L42 HydrophobicContact CZ3-CD1 4.05Å | ||
| 40 | K | 52 | Low | 52.9 | Low | 185 Ų | 185 | 137.5 Ų | 137.5 | 80% | 0.804 | 68% | 0.679 | S | S | * | * | trans | -72.2 | 122.2 | 164 | -82.5 | -176.6 | 173.1 | -178.4 | 0 | 108.7 | K38 | K38-K40 VanDerWaalsContact C-N 3.31Å; K38-K40 PolarHBondContact O-N 3.3Å | ||
| 41 | N | 46.4 | Very low | 52.6 | Low | 132 Ų | 132 | 141.4 Ų | 141.4 | 71% | 0.706 | 70% | 0.695 | S | S | * | * | trans | 62 | 76.3 | 164 | -81.6 | -47.5 | 0 | 0 | 0 | 117.8 | ||||
| 42 | L | 51.9 | Low | 52.1 | Low | 102 Ų | 102 | 136.7 Ų | 136.7 | 53% | 0.534 | 69% | 0.686 | S | S | . | * | trans | -95.1 | 82.4 | 149.7 | -75.3 | 146.2 | 0 | 0 | 0 | 109.1 | W22 W39 S44 | W22-L42 HydrophobicContact CE3-CD1 3.98Å; W22-L42 HydrophobicContact CH2-CD1 3.22Å; W22-L42 HydrophobicContact CH2-CD2 3.79Å; W22-L42 HydrophobicContact CH2-CG 4.08Å; W22-L42 HydrophobicContact CZ2-CD1 4.36Å; W22-L42 HydrophobicContact CZ2-CD2 4.46Å; W22-L42 HydrophobicContact CZ3-CD1 3.03Å; W22-L42 HydrophobicContact CZ3-CD2 4.47Å; W22-L42 HydrophobicContact CZ3-CG 4.3Å; W39-L42 HydrophobicContact CD2-CD1 4.19Å; W39-L42 HydrophobicContact CE3-CD1 3.57Å; W39-L42 HydrophobicContact CE3-CG 4.25Å; W39-L42 HydrophobicContact CZ3-CD1 4.05Å; L42-S44 PolarHBondContact O-N 3.2Å | ||
| 43 | K | 50 | Low | 51.6 | Low | 186 Ų | 186 | 138.2 Ų | 138.2 | 81% | 0.809 | 69% | 0.691 | S | S | * | * | trans | -75.1 | 111.1 | 166.2 | -81.6 | -175.2 | 175.7 | -177.2 | 0 | 108.8 | ||||
| 44 | S | 44.1 | Very low | 50.9 | Low | 94 Ų | 94 | 137.8 Ų | 137.8 | 66% | 0.657 | 70% | 0.698 | S | S | * | * | trans | 68.7 | 75.1 | 141.5 | -150.3 | 0 | 0 | 0 | 0 | 117.6 | L42 R46 | L42-S44 PolarHBondContact O-N 3.2Å; S44-R46 PolarHBondContact O-N 2.86Å | ||
| 45 | C | 47.9 | Very low | 50.4 | Low | 94 Ų | 94 | 142.3 Ų | 142.3 | 64% | 0.635 | 70% | 0.7 | S | S | * | * | trans | -75.8 | 70.2 | 148.4 | -70.2 | 0 | 0 | 0 | 0 | 108.9 | P19 R47 | P19-C45 HydrophobicContact CG-CB 4.46Å; C45-R47 PolarHBondContact O-N 3.32Å | ||
| 46 | R | 50.4 | Low | 49.7 | Very low | 227 Ų | 227 | 146.5 Ų | 146.5 | 86% | 0.857 | 72% | 0.715 | S | S | * | * | trans | -71.8 | 106.7 | 167.7 | -135.8 | -175.5 | -166.2 | -171.7 | 2.4 | 106.7 | S44 H48 | S44-R46 PolarHBondContact O-N 2.86Å; R46-H48 PolarHBondContact O-N 2.87Å | ||
| 47 | R | 49.6 | Very low | 49.2 | Very low | 216 Ų | 216 | 150.6 Ų | 150.6 | 82% | 0.815 | 72% | 0.724 | S | S | * | * | trans | -58 | 97.4 | 173 | -142.3 | -180 | -147.8 | 168.9 | 5.1 | 107.6 | C45 S49 | C45-R47 PolarHBondContact O-N 3.32Å; R47-S49 VanDerWaalsContact C-N 3.33Å; R47-S49 PolarHBondContact O-N 3.11Å | ||
| 48 | H | 41.7 | Very low | 48.3 | Very low | 163 Ų | 163 | 157.3 Ų | 157.3 | 76% | 0.755 | 75% | 0.75 | S | S | * | * | trans | -73.3 | 98 | 167.8 | -142.3 | 107.9 | 0 | 0 | 0 | 105.9 | R46 I50 | R46-H48 PolarHBondContact O-N 2.87Å; H48-I50 WeakPolarHBondContact NE2-CD1 3.22Å; H48-I50 PolarHBondContact O-N 3.25Å | ||
| 49 | S | 42.4 | Very low | 47.7 | Very low | 115 Ų | 115 | 154.3 Ų | 154.3 | 80% | 0.804 | 74% | 0.743 | S | S | * | * | trans | -80.9 | 102 | 167.4 | -177.5 | 0 | 0 | 0 | 0 | 106.8 | R47 | R47-S49 VanDerWaalsContact C-N 3.33Å; R47-S49 PolarHBondContact O-N 3.11Å | ||
| 50 | I | 42.5 | Very low | 47.2 | Very low | 192 Ų | 192 | 155.1 Ų | 155.1 | 99% | 0.985 | 76% | 0.76 | S | S | * | * | trans | -131.7 | 0 | 156.6 | -73.4 | 172.7 | 0 | 0 | 0 | 106.5 | H48 | H48-I50 WeakPolarHBondContact NE2-CD1 3.22Å; H48-I50 PolarHBondContact O-N 3.25Å |
Retrieved 50 of 50 residues in 150 ms
(Link to these results)