| 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 | 39.2 | Very low | 42.4 | Very low | 241 Ų | 241 | 142.2 Ų | 142.2 | 100% | 1.187 | 82% | 0.823 | S | S | * | * | 0 | 142.3 | 0 | -71.6 | -171.5 | 97.9 | 0 | 0 | 107.8 | |||||
| 2 | P | 42.8 | Very low | 42.5 | Very low | 107 Ų | 107 | 140.1 Ų | 140.1 | 70% | 0.695 | 82% | 0.823 | S | S | * | * | trans | -89.7 | 148.2 | -159.2 | 35.3 | -31.7 | 0 | 0 | 0 | 112.1 | ||||
| 3 | E | 39.4 | Very low | 42.8 | Very low | 172 Ų | 172 | 141.3 Ų | 141.3 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | trans | -115.1 | 117 | 150.6 | -80.5 | -145.3 | 134.2 | 0 | 0 | 108.5 | ||||
| 4 | V | 41.7 | Very low | 43.4 | Very low | 130 Ų | 130 | 138.7 Ų | 138.7 | 79% | 0.788 | 81% | 0.811 | S | S | * | * | trans | -85.5 | 114.8 | 179 | 173 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 5 | F | 42.2 | Very low | 43.6 | Very low | 184 Ų | 184 | 137.7 Ų | 137.7 | 81% | 0.807 | 81% | 0.81 | S | S | * | * | trans | -88.8 | 115.3 | 165.3 | -76.3 | -85.7 | 0 | 0 | 0 | 108.6 | ||||
| 6 | A | 47.1 | Very low | 43.6 | Very low | 84 Ų | 84 | 135.5 Ų | 135.5 | 69% | 0.694 | 81% | 0.805 | S | S | * | * | trans | -73.8 | 143.5 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 7 | P | 44.1 | Very low | 43.5 | Very low | 125 Ų | 125 | 134.8 Ų | 134.8 | 81% | 0.812 | 81% | 0.805 | S | S | * | * | trans | -75.5 | 134.2 | 171.3 | 0.1 | 17.2 | 0 | 0 | 0 | 109.8 | E9 | P7-E9 PolarHBondContact O-N 3.32Š| ||
| 8 | I | 45.5 | Very low | 43.5 | Very low | 167 Ų | 167 | 134.6 Ų | 134.6 | 86% | 0.856 | 80% | 0.804 | S | S | * | * | trans | -69.8 | 114 | 171 | -65.6 | 160.9 | 0 | 0 | 0 | 107.7 | A10 | I8-A10 PolarHBondContact O-N 3.31Š| ||
| 9 | E | 41.8 | Very low | 43.2 | Very low | 185 Ų | 185 | 134.9 Ų | 134.9 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 120.5 | 168.6 | -82.8 | -174.9 | 144.9 | 0 | 0 | 109.5 | P7 G11 | P7-E9 PolarHBondContact O-N 3.32Å; E9-G11 PolarHBondContact O-N 3.26Å |
| 10 | A | 47.1 | Very low | 43.1 | Very low | 96 Ų | 96 | 133.3 Ų | 133.3 | 79% | 0.793 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 122.2 | 166.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | I8 S12 | I8-A10 PolarHBondContact O-N 3.31Å; A10-S12 PolarHBondContact O-N 3.34Å |
| 11 | G | 36 | Very low | 42.9 | Very low | 73 Ų | 73 | 129.7 Ų | 129.7 | 75% | 0.753 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 122.2 | -177 | 0 | 0 | 0 | 0 | 0 | 112.9 | E9 I13 | E9-G11 PolarHBondContact O-N 3.26Å; G11-I13 PolarHBondContact O-N 3.32Å |
| 12 | S | 42.9 | Very low | 42.8 | Very low | 117 Ų | 117 | 123 Ų | 123 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | trans | -66.5 | 114.5 | 167.8 | 20.6 | 0 | 0 | 0 | 0 | 109.4 | A10 | A10-S12 PolarHBondContact O-N 3.34Š| ||
| 13 | I | 47.2 | Very low | 42.7 | Very low | 156 Ų | 156 | 128.5 Ų | 128.5 | 80% | 0.8 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -63.1 | 127.4 | 168.3 | -61.8 | 161.4 | 0 | 0 | 0 | 107.2 | G11 | G11-I13 PolarHBondContact O-N 3.32Š|
| 14 | P | 50.3 | Low | 43 | Very low | 105 Ų | 105 | 129.7 Ų | 129.7 | 68% | 0.682 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 138.6 | 175 | 26.5 | -32 | 0 | 0 | 0 | 109.4 | S16 | P14-S16 PolarHBondContact O-N 3.5Š|
| 15 | P | 46.8 | Very low | 43.1 | Very low | 123 Ų | 123 | 128.7 Ų | 128.7 | 80% | 0.799 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 128.5 | 177.1 | 24.7 | -31.6 | 0 | 0 | 0 | 109.4 | ||
| 16 | S | 43.5 | Very low | 43.1 | Very low | 103 Ų | 103 | 124.5 Ų | 124.5 | 72% | 0.72 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 137 | 170.1 | 46.5 | 0 | 0 | 0 | 0 | 109.8 | P14 V18 | P14-S16 PolarHBondContact O-N 3.5Å; S16-V18 PolarHBondContact O-N 3.01Å; S16-V18 VanDerWaalsContact O-N 3.17Å |
| 17 | P | 42.6 | Very low | 43.3 | Very low | 124 Ų | 124 | 124.1 Ų | 124.1 | 81% | 0.805 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 126.5 | -178.7 | 24.1 | -31.7 | 0 | 0 | 0 | 108.9 | D19 | P17-D19 PolarHBondContact O-N 3.1Š|
| 18 | V | 42.9 | Very low | 43.7 | Very low | 130 Ų | 130 | 120.2 Ų | 120.2 | 79% | 0.788 | 70% | 0.704 | S | S | * | * | trans | -55.5 | 113.8 | 167.2 | 145 | 0 | 0 | 0 | 0 | 106.6 | S16 S20 | S16-V18 PolarHBondContact O-N 3.01Å; S16-V18 VanDerWaalsContact O-N 3.17Å; V18-S20 PolarHBondContact O-N 3.38Å | ||
| 19 | D | 37.4 | Very low | 44 | Very low | 141 Ų | 141 | 120 Ų | 120 | 75% | 0.754 | 70% | 0.696 | S | S | * | * | trans | -68.9 | 86 | 169.5 | -171.1 | 17.3 | 0 | 0 | 0 | 107.1 | P17 S21 | P17-D19 PolarHBondContact O-N 3.1Å; D19-S21 PolarHBondContact O-N 3.26Å; D19-S21 PolarHBondContact OD1-N 3.17Å | ||
| 20 | S | 40.5 | Very low | 44.6 | Very low | 103 Ų | 103 | 113.8 Ų | 113.8 | 72% | 0.72 | 67% | 0.669 | S | S | * | * | trans | -75.2 | 59.9 | 163.6 | 56.8 | 0 | 0 | 0 | 0 | 108.5 | V18 P22 | V18-S20 PolarHBondContact O-N 3.38Å; S20-P22 WeakPolarHBondContact O-CD 3.49Å | ||
| 21 | S | 39 | Very low | 45.2 | Very low | 57 Ų | 57 | 113.6 Ų | 113.6 | 40% | 0.399 | 66% | 0.657 | S | S | . | * | trans | -64.8 | 119.2 | 167 | 158 | 0 | 0 | 0 | 0 | 107.3 | D19 R23 | D19-S21 PolarHBondContact O-N 3.26Å; D19-S21 PolarHBondContact OD1-N 3.17Å; S21-R23 PolarHBondContact O-N 3Å | ||
| 22 | P | 38.8 | Very low | 46 | Very low | 102 Ų | 102 | 116.6 Ų | 116.6 | 66% | 0.662 | 65% | 0.652 | S | S | * | * | trans | -60.1 | 128.3 | 161.3 | 26.1 | -29.8 | 0 | 0 | 0 | 106.8 | S20 R24 | S20-P22 WeakPolarHBondContact O-CD 3.49Å; P22-R24 PolarHBondContact O-N 2.87Å | ||
| 23 | R | 40.8 | Very low | 46.6 | Very low | 221 Ų | 221 | 118.9 Ų | 118.9 | 83% | 0.834 | 64% | 0.642 | S | S | * | * | trans | -29.9 | 106.7 | -173.4 | -66.2 | 175.8 | -173.1 | -177.6 | 1.1 | 111.9 | S21 L25 | S21-R23 PolarHBondContact O-N 3Å; R23-L25 PolarHBondContact O-N 3.32Å | ||
| 24 | R | 44.1 | Very low | 47 | Very low | 198 Ų | 198 | 113.9 Ų | 113.9 | 75% | 0.747 | 62% | 0.617 | S | S | * | * | trans | -54.8 | 99.9 | 172.9 | -147.7 | 177.5 | -164.2 | -89.1 | -1.6 | 108.3 | P22 S26 | P22-R24 PolarHBondContact O-N 2.87Å; R24-S26 PolarHBondContact O-N 3.16Å | ||
| 25 | L | 44.8 | Very low | 47.3 | Very low | 108 Ų | 108 | 111.6 Ų | 111.6 | 57% | 0.565 | 61% | 0.607 | S | S | * | * | trans | -60.7 | 134.4 | 174.4 | -69.1 | 172.8 | 0 | 0 | 0 | 108 | R23 W27 | R23-L25 PolarHBondContact O-N 3.32Å; L25-W27 PolarHBondContact O-N 2.97Å | ||
| 26 | S | 43 | Very low | 47.3 | Very low | 96 Ų | 96 | 111 Ų | 111 | 67% | 0.671 | 60% | 0.597 | S | S | * | * | trans | -66.6 | 95.8 | -172 | 162 | 0 | 0 | 0 | 0 | 111.3 | R24 G28 | R24-S26 PolarHBondContact O-N 3.16Å; S26-G28 PolarHBondContact O-N 3.35Å | ||
| 27 | W | 50.1 | Low | 47.5 | Very low | 76 Ų | 76 | 113.9 Ų | 113.9 | 29% | 0.288 | 60% | 0.597 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -51.3 | -19.7 | 171.9 | -73.1 | 101.6 | 0 | 0 | 0 | 115.4 | L25 K29 L30 V31 Q155 | L25-W27 PolarHBondContact O-N 2.97Å; W27-K29 PolarHBondContact O-N 3.23Å; W27-K29 VanDerWaalsContact O-N 3.08Å; W27-L30 HydrophobicContact CE3-CD1 4.14Å; W27-L30 HydrophobicContact CH2-CD1 4.42Å; W27-L30 HydrophobicContact CZ3-CD1 3.68Å; W27-L30 PolarHBondContact O-N 3.33Å; W27-L30 VanDerWaalsContact O-N 3.11Å; W27-V31 PolarHBondContact O-N 2.88Å; W27-Q155 HydrophobicContact CH2-CB 4.46Å; W27-Q155 WeakPolarHBondContact CH2-O 3.49Å; W27-Q155 HydrophobicContact CZ2-CB 4.01Å; W27-Q155 WeakPolarHBondContact CZ2-O 3.38Å; W27-Q155 WeakPolarHBondContact CZ3-O 3.5Å |
| 28 | G | 53.3 | Low | 47.7 | Very low | 44 Ų | 44 | 111.8 Ų | 111.8 | 45% | 0.454 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -55.1 | -30.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | S26 Q32 | S26-G28 PolarHBondContact O-N 3.35Å; G28-Q32 VanDerWaalsContact O-CB 3.26Å; G28-Q32 WeakPolarHBondContact O-CB 3.4Å; G28-Q32 PolarHBondContact O-N 3.04Å |
| 29 | K | 50.7 | Low | 47.6 | Very low | 163 Ų | 163 | 111 Ų | 111 | 71% | 0.709 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -78.5 | -25.4 | -179 | -78.2 | 177.1 | 174.2 | 174.1 | 0 | 114.5 | W27 | W27-K29 PolarHBondContact O-N 3.23Å; W27-K29 VanDerWaalsContact O-N 3.08Å |
| 30 | L | 55.5 | Low | 48 | Very low | 54 Ų | 54 | 111.5 Ų | 111.5 | 28% | 0.283 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -88.7 | -42.3 | -179.9 | -69.1 | 174.9 | 0 | 0 | 0 | 110.9 | W27 Q32 R33 L34 | W27-L30 HydrophobicContact CE3-CD1 4.14Å; W27-L30 HydrophobicContact CH2-CD1 4.42Å; W27-L30 HydrophobicContact CZ3-CD1 3.68Å; W27-L30 PolarHBondContact O-N 3.33Å; W27-L30 VanDerWaalsContact O-N 3.11Å; L30-Q32 VanDerWaalsContact C-N 3.34Å; L30-Q32 PolarHBondContact O-N 3.43Å; L30-R33 PolarHBondContact O-N 2.82Å; L30-L34 PolarHBondContact O-N 2.94Å |
| 31 | V | 59.9 | Low | 48.2 | Very low | 91 Ų | 91 | 114 Ų | 114 | 55% | 0.552 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -63 | -40.6 | 177.3 | 177.6 | 0 | 0 | 0 | 0 | 111.5 | W27 R33 L34 A35 | W27-V31 PolarHBondContact O-N 2.88Å; V31-R33 VanDerWaalsContact C-N 3.25Å; V31-R33 PolarHBondContact O-N 3.13Å; V31-L34 PolarHBondContact O-N 3.26Å; V31-A35 PolarHBondContact O-N 2.92Å |
| 32 | Q | 52.4 | Low | 48.3 | Very low | 136 Ų | 136 | 116.4 Ų | 116.4 | 64% | 0.636 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -65 | -29.7 | 179.6 | -167.9 | 158.7 | 19.1 | 0 | 0 | 112.7 | G28 L30 | G28-Q32 VanDerWaalsContact O-CB 3.26Å; G28-Q32 WeakPolarHBondContact O-CB 3.4Å; G28-Q32 PolarHBondContact O-N 3.04Å; L30-Q32 VanDerWaalsContact C-N 3.34Å; L30-Q32 PolarHBondContact O-N 3.43Å |
| 33 | R | 55.3 | Low | 48.5 | Very low | 165 Ų | 165 | 117.2 Ų | 117.2 | 62% | 0.623 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -77.8 | -31.9 | 177.8 | -77.6 | -173.5 | 169.5 | 159 | -2.3 | 113.4 | L30 V31 A35 D36 F37 | L30-R33 PolarHBondContact O-N 2.82Å; V31-R33 VanDerWaalsContact C-N 3.25Å; V31-R33 PolarHBondContact O-N 3.13Å; R33-A35 VanDerWaalsContact C-N 3.32Å; R33-D36 PolarHBondContact O-N 3.24Å; R33-F37 WeakPolarHBondContact O-CD2 3.48Å; R33-F37 WeakPolarHBondContact O-CE2 3.34Å |
| 34 | L | 55.8 | Low | 48.7 | Very low | 51 Ų | 51 | 115 Ų | 115 | 27% | 0.267 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -64.9 | -38 | 176 | -73.1 | 168.2 | 0 | 0 | 0 | 111.6 | L30 V31 D36 F37 E86 | L30-L34 PolarHBondContact O-N 2.94Å; V31-L34 PolarHBondContact O-N 3.26Å; L34-D36 VanDerWaalsContact C-N 3.32Å; L34-D36 PolarHBondContact O-N 3.48Å; L34-F37 PolarHBondContact O-N 3.07Å; L34-E86 WeakPolarHBondContact CD2-OE1 3.34Å |
| 35 | A | 57.2 | Low | 48.5 | Very low | 57 Ų | 57 | 115 Ų | 115 | 47% | 0.471 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -66.3 | -30.8 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | V31 R33 F37 | V31-A35 PolarHBondContact O-N 2.92Å; R33-A35 VanDerWaalsContact C-N 3.32Å; A35-F37 VanDerWaalsContact C-N 3.34Å; A35-F37 PolarHBondContact O-N 3.07Å |
| 36 | D | 46 | Very low | 48.4 | Very low | 111 Ų | 111 | 116 Ų | 116 | 59% | 0.594 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -74.4 | -21.4 | -177 | -68.7 | -25 | 0 | 0 | 0 | 113.1 | R33 L34 | R33-D36 PolarHBondContact O-N 3.24Å; L34-D36 VanDerWaalsContact C-N 3.32Å; L34-D36 PolarHBondContact O-N 3.48Å |
| 37 | F | 47.4 | Very low | 48 | Very low | 163 Ų | 163 | 115.4 Ų | 115.4 | 72% | 0.715 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -88.9 | -27.4 | -176.9 | -72.2 | -71.8 | 0 | 0 | 0 | 114.4 | R33 L34 A35 T39 | R33-F37 WeakPolarHBondContact O-CD2 3.48Å; R33-F37 WeakPolarHBondContact O-CE2 3.34Å; L34-F37 PolarHBondContact O-N 3.07Å; A35-F37 VanDerWaalsContact C-N 3.34Å; A35-F37 PolarHBondContact O-N 3.07Å; F37-T39 PolarHBondContact O-N 3.17Å; F37-T39 VanDerWaalsContact O-N 3.16Å |
| 38 | S | 46.3 | Very low | 47.8 | Very low | 81 Ų | 81 | 117.2 Ų | 117.2 | 57% | 0.566 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | -10.5 | -179.1 | -63.4 | 0 | 0 | 0 | 0 | 114.6 | ||
| 39 | T | 41.8 | Very low | 47.3 | Very low | 113 Ų | 113 | 122 Ų | 122 | 69% | 0.693 | 69% | 0.69 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89 | -7.9 | -174 | -40.5 | 0 | 0 | 0 | 0 | 113.4 | F37 | F37-T39 PolarHBondContact O-N 3.17Å; F37-T39 VanDerWaalsContact O-N 3.16Å |
| 40 | N | 44.9 | Very low | 46.9 | Very low | 151 Ų | 151 | 121.3 Ų | 121.3 | 81% | 0.807 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -104.6 | 0.8 | -170.4 | -87.1 | 10.9 | 0 | 0 | 0 | 116 | ||
| 41 | D | 44.4 | Very low | 46.2 | Very low | 156 Ų | 156 | 122.1 Ų | 122.1 | 83% | 0.834 | 72% | 0.715 | S | S | * | * | trans | -128 | 76.1 | -174.4 | -148.1 | 9.1 | 0 | 0 | 0 | 112.6 | ||||
| 42 | S | 42 | Very low | 45.3 | Very low | 108 Ų | 108 | 123.9 Ų | 123.9 | 76% | 0.755 | 73% | 0.732 | S | S | * | * | trans | -150 | 83.8 | 163.4 | 70.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 43 | S | 43.1 | Very low | 45.5 | Very low | 118 Ų | 118 | 129.2 Ų | 129.2 | 83% | 0.825 | 75% | 0.746 | S | S | * | * | trans | -164.6 | 91 | 158.9 | -83 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 44 | I | 45.8 | Very low | 45 | Very low | 174 Ų | 174 | 127 Ų | 127 | 89% | 0.892 | 76% | 0.756 | S | S | * | * | trans | -142.3 | 130.7 | 147.8 | 51.4 | 169.9 | 0 | 0 | 0 | 110 | ||||
| 45 | E | 39 | Very low | 44.5 | Very low | 198 Ų | 198 | 132 Ų | 132 | 93% | 0.925 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 147 | -171 | -66.1 | 178.1 | 130.3 | 0 | 0 | 113.2 | ||
| 46 | S | 42.4 | Very low | 44.2 | Very low | 130 Ų | 130 | 137 Ų | 137 | 91% | 0.909 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 120 | 172.3 | -65.1 | 0 | 0 | 0 | 0 | 111.6 | ||
| 47 | G | 35.4 | Very low | 44.4 | Very low | 83 Ų | 83 | 137.7 Ų | 137.7 | 86% | 0.856 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -104 | 116.5 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 48 | S | 45.7 | Very low | 44.5 | Very low | 115 Ų | 115 | 137.6 Ų | 137.6 | 80% | 0.804 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -85.3 | 139.4 | 176.3 | -163.8 | 0 | 0 | 0 | 0 | 111 | ||
| 49 | N | 43.1 | Very low | 45 | Very low | 144 Ų | 144 | 139.4 Ų | 139.4 | 77% | 0.77 | 83% | 0.834 | S | S | * | * | trans | -173.1 | 133.8 | 137.5 | -109 | -7.5 | 0 | 0 | 0 | 116.8 | ||||
| 50 | N | 41.2 | Very low | 45.4 | Very low | 148 Ų | 148 | 137.8 Ų | 137.8 | 79% | 0.791 | 84% | 0.839 | S | S | * | * | trans | 56.6 | 121.8 | 142.7 | -74.8 | 6.5 | 0 | 0 | 0 | 122.9 | ||||
| 51 | G | 41.6 | Very low | 45.7 | Very low | 71 Ų | 71 | 136.2 Ų | 136.2 | 73% | 0.732 | 84% | 0.84 | S | S | * | * | trans | -86.4 | 178.2 | 170.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 52 | S | 41.4 | Very low | 45.9 | Very low | 129 Ų | 129 | 136.1 Ų | 136.1 | 90% | 0.902 | 84% | 0.84 | S | S | * | * | trans | -157.8 | 131.3 | 154.2 | -82.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 53 | R | 55.1 | Low | 46.5 | Very low | 248 Ų | 248 | 137.1 Ų | 137.1 | 94% | 0.936 | 84% | 0.841 | S | S | * | * | trans | -88.8 | 138.2 | 175.7 | -56.3 | 165.7 | 87.6 | 179.2 | 6.1 | 107.2 | ||||
| 54 | S | 44.8 | Very low | 46.5 | Very low | 119 Ų | 119 | 141.5 Ų | 141.5 | 83% | 0.832 | 85% | 0.846 | S | S | * | * | trans | -158.5 | 145.6 | 154.5 | 55.5 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 55 | D | 45.8 | Very low | 46.8 | Very low | 155 Ų | 155 | 139.7 Ų | 139.7 | 83% | 0.829 | 84% | 0.838 | S | S | * | * | trans | -82.2 | 161.8 | -155.8 | -65.6 | -59.2 | 0 | 0 | 0 | 116.3 | ||||
| 56 | L | 51 | Low | 47 | Very low | 163 Ų | 163 | 137.3 Ų | 137.3 | 85% | 0.853 | 83% | 0.832 | S | S | * | * | trans | -17 | 132.5 | 158.2 | -53.7 | 170.8 | 0 | 0 | 0 | 117.5 | ||||
| 57 | S | 50.8 | Low | 47.3 | Very low | 125 Ų | 125 | 138 Ų | 138 | 87% | 0.874 | 83% | 0.825 | S | S | * | * | trans | -148.8 | 116.7 | 142.3 | -77.1 | 0 | 0 | 0 | 0 | 110 | ||||
| 58 | D | 48.8 | Very low | 47.6 | Very low | 161 Ų | 161 | 139.3 Ų | 139.3 | 86% | 0.861 | 82% | 0.819 | S | S | * | * | trans | -80.5 | 125 | 172.1 | -176.5 | 22.6 | 0 | 0 | 0 | 108.6 | ||||
| 59 | S | 56.4 | Low | 47.6 | Very low | 118 Ų | 118 | 138.5 Ų | 138.5 | 83% | 0.825 | 81% | 0.811 | S | S | * | * | trans | -160.1 | 101.8 | 167.2 | -84.8 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 60 | G | 50 | Low | 47.7 | Very low | 79 Ų | 79 | 137.1 Ų | 137.1 | 81% | 0.814 | 81% | 0.808 | S | S | * | * | trans | -69.4 | 131.7 | 166.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 61 | S | 52.4 | Low | 47.8 | Very low | 118 Ų | 118 | 135 Ų | 135 | 83% | 0.825 | 80% | 0.796 | S | S | * | * | trans | -145.5 | 125.9 | 150.9 | 70.3 | 0 | 0 | 0 | 0 | 110 | ||||
| 62 | D | 47.4 | Very low | 48.3 | Very low | 155 Ų | 155 | 137.7 Ų | 137.7 | 83% | 0.829 | 79% | 0.794 | S | S | * | * | trans | -72.9 | 149.6 | -177.4 | -68 | -57.3 | 0 | 0 | 0 | 113.4 | ||||
| 63 | V | 55.9 | Low | 48.8 | Very low | 128 Ų | 128 | 137.4 Ų | 137.4 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | trans | 55.2 | 109 | 159.4 | -125.7 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 64 | F | 41.8 | Very low | 48.5 | Very low | 210 Ų | 210 | 132.5 Ų | 132.5 | 92% | 0.921 | 77% | 0.774 | S | S | * | * | -151.5 | 131.8 | 122.2 | -104.9 | -80.9 | 0 | 0 | 0 | 109.8 | D66 | F64-D66 PolarHBondContact O-N 2.99Å; F64-D66 VanDerWaalsContact O-N 3.09Å | |||
| 65 | N | 53 | Low | 48.9 | Very low | 137 Ų | 137 | 136 Ų | 136 | 73% | 0.733 | 78% | 0.775 | S | S | * | * | trans | -60.4 | 99.5 | 175.2 | 175.1 | 82.3 | 0 | 0 | 0 | 110.3 | ||||
| 66 | D | 42.8 | Very low | 49.3 | Very low | 148 Ų | 148 | 134.4 Ų | 134.4 | 79% | 0.791 | 76% | 0.76 | S | S | * | * | trans | -109.5 | 116.4 | 167.5 | -135.1 | -8.7 | 0 | 0 | 0 | 109 | F64 C68 | F64-D66 PolarHBondContact O-N 2.99Å; F64-D66 VanDerWaalsContact O-N 3.09Å; D66-C68 VanDerWaalsContact C-N 3.35Å; D66-C68 PolarHBondContact O-N 2.86Å | ||
| 67 | L | 49.7 | Very low | 50.2 | Low | 145 Ų | 145 | 130.4 Ų | 130.4 | 76% | 0.759 | 74% | 0.74 | S | S | * | * | trans | -66.2 | 93 | 177.4 | -70.3 | 156 | 0 | 0 | 0 | 107.6 | P69 | L67-P69 VanDerWaalsContact O-CD 3.28Å; L67-P69 WeakPolarHBondContact O-CD 3.25Å | ||
| 68 | C | 40.8 | Very low | 51.5 | Low | 109 Ų | 109 | 129.1 Ų | 129.1 | 74% | 0.736 | 73% | 0.728 | S | S | * | * | trans | -63 | 120.2 | 159.4 | -63.7 | 0 | 0 | 0 | 0 | 106.4 | D66 V70 | D66-C68 VanDerWaalsContact C-N 3.35Å; D66-C68 PolarHBondContact O-N 2.86Å; C68-V70 PolarHBondContact O-N 3.1Å | ||
| 69 | P | 45.6 | Very low | 53.1 | Low | 99 Ų | 99 | 126.3 Ų | 126.3 | 64% | 0.643 | 71% | 0.711 | S | S | * | * | trans | -56.5 | 122.9 | 156.7 | 26.6 | -28.4 | 0 | 0 | 0 | 104.4 | L67 N71 | L67-P69 VanDerWaalsContact O-CD 3.28Å; L67-P69 WeakPolarHBondContact O-CD 3.25Å; P69-N71 PolarHBondContact O-N 3.33Å | ||
| 70 | V | 45.7 | Very low | 54.4 | Low | 115 Ų | 115 | 123.1 Ų | 123.1 | 70% | 0.697 | 68% | 0.684 | S | S | * | * | trans | -56.9 | 93.5 | 163.9 | 167.5 | 0 | 0 | 0 | 0 | 104.5 | C68 D72 | C68-V70 PolarHBondContact O-N 3.1Å; V70-D72 WeakPolarHBondContact CG1-OD1 3.49Å; V70-D72 PolarHBondContact O-N 3.4Å | ||
| 71 | N | 43.2 | Very low | 56.2 | Low | 104 Ų | 104 | 125.5 Ų | 125.5 | 56% | 0.556 | 67% | 0.673 | S | S | * | * | trans | -70.9 | 97.3 | 160.6 | -74.9 | -13.9 | 0 | 0 | 0 | 103.3 | P69 D73 | P69-N71 PolarHBondContact O-N 3.33Å; N71-D73 PolarHBondContact O-N 2.87Å | ||
| 72 | D | 52 | Low | 58.1 | Low | 126 Ų | 126 | 122.8 Ų | 122.8 | 67% | 0.674 | 66% | 0.658 | S | S | * | * | G | 310 helix | trans | -54.5 | -7.1 | 169.9 | -82 | -46.8 | 0 | 0 | 0 | 112.4 | V70 | V70-D72 WeakPolarHBondContact CG1-OD1 3.49Å; V70-D72 PolarHBondContact O-N 3.4Å |
| 73 | D | 51 | Low | 60.2 | Low | 124 Ų | 124 | 116.8 Ų | 116.8 | 66% | 0.663 | 63% | 0.626 | S | S | * | * | G | 310 helix | trans | -79.1 | -10.5 | -177.1 | -74.7 | -21.5 | 0 | 0 | 0 | 115.9 | N71 F75 | N71-D73 PolarHBondContact O-N 2.87Å; D73-F75 VanDerWaalsContact C-N 3.32Å; D73-F75 PolarHBondContact O-N 3.05Å |
| 74 | L | 49.7 | Very low | 62.1 | Low | 145 Ų | 145 | 112.3 Ų | 112.3 | 76% | 0.759 | 60% | 0.597 | S | S | * | * | G | 310 helix | trans | -84.5 | 1.7 | -173.5 | -67.4 | 179.6 | 0 | 0 | 0 | 115.4 | ||
| 75 | F | 52.1 | Low | 64.6 | Low | 193 Ų | 193 | 108.5 Ų | 108.5 | 85% | 0.846 | 58% | 0.58 | S | S | * | * | G | 310 helix | trans | -124.3 | 11.9 | 178.1 | -64.9 | -79.1 | 0 | 0 | 0 | 114.1 | D73 D77 | D73-F75 VanDerWaalsContact C-N 3.32Å; D73-F75 PolarHBondContact O-N 3.05Å; F75-D77 PolarHBondContact O-N 3.14Å; F75-D77 VanDerWaalsContact O-N 3.16Å |
| 76 | F | 55.4 | Low | 66.6 | Low | 120 Ų | 120 | 106.5 Ų | 106.5 | 53% | 0.526 | 57% | 0.566 | S | S | . | * | trans | -74.7 | 106.5 | 175.6 | -87.3 | -91.7 | 0 | 0 | 0 | 110.5 | P78 | F76-P78 WeakPolarHBondContact O-CD 3.48Š| ||
| 77 | D | 70 | Confident | 69.2 | Low | 79 Ų | 79 | 99.6 Ų | 99.6 | 42% | 0.422 | 53% | 0.53 | S | S | . | . | trans | -70.9 | 119.6 | 171 | 180 | 0.1 | 0 | 0 | 0 | 109.1 | F75 M79 E80 E81 | F75-D77 PolarHBondContact O-N 3.14Å; F75-D77 VanDerWaalsContact O-N 3.16Å; D77-M79 PolarHBondContact O-N 2.83Å; D77-M79 WeakPolarHBondContact OD1-CB 3.34Å; D77-M79 PolarHBondContact OD1-N 2.83Å; D77-E80 HydrophobicContact CB-CB 3.98Å; D77-E80 WeakPolarHBondContact O-CB 3.47Å; D77-E80 PolarHBondContact O-N 2.72Å; D77-E81 PolarHBondContact O-N 3.23Å; D77-E81 VanDerWaalsContact O-N 3.11Å | ||
| 78 | P | 77.8 | Confident | 71.4 | Confident | 98 Ų | 98 | 93.8 Ų | 93.8 | 64% | 0.636 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -54.3 | -27.9 | 176.5 | -26.1 | 34.9 | 0 | 0 | 0 | 113.6 | F76 A82 | F76-P78 WeakPolarHBondContact O-CD 3.48Å; P78-A82 PolarHBondContact O-N 2.92Å |
| 79 | M | 81.9 | Confident | 74 | Confident | 103 Ų | 103 | 91.7 Ų | 91.7 | 51% | 0.507 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -68.3 | -43.2 | 174 | -173.3 | -167.4 | -62.9 | 0 | 0 | 111.5 | D77 A82 I83 | D77-M79 PolarHBondContact O-N 2.83Å; D77-M79 WeakPolarHBondContact OD1-CB 3.34Å; D77-M79 PolarHBondContact OD1-N 2.83Å; M79-A82 PolarHBondContact O-N 2.76Å; M79-I83 HydrophobicContact CG-CD1 3.96Å; M79-I83 VanDerWaalsContact O-CG1 3.28Å; M79-I83 WeakPolarHBondContact O-CG1 3.39Å; M79-I83 PolarHBondContact O-N 2.85Å; M79-I83 VanDerWaalsContact O-N 3.1Å; M79-I83 HydrophobicContact SD-CD1 4.47Å |
| 80 | E | 83.8 | Confident | 76.3 | Confident | 51 Ų | 51 | 87.7 Ų | 87.7 | 24% | 0.238 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -67.5 | -37.5 | -178.9 | -172.4 | 164.6 | -127.4 | 0 | 0 | 111.4 | D77 I83 L84 I125 | D77-E80 HydrophobicContact CB-CB 3.98Å; D77-E80 WeakPolarHBondContact O-CB 3.47Å; D77-E80 PolarHBondContact O-N 2.72Å; E80-I83 PolarHBondContact O-N 2.92Å; E80-L84 WeakPolarHBondContact O-CB 3.32Å; E80-L84 PolarHBondContact O-N 3.5Å; E80-I125 HydrophobicContact CG-CD1 3.59Å |
| 81 | E | 88.2 | Confident | 78.6 | Confident | 128 Ų | 128 | 82.4 Ų | 82.4 | 60% | 0.598 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -61.3 | -44.4 | 172.9 | -173.6 | -176.9 | 178.9 | 0 | 0 | 112.1 | D77 I83 L84 K85 | D77-E81 PolarHBondContact O-N 3.23Å; D77-E81 VanDerWaalsContact O-N 3.11Å; E81-I83 VanDerWaalsContact C-N 3.35Å; E81-I83 PolarHBondContact O-N 3.23Å; E81-L84 WeakPolarHBondContact O-CB 3.37Å; E81-L84 PolarHBondContact O-N 2.92Å; E81-K85 WeakPolarHBondContact O-CB 3.28Å; E81-K85 PolarHBondContact O-N 2.95Å |
| 82 | A | 91.7 | Very high | 81 | Confident | 61 Ų | 61 | 77.6 Ų | 77.6 | 50% | 0.504 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.4 | -43.3 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | P78 M79 K85 E86 | P78-A82 PolarHBondContact O-N 2.92Å; M79-A82 PolarHBondContact O-N 2.76Å; A82-K85 PolarHBondContact O-N 3.41Å; A82-E86 PolarHBondContact O-N 2.77Å |
| 83 | I | 93.1 | Very high | 82.9 | Confident | 30 Ų | 30 | 76 Ų | 76 | 15% | 0.154 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -65.7 | -43.8 | 178.1 | -67 | 168.2 | 0 | 0 | 0 | 110.4 | M79 E80 E81 K85 E86 V87 L135 R136 V158 | M79-I83 HydrophobicContact CG-CD1 3.96Å; M79-I83 VanDerWaalsContact O-CG1 3.28Å; M79-I83 WeakPolarHBondContact O-CG1 3.39Å; M79-I83 PolarHBondContact O-N 2.85Å; M79-I83 VanDerWaalsContact O-N 3.1Å; M79-I83 HydrophobicContact SD-CD1 4.47Å; E80-I83 PolarHBondContact O-N 2.92Å; E81-I83 VanDerWaalsContact C-N 3.35Å; E81-I83 PolarHBondContact O-N 3.23Å; I83-K85 VanDerWaalsContact C-N 3.31Å; I83-K85 PolarHBondContact O-N 3.2Å; I83-E86 PolarHBondContact O-N 2.87Å; I83-V87 HydrophobicContact CG2-CG2 4.31Å; I83-V87 WeakPolarHBondContact O-CB 3.46Å; I83-V87 VanDerWaalsContact O-CG2 3.31Å; I83-V87 WeakPolarHBondContact O-CG2 3.34Å; I83-V87 PolarHBondContact O-N 2.94Å; I83-L135 HydrophobicContact CG2-CD2 4.27Å; I83-R136 HydrophobicContact CD1-CG 3.5Å; I83-R136 HydrophobicContact CG2-CG 4.49Å; I83-V158 HydrophobicContact CG2-CG1 3.58Å |
| 84 | L | 95 | Very high | 84.8 | Confident | 33 Ų | 33 | 71.7 Ų | 71.7 | 17% | 0.173 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -55.6 | -49.5 | 175.9 | 179.6 | 60.7 | 0 | 0 | 0 | 111.3 | E80 E81 E86 V87 V88 G121 I125 L135 | E80-L84 WeakPolarHBondContact O-CB 3.32Å; E80-L84 PolarHBondContact O-N 3.5Å; E81-L84 WeakPolarHBondContact O-CB 3.37Å; E81-L84 PolarHBondContact O-N 2.92Å; L84-E86 VanDerWaalsContact C-N 3.32Å; L84-E86 PolarHBondContact O-N 3.5Å; L84-V87 PolarHBondContact O-N 3.03Å; L84-V88 HydrophobicContact CD1-CG2 4.14Å; L84-V88 HydrophobicContact CG-CG2 4.47Å; L84-V88 WeakPolarHBondContact O-CB 3.06Å; L84-V88 WeakPolarHBondContact O-CG2 3.35Å; L84-V88 PolarHBondContact O-N 2.87Å; L84-G121 WeakPolarHBondContact CD1-O 3.39Å; L84-I125 HydrophobicContact CB-CD1 4.26Å; L84-I125 HydrophobicContact CB-CG1 4.47Å; L84-I125 HydrophobicContact CD1-CD1 4.1Å; L84-I125 HydrophobicContact CD1-CG1 3.77Å; L84-I125 HydrophobicContact CD2-CD1 4.41Å; L84-I125 HydrophobicContact CD2-CG1 3.75Å; L84-I125 HydrophobicContact CG-CD1 4.49Å; L84-I125 HydrophobicContact CG-CG1 4.19Å; L84-L135 HydrophobicContact CB-CD2 4.45Å; L84-L135 HydrophobicContact CD1-CD2 4.02Å |
| 85 | K | 94.8 | Very high | 86.7 | Confident | 131 Ų | 131 | 64.8 Ų | 64.8 | 57% | 0.57 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -58.8 | -45.1 | 179.3 | -175.3 | -177.4 | 175.7 | -61.6 | 0 | 111.3 | E81 A82 I83 V88 D89 | E81-K85 WeakPolarHBondContact O-CB 3.28Å; E81-K85 PolarHBondContact O-N 2.95Å; A82-K85 PolarHBondContact O-N 3.41Å; I83-K85 VanDerWaalsContact C-N 3.31Å; I83-K85 PolarHBondContact O-N 3.2Å; K85-V88 PolarHBondContact O-N 3.05Å; K85-D89 IonicContact NZ-OD2 3.01Å; K85-D89 PolarHBondContact NZ-OD2 2.91Å; K85-D89 WeakPolarHBondContact O-CB 3.4Å; K85-D89 PolarHBondContact O-N 2.86Å |
| 86 | E | 95 | Very high | 88.5 | Confident | 94 Ų | 94 | 61.5 Ų | 61.5 | 44% | 0.439 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.8 | -44.5 | 177.9 | -175.7 | 175.5 | -175.9 | 0 | 0 | 112.4 | L34 A82 I83 L84 D89 L90 | L34-E86 WeakPolarHBondContact CD2-OE1 3.34Å; A82-E86 PolarHBondContact O-N 2.77Å; I83-E86 PolarHBondContact O-N 2.87Å; L84-E86 VanDerWaalsContact C-N 3.32Å; L84-E86 PolarHBondContact O-N 3.5Å; E86-D89 PolarHBondContact O-N 3.39Å; E86-L90 HydrophobicContact CG-CD1 4.18Å; E86-L90 WeakPolarHBondContact O-CB 3.49Å; E86-L90 WeakPolarHBondContact O-CG 3.49Å; E86-L90 PolarHBondContact O-N 2.79Å |
| 87 | V | 95.9 | Very high | 89.9 | Confident | 4 Ų | 4 | 60.9 Ų | 60.9 | 2% | 0.024 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.1 | -47.1 | 177.5 | 168 | 0 | 0 | 0 | 0 | 111 | I83 L84 D89 L90 I91 L124 L135 I140 L156 V158 | I83-V87 HydrophobicContact CG2-CG2 4.31Å; I83-V87 WeakPolarHBondContact O-CB 3.46Å; I83-V87 VanDerWaalsContact O-CG2 3.31Å; I83-V87 WeakPolarHBondContact O-CG2 3.34Å; I83-V87 PolarHBondContact O-N 2.94Å; L84-V87 PolarHBondContact O-N 3.03Å; V87-D89 VanDerWaalsContact C-N 3.35Å; V87-D89 PolarHBondContact O-N 2.85Å; V87-L90 WeakPolarHBondContact O-CB 3.35Å; V87-L90 PolarHBondContact O-N 3.05Å; V87-I91 HydrophobicContact CG1-CD1 3.91Å; V87-I91 WeakPolarHBondContact O-CG1 3.5Å; V87-I91 PolarHBondContact O-N 2.73Å; V87-L124 HydrophobicContact CG1-CD1 4.09Å; V87-L135 HydrophobicContact CG2-CD2 4.36Å; V87-I140 HydrophobicContact CG1-CD1 3.47Å; V87-I140 VanDerWaalsContact CG1-CD1 3.47Å; V87-L156 HydrophobicContact CG1-CD2 4.26Å; V87-L156 HydrophobicContact CG2-CD2 4.38Å; V87-V158 HydrophobicContact CG2-CB 4.4Å; V87-V158 HydrophobicContact CG2-CG1 3.74Å; V87-V158 HydrophobicContact CG2-CG2 4Å |
| 88 | V | 96.3 | Very high | 90.6 | Very high | 22 Ų | 22 | 57.2 Ų | 57.2 | 13% | 0.133 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -64.1 | -41 | 178 | 172.3 | 0 | 0 | 0 | 0 | 111 | L84 K85 L90 I91 A92 L117 | L84-V88 HydrophobicContact CD1-CG2 4.14Å; L84-V88 HydrophobicContact CG-CG2 4.47Å; L84-V88 WeakPolarHBondContact O-CB 3.06Å; L84-V88 WeakPolarHBondContact O-CG2 3.35Å; L84-V88 PolarHBondContact O-N 2.87Å; K85-V88 PolarHBondContact O-N 3.05Å; V88-L90 VanDerWaalsContact C-N 3.32Å; V88-L90 PolarHBondContact O-N 2.81Å; V88-I91 PolarHBondContact O-N 2.79Å; V88-A92 WeakPolarHBondContact O-CB 3.32Å; V88-A92 PolarHBondContact O-N 3.03Å; V88-L117 HydrophobicContact CG1-CB 3.77Å; V88-L117 HydrophobicContact CG1-CD2 4.3Å; V88-L117 HydrophobicContact CG1-CG 4.42Å |
| 89 | D | 95.1 | Very high | 90.6 | Very high | 65 Ų | 65 | 55.8 Ų | 55.8 | 35% | 0.348 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.3 | -38.3 | 174.6 | -80.3 | -28.5 | 0 | 0 | 0 | 111.7 | K85 E86 V87 R93 | K85-D89 IonicContact NZ-OD2 3.01Å; K85-D89 PolarHBondContact NZ-OD2 2.91Å; K85-D89 WeakPolarHBondContact O-CB 3.4Å; K85-D89 PolarHBondContact O-N 2.86Å; E86-D89 PolarHBondContact O-N 3.39Å; V87-D89 VanDerWaalsContact C-N 3.35Å; V87-D89 PolarHBondContact O-N 2.85Å; D89-R93 WeakPolarHBondContact O-CB 3.19Å; D89-R93 VanDerWaalsContact O-CG 3.32Å; D89-R93 WeakPolarHBondContact O-CG 3.35Å; D89-R93 PolarHBondContact O-N 3.24Å; D89-R93 PolarHBondContact O-NE 2.78Å |
| 90 | L | 94.5 | Very high | 90 | Very high | 15 Ų | 15 | 55.6 Ų | 55.6 | 8% | 0.079 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -65.8 | -45.6 | 174.4 | -87.3 | 162.8 | 0 | 0 | 0 | 112.3 | E86 V87 V88 A92 R93 S94 L156 | E86-L90 HydrophobicContact CG-CD1 4.18Å; E86-L90 WeakPolarHBondContact O-CB 3.49Å; E86-L90 WeakPolarHBondContact O-CG 3.49Å; E86-L90 PolarHBondContact O-N 2.79Å; V87-L90 WeakPolarHBondContact O-CB 3.35Å; V87-L90 PolarHBondContact O-N 3.05Å; V88-L90 VanDerWaalsContact C-N 3.32Å; V88-L90 PolarHBondContact O-N 2.81Å; L90-A92 VanDerWaalsContact C-N 3.35Å; L90-R93 VanDerWaalsContact CD2-NH1 3.31Å; L90-R93 VanDerWaalsContact CD2-NH2 3.31Å; L90-R93 VanDerWaalsContact CG-NH2 3.25Å; L90-R93 PolarHBondContact O-N 2.87Å; L90-S94 WeakPolarHBondContact O-CB 3.46Å; L90-S94 PolarHBondContact O-N 3.3Å; L90-S94 PolarHBondContact O-OG 3.33Å; L90-L156 HydrophobicContact CB-CD2 4.05Å; L90-L156 HydrophobicContact CD1-CD1 3.89Å; L90-L156 HydrophobicContact CD1-CD2 3.85Å |
| 91 | I | 95 | Very high | 88.6 | Confident | 5 Ų | 5 | 55.9 Ų | 55.9 | 3% | 0.026 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -59.3 | -49.6 | 176.2 | -70.3 | 165.3 | 0 | 0 | 0 | 109.4 | V87 V88 R93 S94 L95 I120 L124 L142 L170 | V87-I91 HydrophobicContact CG1-CD1 3.91Å; V87-I91 WeakPolarHBondContact O-CG1 3.5Å; V87-I91 PolarHBondContact O-N 2.73Å; V88-I91 PolarHBondContact O-N 2.79Å; I91-R93 VanDerWaalsContact C-N 3.31Å; I91-R93 PolarHBondContact O-N 3.38Å; I91-S94 PolarHBondContact O-N 3.5Å; I91-L95 HydrophobicContact CG2-CD1 3.94Å; I91-L95 WeakPolarHBondContact O-CG 3.09Å; I91-L95 PolarHBondContact O-N 2.99Å; I91-I120 HydrophobicContact CD1-CG2 4.26Å; I91-L124 HydrophobicContact CD1-CD1 3.96Å; I91-L142 HydrophobicContact CG2-CD1 4.23Å; I91-L142 HydrophobicContact CG2-CD2 4.32Å; I91-L170 HydrophobicContact CD1-CD2 4Å; I91-L170 HydrophobicContact CG2-CD2 4.29Å |
| 92 | A | 93.8 | Very high | 87.5 | Confident | 2 Ų | 2 | 57.2 Ų | 57.2 | 2% | 0.017 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -61.5 | -39.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | V88 L90 R96 L117 | V88-A92 WeakPolarHBondContact O-CB 3.32Å; V88-A92 PolarHBondContact O-N 3.03Å; L90-A92 VanDerWaalsContact C-N 3.35Å; A92-R96 VanDerWaalsContact C-CZ 3.5Å; A92-R96 WeakPolarHBondContact O-CG 3.07Å; A92-R96 VanDerWaalsContact O-CZ 3.25Å; A92-R96 PolarHBondContact O-N 3.15Å; A92-R96 PolarHBondContact O-NE 3.43Å; A92-R96 PolarHBondContact O-NH1 2.89Å; A92-L117 HydrophobicContact CB-CD1 3.71Å; A92-L117 HydrophobicContact CB-CD2 4.11Å |
| 93 | R | 91.4 | Very high | 86.2 | Confident | 93 Ų | 93 | 55.6 Ų | 55.6 | 35% | 0.351 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -64.9 | -48.2 | 173.6 | -78.7 | -177.6 | -75.3 | 124.4 | -14.1 | 111.9 | D89 L90 I91 L95 R96 E97 | D89-R93 WeakPolarHBondContact O-CB 3.19Å; D89-R93 VanDerWaalsContact O-CG 3.32Å; D89-R93 WeakPolarHBondContact O-CG 3.35Å; D89-R93 PolarHBondContact O-N 3.24Å; D89-R93 PolarHBondContact O-NE 2.78Å; L90-R93 VanDerWaalsContact CD2-NH1 3.31Å; L90-R93 VanDerWaalsContact CD2-NH2 3.31Å; L90-R93 VanDerWaalsContact CG-NH2 3.25Å; L90-R93 PolarHBondContact O-N 2.87Å; I91-R93 VanDerWaalsContact C-N 3.31Å; I91-R93 PolarHBondContact O-N 3.38Å; R93-L95 VanDerWaalsContact C-N 3.27Å; R93-L95 PolarHBondContact O-N 3.19Å; R93-R96 PolarHBondContact O-N 3.47Å; R93-E97 WeakPolarHBondContact O-CG 3.42Å; R93-E97 PolarHBondContact O-N 3.5Å |
| 94 | S | 90.4 | Very high | 85.2 | Confident | 34 Ų | 34 | 54.9 Ų | 54.9 | 24% | 0.238 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -57.3 | -41.6 | -180 | -57.3 | 0 | 0 | 0 | 0 | 111.5 | L90 I91 R96 E97 A98 | L90-S94 WeakPolarHBondContact O-CB 3.46Å; L90-S94 PolarHBondContact O-N 3.3Å; L90-S94 PolarHBondContact O-OG 3.33Å; I91-S94 PolarHBondContact O-N 3.5Å; S94-R96 PolarHBondContact O-N 3.11Å; S94-E97 PolarHBondContact O-N 3.08Å; S94-A98 VanDerWaalsContact O-CB 3.32Å; S94-A98 WeakPolarHBondContact O-CB 2.7Å; S94-A98 PolarHBondContact O-N 2.76Å |
| 95 | L | 90.5 | Very high | 84.4 | Confident | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -64.3 | -39.9 | 175.5 | -69.5 | 167.7 | 0 | 0 | 0 | 113.1 | I91 R93 E97 A98 L110 I112 L142 V144 L172 L203 | I91-L95 HydrophobicContact CG2-CD1 3.94Å; I91-L95 WeakPolarHBondContact O-CG 3.09Å; I91-L95 PolarHBondContact O-N 2.99Å; R93-L95 VanDerWaalsContact C-N 3.27Å; R93-L95 PolarHBondContact O-N 3.19Å; L95-E97 VanDerWaalsContact C-N 3.34Å; L95-A98 PolarHBondContact O-N 2.87Å; L95-L110 HydrophobicContact CB-CD2 3.86Å; L95-L110 VanDerWaalsContact O-CD2 3.27Å; L95-L110 WeakPolarHBondContact O-CD2 3.4Å; L95-I112 HydrophobicContact CB-CD1 3.97Å; L95-I112 HydrophobicContact CD1-CD1 4.11Å; L95-L142 HydrophobicContact CD2-CD2 4.13Å; L95-L142 HydrophobicContact CG-CD2 4.18Å; L95-V144 HydrophobicContact CD2-CG2 4.18Å; L95-L172 HydrophobicContact CD1-CD1 3.65Å; L95-L172 HydrophobicContact CD2-CD1 3.59Å; L95-L172 HydrophobicContact CG-CD1 4.2Å; L95-L203 HydrophobicContact CD1-CD1 4Å |
| 96 | R | 88.2 | Confident | 83.6 | Confident | 124 Ų | 124 | 56.2 Ų | 56.2 | 47% | 0.468 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -68.3 | -34.5 | 178 | -74 | -175.4 | -66.6 | -93.4 | 7 | 112.5 | A92 R93 S94 K99 I112 | A92-R96 VanDerWaalsContact C-CZ 3.5Å; A92-R96 WeakPolarHBondContact O-CG 3.07Å; A92-R96 VanDerWaalsContact O-CZ 3.25Å; A92-R96 PolarHBondContact O-N 3.15Å; A92-R96 PolarHBondContact O-NE 3.43Å; A92-R96 PolarHBondContact O-NH1 2.89Å; R93-R96 PolarHBondContact O-N 3.47Å; S94-R96 PolarHBondContact O-N 3.11Å; R96-K99 WeakPolarHBondContact O-CB 3.33Å; R96-I112 HydrophobicContact CG-CD1 4.42Å |
| 97 | E | 85.7 | Confident | 82.8 | Confident | 107 Ų | 107 | 51.9 Ų | 51.9 | 50% | 0.5 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -75.2 | -31.6 | 176.5 | -68.8 | 175.8 | -174.2 | 0 | 0 | 111.8 | R93 S94 L95 K99 D100 | R93-E97 WeakPolarHBondContact O-CG 3.42Å; R93-E97 PolarHBondContact O-N 3.5Å; S94-E97 PolarHBondContact O-N 3.08Å; L95-E97 VanDerWaalsContact C-N 3.34Å; E97-K99 PolarHBondContact O-N 2.84Å; E97-D100 PolarHBondContact O-N 2.98Å |
| 98 | A | 83.8 | Confident | 82 | Confident | 2 Ų | 2 | 55.3 Ų | 55.3 | 2% | 0.017 | 27% | 0.274 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | 0.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | S94 L95 C103 L105 I153 | S94-A98 VanDerWaalsContact O-CB 3.32Å; S94-A98 WeakPolarHBondContact O-CB 2.7Å; S94-A98 PolarHBondContact O-N 2.76Å; L95-A98 PolarHBondContact O-N 2.87Å; A98-C103 VanDerWaalsContact CA-SG 3.52Å; A98-C103 WeakPolarHBondContact O-CB 3.38Å; A98-L105 HydrophobicContact CB-CD1 4.08Å; A98-L105 HydrophobicContact CB-CG 4.3Å; A98-L105 WeakPolarHBondContact O-CB 3.38Å; A98-L105 PolarHBondContact O-N 2.81Å; A98-I153 HydrophobicContact CB-CD1 4.12Å; A98-I153 HydrophobicContact CB-CG2 3.69Å |
| 99 | K | 78.3 | Confident | 81.4 | Confident | 67 Ų | 67 | 60 Ų | 60 | 29% | 0.291 | 29% | 0.293 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.2 | -33.1 | -179.8 | 178.7 | -176 | 85.4 | -171.6 | 0 | 113.3 | R96 E97 C107 T108 | R96-K99 WeakPolarHBondContact O-CB 3.33Å; E97-K99 PolarHBondContact O-N 2.84Å; K99-C107 WeakPolarHBondContact CG-O 3.46Å; K99-C107 PolarHBondContact O-N 2.97Å; K99-C107 VanDerWaalsContact O-N 3.14Å; K99-T108 WeakPolarHBondContact CD-O 3.35Å |
| 100 | D | 70.4 | Confident | 81.1 | Confident | 99 Ų | 99 | 58 Ų | 58 | 53% | 0.529 | 28% | 0.281 | S | S | . | . | S | Bend | trans | -64.5 | 157 | -167.8 | -71.6 | -17.5 | 0 | 0 | 0 | 112.9 | E97 D102 C103 | E97-D100 PolarHBondContact O-N 2.98Å; D100-D102 PolarHBondContact O-N 2.86Å; D100-C103 WeakPolarHBondContact O-CA 3.27Å; D100-C103 WeakPolarHBondContact O-CB 3.46Å; D100-C103 PolarHBondContact O-N 2.87Å |
| 101 | S | 54.4 | Low | 81 | Confident | 57 Ų | 57 | 60.7 Ų | 60.7 | 40% | 0.399 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.3 | -21.4 | -167 | 35.3 | 0 | 0 | 0 | 0 | 115.9 | C103 | S101-C103 VanDerWaalsContact C-N 3.35Š|
| 102 | D | 63.7 | Low | 80.8 | Confident | 157 Ų | 157 | 62.5 Ų | 62.5 | 84% | 0.84 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93 | 3.5 | 176.9 | -62.4 | -42.4 | 0 | 0 | 0 | 112.8 | D100 | D100-D102 PolarHBondContact O-N 2.86Š|
| 103 | C | 65.4 | Low | 80.8 | Confident | 27 Ų | 27 | 63.4 Ų | 63.4 | 18% | 0.182 | 31% | 0.311 | C | S | . | . | S | Bend | trans | -114.3 | 175 | -174.7 | -151.8 | 0 | 0 | 0 | 0 | 112.9 | A98 D100 S101 L105 R106 | A98-C103 VanDerWaalsContact CA-SG 3.52Å; A98-C103 WeakPolarHBondContact O-CB 3.38Å; D100-C103 WeakPolarHBondContact O-CA 3.27Å; D100-C103 WeakPolarHBondContact O-CB 3.46Å; D100-C103 PolarHBondContact O-N 2.87Å; S101-C103 VanDerWaalsContact C-N 3.35Å; C103-L105 PolarHBondContact O-N 3.49Å; C103-R106 VanDerWaalsContact O-CG 3.25Å; C103-R106 WeakPolarHBondContact O-CG 3.26Å |
| 104 | A | 72.3 | Confident | 80.5 | Confident | 15 Ų | 15 | 67.6 Ų | 67.6 | 12% | 0.124 | 33% | 0.334 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -61.1 | -34.2 | -166.1 | 0 | 0 | 0 | 0 | 0 | 115.6 | Q146 E151 I153 | A104-Q146 PolarHBondContact O-NE2 3.47Å; A104-E151 HydrophobicContact CB-CB 4.03Å; A104-I153 HydrophobicContact CB-CD1 3.56Å |
| 105 | L | 78.3 | Confident | 80.6 | Confident | 5 Ų | 5 | 72.5 Ų | 72.5 | 3% | 0.026 | 35% | 0.351 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.1 | -19.8 | -171 | -58.6 | 179 | 0 | 0 | 0 | 114.3 | A98 C103 C107 L110 V144 I153 L201 | A98-L105 HydrophobicContact CB-CD1 4.08Å; A98-L105 HydrophobicContact CB-CG 4.3Å; A98-L105 WeakPolarHBondContact O-CB 3.38Å; A98-L105 PolarHBondContact O-N 2.81Å; C103-L105 PolarHBondContact O-N 3.49Å; L105-C107 VanDerWaalsContact C-N 3.26Å; L105-C107 PolarHBondContact O-N 2.77Å; L105-C107 VanDerWaalsContact O-N 3.1Å; L105-L110 HydrophobicContact CD1-CD1 4.24Å; L105-L110 HydrophobicContact CD1-CD2 3.88Å; L105-V144 HydrophobicContact CD2-CB 3.8Å; L105-V144 HydrophobicContact CD2-CG1 3.66Å; L105-V144 HydrophobicContact CD2-CG2 3.96Å; L105-I153 HydrophobicContact CD2-CD1 4.19Å; L105-I153 HydrophobicContact CG-CD1 4.18Å; L105-L201 HydrophobicContact CB-CD1 4.45Å; L105-L201 WeakPolarHBondContact O-CD1 3.46Å |
| 106 | R | 76.6 | Confident | 80.8 | Confident | 187 Ų | 187 | 72.5 Ų | 72.5 | 71% | 0.706 | 35% | 0.352 | S | S | * | . | trans | 45 | 44.4 | 175.6 | -57 | -175.5 | 177.2 | 174.7 | 2.1 | 114.4 | C103 | C103-R106 VanDerWaalsContact O-CG 3.25Å; C103-R106 WeakPolarHBondContact O-CG 3.26Å | ||
| 107 | C | 78.3 | Confident | 81.2 | Confident | 2 Ų | 2 | 68.2 Ų | 68.2 | 1% | 0.014 | 34% | 0.338 | C | S | . | . | trans | -117.9 | 165.9 | -176.2 | 65 | 0 | 0 | 0 | 0 | 112.3 | K99 L105 Q199 L201 | K99-C107 WeakPolarHBondContact CG-O 3.46Å; K99-C107 PolarHBondContact O-N 2.97Å; K99-C107 VanDerWaalsContact O-N 3.14Å; L105-C107 VanDerWaalsContact C-N 3.26Å; L105-C107 PolarHBondContact O-N 2.77Å; L105-C107 VanDerWaalsContact O-N 3.1Å; C107-Q199 WeakPolarHBondContact CB-O 3.28Å; C107-L201 HydrophobicContact CB-CB 4.28Å; C107-L201 HydrophobicContact CB-CD1 3.62Å; C107-L201 HydrophobicContact CB-CG 3.63Å | ||
| 108 | T | 79.5 | Confident | 81.6 | Confident | 76 Ų | 76 | 68.3 Ų | 68.3 | 47% | 0.466 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -92.5 | -26 | 174.4 | 41.8 | 0 | 0 | 0 | 0 | 112.5 | K99 R198 Q199 | K99-T108 WeakPolarHBondContact CD-O 3.35Å; T108-R198 HydrophobicContact CG2-CB 3.43Å; T108-R198 VanDerWaalsContact CG2-CB 3.43Å; T108-R198 HydrophobicContact CG2-CG 4.32Å; T108-R198 PolarHBondContact OG1-O 3.06Å; T108-Q199 PolarHBondContact N-O 3.01Å |
| 109 | K | 84.5 | Confident | 82.2 | Confident | 122 Ų | 122 | 72 Ų | 72 | 53% | 0.53 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148 | 133.1 | -178.6 | -172 | 174.6 | -172.4 | -178.6 | 0 | 108.8 | L111 A200 L201 | K109-L111 HydrophobicContact CD-CD2 4.19Å; K109-L111 HydrophobicContact CG-CD2 4.29Å; K109-A200 HydrophobicContact CB-CB 4.01Å; K109-A200 CarbonylContact O-C 3.5Å; K109-A200 WeakPolarHBondContact O-CA 3.42Å; K109-L201 PolarHBondContact O-N 3.16Å |
| 110 | L | 88.6 | Confident | 83.1 | Confident | 21 Ų | 21 | 68.9 Ų | 68.9 | 11% | 0.11 | 34% | 0.341 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 126 | 171 | -174.5 | 67 | 0 | 0 | 0 | 108.5 | L95 L105 I112 L201 L203 | L95-L110 HydrophobicContact CB-CD2 3.86Å; L95-L110 VanDerWaalsContact O-CD2 3.27Å; L95-L110 WeakPolarHBondContact O-CD2 3.4Å; L105-L110 HydrophobicContact CD1-CD1 4.24Å; L105-L110 HydrophobicContact CD1-CD2 3.88Å; L110-I112 HydrophobicContact CD2-CD1 4.38Å; L110-I112 HydrophobicContact CD2-CG1 4.25Å; L110-I112 HydrophobicContact CG-CG1 4.27Å; L110-L201 CarbonylContact C-O 3.53Å; L110-L201 WeakPolarHBondContact CA-O 3.33Å; L110-L201 HydrophobicContact CD1-CB 4.01Å; L110-L203 HydrophobicContact CD1-CD2 4.13Å; L110-L203 HydrophobicContact CD1-CG 4.16Å |
| 111 | L | 91.2 | Very high | 84.3 | Confident | 72 Ų | 72 | 64.3 Ų | 64.3 | 38% | 0.377 | 32% | 0.317 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.1 | 119.7 | 173.8 | -58.1 | 177.3 | 0 | 0 | 0 | 108.6 | K109 L201 K202 L203 | K109-L111 HydrophobicContact CD-CD2 4.19Å; K109-L111 HydrophobicContact CG-CD2 4.29Å; L111-L201 PolarHBondContact N-O 3.05Å; L111-K202 HydrophobicContact CB-CB 3.98Å; L111-K202 HydrophobicContact CB-CD 4.29Å; L111-K202 HydrophobicContact CB-CG 4Å; L111-K202 HydrophobicContact CD1-CB 4.29Å; L111-K202 HydrophobicContact CD1-CD 4.25Å; L111-K202 WeakPolarHBondContact O-CA 3.41Å; L111-L203 PolarHBondContact O-N 3.41Å |
| 112 | I | 92.8 | Very high | 86.2 | Confident | 43 Ų | 43 | 66.8 Ų | 66.8 | 22% | 0.221 | 32% | 0.323 | C | S | . | . | trans | -107.6 | 117 | 177.4 | -54.9 | 178.8 | 0 | 0 | 0 | 106.8 | L95 R96 L110 L116 L117 L203 | L95-I112 HydrophobicContact CB-CD1 3.97Å; L95-I112 HydrophobicContact CD1-CD1 4.11Å; R96-I112 HydrophobicContact CG-CD1 4.42Å; L110-I112 HydrophobicContact CD2-CD1 4.38Å; L110-I112 HydrophobicContact CD2-CG1 4.25Å; L110-I112 HydrophobicContact CG-CG1 4.27Å; I112-L116 HydrophobicContact CG2-CD2 4.37Å; I112-L117 HydrophobicContact CG2-CD1 4.1Å; I112-L117 HydrophobicContact CG2-CD2 4.24Å; I112-L117 HydrophobicContact CG2-CG 3.93Å; I112-L203 HydrophobicContact CB-CD1 4.5Å; I112-L203 HydrophobicContact CG1-CD1 3.99Å; I112-L203 HydrophobicContact CG2-CD1 4.3Å | ||
| 113 | P | 92.9 | Very high | 87.8 | Confident | 22 Ų | 22 | 60.5 Ų | 60.5 | 14% | 0.143 | 29% | 0.289 | C | S | . | . | trans | -58.9 | 137 | 173.4 | -22.1 | 32.4 | 0 | 0 | 0 | 111.1 | K115 L116 L203 T205 | P113-K115 PolarHBondContact O-N 3.12Å; P113-L116 HydrophobicContact CB-CB 4.04Å; P113-L116 HydrophobicContact CG-CB 4.39Å; P113-L116 VanDerWaalsContact O-CB 3.3Å; P113-L116 WeakPolarHBondContact O-CB 3.17Å; P113-L116 PolarHBondContact O-N 2.75Å; P113-L116 VanDerWaalsContact O-N 3.12Å; P113-L203 VanDerWaalsContact CG-O 3.28Å; P113-L203 WeakPolarHBondContact CG-O 3.47Å; P113-T205 HydrophobicContact CB-CG2 3.94Å; P113-T205 HydrophobicContact CG-CG2 4.04Å | ||
| 114 | E | 85.4 | Confident | 89.3 | Confident | 180 Ų | 180 | 59.2 Ų | 59.2 | 84% | 0.841 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -58 | -48.5 | -176.3 | -173.1 | 173.5 | -170.9 | 0 | 0 | 112.1 | L116 L117 | E114-L116 PolarHBondContact O-N 3.19Å; E114-L117 PolarHBondContact O-N 3.33Å |
| 115 | K | 92.1 | Very high | 90.4 | Very high | 137 Ų | 137 | 59.8 Ų | 59.8 | 60% | 0.596 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -67.7 | -17.3 | 178.9 | -61.2 | -166.6 | 174.4 | -162.6 | 0 | 114.7 | P113 H119 | P113-K115 PolarHBondContact O-N 3.12Å; K115-H119 VanDerWaalsContact O-CG 3.24Å; K115-H119 PolarHBondContact O-N 2.77Å; K115-H119 VanDerWaalsContact O-N 3.09Å; K115-H119 PolarHBondContact O-ND1 2.77Å |
| 116 | L | 95 | Very high | 91.2 | Very high | 1 Ų | 1 | 65.1 Ų | 65.1 | 1% | 0.005 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.7 | -45.1 | -179.6 | 173.2 | 63.5 | 0 | 0 | 0 | 110.5 | I112 P113 E114 E118 H119 I120 L172 L203 S204 F207 | I112-L116 HydrophobicContact CG2-CD2 4.37Å; P113-L116 HydrophobicContact CB-CB 4.04Å; P113-L116 HydrophobicContact CG-CB 4.39Å; P113-L116 VanDerWaalsContact O-CB 3.3Å; P113-L116 WeakPolarHBondContact O-CB 3.17Å; P113-L116 PolarHBondContact O-N 2.75Å; P113-L116 VanDerWaalsContact O-N 3.12Å; E114-L116 PolarHBondContact O-N 3.19Å; L116-E118 VanDerWaalsContact C-N 3.33Å; L116-E118 PolarHBondContact O-N 3.35Å; L116-H119 PolarHBondContact O-N 2.97Å; L116-I120 HydrophobicContact CD1-CD1 3.84Å; L116-I120 HydrophobicContact CD1-CG1 4.19Å; L116-I120 HydrophobicContact CD2-CD1 4.48Å; L116-I120 HydrophobicContact CG-CD1 3.73Å; L116-I120 HydrophobicContact CG-CG1 4.48Å; L116-I120 WeakPolarHBondContact O-CB 3.44Å; L116-I120 WeakPolarHBondContact O-CD1 3.38Å; L116-I120 WeakPolarHBondContact O-CG1 3.3Å; L116-I120 PolarHBondContact O-N 2.87Å; L116-L172 HydrophobicContact CD1-CD2 4.5Å; L116-L172 HydrophobicContact CD2-CD2 4.49Å; L116-L203 HydrophobicContact CD2-CB 3.8Å; L116-L203 HydrophobicContact CD2-CD1 3.86Å; L116-L203 HydrophobicContact CD2-CG 4.49Å; L116-S204 WeakPolarHBondContact CD2-O 3.37Å; L116-F207 HydrophobicContact CD1-CB 4.36Å; L116-F207 HydrophobicContact CD1-CD1 3.65Å; L116-F207 HydrophobicContact CD1-CE1 4.36Å; L116-F207 HydrophobicContact CD1-CG 4.28Å |
| 117 | L | 95.3 | Very high | 92.1 | Very high | 33 Ų | 33 | 56.5 Ų | 56.5 | 17% | 0.173 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -67.4 | -36.2 | -178.5 | -68.4 | 177 | 0 | 0 | 0 | 112.1 | V88 A92 I112 E114 I120 G121 | V88-L117 HydrophobicContact CG1-CB 3.77Å; V88-L117 HydrophobicContact CG1-CD2 4.3Å; V88-L117 HydrophobicContact CG1-CG 4.42Å; A92-L117 HydrophobicContact CB-CD1 3.71Å; A92-L117 HydrophobicContact CB-CD2 4.11Å; I112-L117 HydrophobicContact CG2-CD1 4.1Å; I112-L117 HydrophobicContact CG2-CD2 4.24Å; I112-L117 HydrophobicContact CG2-CG 3.93Å; E114-L117 PolarHBondContact O-N 3.33Å; L117-I120 HydrophobicContact CD2-CD1 4.45Å; L117-G121 PolarHBondContact O-N 3.5Å |
| 118 | E | 94.5 | Very high | 92.9 | Very high | 109 Ų | 109 | 56.4 Ų | 56.4 | 51% | 0.509 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -61.5 | -52.4 | 174.3 | -176 | -175.9 | 173 | 0 | 0 | 111.3 | L116 I120 G121 Q122 | L116-E118 VanDerWaalsContact C-N 3.33Å; L116-E118 PolarHBondContact O-N 3.35Å; E118-I120 VanDerWaalsContact C-N 3.33Å; E118-I120 PolarHBondContact O-N 3.34Å; E118-G121 PolarHBondContact O-N 3.01Å; E118-G121 VanDerWaalsContact O-N 3.09Å; E118-Q122 PolarHBondContact O-N 3.31Å |
| 119 | H | 96.2 | Very high | 93.5 | Very high | 80 Ų | 80 | 56.4 Ų | 56.4 | 37% | 0.37 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -64.5 | -37.5 | 178.9 | -61.6 | 164.4 | 0 | 0 | 0 | 112.3 | K115 L116 G121 Q122 E123 F207 | K115-H119 VanDerWaalsContact O-CG 3.24Å; K115-H119 PolarHBondContact O-N 2.77Å; K115-H119 VanDerWaalsContact O-N 3.09Å; K115-H119 PolarHBondContact O-ND1 2.77Å; L116-H119 PolarHBondContact O-N 2.97Å; H119-G121 VanDerWaalsContact C-N 3.29Å; H119-G121 PolarHBondContact O-N 2.89Å; H119-Q122 PolarHBondContact O-N 2.93Å; H119-E123 WeakPolarHBondContact O-CB 3.36Å; H119-E123 PolarHBondContact O-N 3.44Å; H119-F207 HydrophobicContact CB-CE1 3.77Å; H119-F207 HydrophobicContact CB-CZ 4.1Å |
| 120 | I | 97 | Very high | 93.9 | Very high | 1 Ų | 1 | 54.8 Ų | 54.8 | 1% | 0.005 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -57.8 | -47 | 172.3 | -73.2 | 163.6 | 0 | 0 | 0 | 109.7 | I91 L116 L117 E118 Q122 E123 L124 L170 L172 F207 | I91-I120 HydrophobicContact CD1-CG2 4.26Å; L116-I120 HydrophobicContact CD1-CD1 3.84Å; L116-I120 HydrophobicContact CD1-CG1 4.19Å; L116-I120 HydrophobicContact CD2-CD1 4.48Å; L116-I120 HydrophobicContact CG-CD1 3.73Å; L116-I120 HydrophobicContact CG-CG1 4.48Å; L116-I120 WeakPolarHBondContact O-CB 3.44Å; L116-I120 WeakPolarHBondContact O-CD1 3.38Å; L116-I120 WeakPolarHBondContact O-CG1 3.3Å; L116-I120 PolarHBondContact O-N 2.87Å; L117-I120 HydrophobicContact CD2-CD1 4.45Å; E118-I120 VanDerWaalsContact C-N 3.33Å; E118-I120 PolarHBondContact O-N 3.34Å; I120-Q122 PolarHBondContact O-N 3.25Å; I120-E123 PolarHBondContact O-N 3.44Å; I120-L124 HydrophobicContact CG2-CD1 3.84Å; I120-L124 HydrophobicContact CG2-CG 4.18Å; I120-L124 VanDerWaalsContact O-CG 3.23Å; I120-L124 WeakPolarHBondContact O-CG 3.16Å; I120-L124 PolarHBondContact O-N 3.45Å; I120-L170 HydrophobicContact CD1-CD1 4.42Å; I120-L170 HydrophobicContact CD1-CD2 4.31Å; I120-L170 HydrophobicContact CG1-CD1 4.14Å; I120-L170 HydrophobicContact CG2-CD1 4.36Å; I120-L170 HydrophobicContact CG2-CD2 3.71Å; I120-L172 HydrophobicContact CD1-CD2 3.65Å; I120-F207 HydrophobicContact CG1-CD1 4.13Å; I120-F207 HydrophobicContact CG1-CD2 3.95Å; I120-F207 HydrophobicContact CG1-CE1 4.12Å; I120-F207 HydrophobicContact CG1-CE2 3.92Å; I120-F207 HydrophobicContact CG1-CG 4.05Å; I120-F207 HydrophobicContact CG1-CZ 4.02Å |
| 121 | G | 95.9 | Very high | 94.1 | Very high | 3 Ų | 3 | 55 Ų | 55 | 3% | 0.031 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58.3 | -49.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | L84 L117 E118 H119 E123 L124 I125 | L84-G121 WeakPolarHBondContact CD1-O 3.39Å; L117-G121 PolarHBondContact O-N 3.5Å; E118-G121 PolarHBondContact O-N 3.01Å; E118-G121 VanDerWaalsContact O-N 3.09Å; H119-G121 VanDerWaalsContact C-N 3.29Å; H119-G121 PolarHBondContact O-N 2.89Å; G121-E123 VanDerWaalsContact C-N 3.33Å; G121-E123 PolarHBondContact O-N 3.31Å; G121-L124 PolarHBondContact O-N 3.22Å; G121-I125 PolarHBondContact O-N 2.91Å; G121-I125 VanDerWaalsContact O-N 3.12Å |
| 122 | Q | 95.4 | Very high | 94.1 | Very high | 110 Ų | 110 | 55.2 Ų | 55.2 | 51% | 0.514 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -57.1 | -45.9 | 177.9 | -70.8 | 169.7 | -13.5 | 0 | 0 | 112 | E118 H119 I120 I125 H126 | E118-Q122 PolarHBondContact O-N 3.31Å; H119-Q122 PolarHBondContact O-N 2.93Å; I120-Q122 PolarHBondContact O-N 3.25Å; Q122-I125 PolarHBondContact O-N 3.23Å; Q122-H126 WeakPolarHBondContact O-CB 3.46Å; Q122-H126 PolarHBondContact O-N 3.46Å |
| 123 | E | 96.5 | Very high | 94.1 | Very high | 25 Ų | 25 | 57.1 Ų | 57.1 | 12% | 0.117 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -64.8 | -41.2 | 179.5 | -171.3 | 60.4 | -150.1 | 0 | 0 | 112.3 | H119 I120 G121 I125 H126 L127 F207 V209 C225 | H119-E123 WeakPolarHBondContact O-CB 3.36Å; H119-E123 PolarHBondContact O-N 3.44Å; I120-E123 PolarHBondContact O-N 3.44Å; G121-E123 VanDerWaalsContact C-N 3.33Å; G121-E123 PolarHBondContact O-N 3.31Å; E123-I125 PolarHBondContact O-N 3.31Å; E123-H126 PolarHBondContact O-N 2.95Å; E123-L127 HydrophobicContact CG-CD1 4.09Å; E123-L127 WeakPolarHBondContact O-CB 3.28Å; E123-L127 WeakPolarHBondContact O-CG 3.34Å; E123-L127 PolarHBondContact O-N 3.37Å; E123-F207 HydrophobicContact CB-CE2 3.89Å; E123-F207 HydrophobicContact CB-CZ 4Å; E123-F207 HydrophobicContact CG-CE2 3.99Å; E123-F207 HydrophobicContact CG-CZ 4.41Å; E123-V209 HydrophobicContact CB-CG2 4.47Å; E123-V209 HydrophobicContact CG-CB 4.11Å; E123-V209 HydrophobicContact CG-CG2 3.74Å; E123-C225 PolarHBondContact OE1-SG 2.94Å; E123-C225 PolarHBondContact OE2-SG 3.09Å |
| 124 | L | 96.7 | Very high | 94.2 | Very high | 0 Ų | 0 | 56.6 Ų | 56.6 | 0% | 0 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 178 | -69.3 | 176.7 | 0 | 0 | 0 | 111.8 | V87 I91 I120 G121 A128 L135 I140 L168 V209 | V87-L124 HydrophobicContact CG1-CD1 4.09Å; I91-L124 HydrophobicContact CD1-CD1 3.96Å; I120-L124 HydrophobicContact CG2-CD1 3.84Å; I120-L124 HydrophobicContact CG2-CG 4.18Å; I120-L124 VanDerWaalsContact O-CG 3.23Å; I120-L124 WeakPolarHBondContact O-CG 3.16Å; I120-L124 PolarHBondContact O-N 3.45Å; G121-L124 PolarHBondContact O-N 3.22Å; L124-A128 WeakPolarHBondContact O-CB 3.38Å; L124-A128 PolarHBondContact O-N 2.95Å; L124-A128 VanDerWaalsContact O-N 3.16Å; L124-L135 HydrophobicContact CB-CD1 4.07Å; L124-I140 HydrophobicContact CD1-CD1 4.18Å; L124-L168 HydrophobicContact CB-CD1 4.49Å; L124-L168 HydrophobicContact CD2-CB 4.21Å; L124-L168 HydrophobicContact CD2-CD1 3.59Å; L124-V209 HydrophobicContact CD2-CG1 4.2Å |
| 125 | I | 95.4 | Very high | 94.7 | Very high | 27 Ų | 27 | 48.2 Ų | 48.2 | 14% | 0.138 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -64.4 | -48.7 | 174.4 | -69 | -59.1 | 0 | 0 | 0 | 110.7 | E80 L84 G121 Q122 E123 L127 A128 A129 L135 | E80-I125 HydrophobicContact CG-CD1 3.59Å; L84-I125 HydrophobicContact CB-CD1 4.26Å; L84-I125 HydrophobicContact CB-CG1 4.47Å; L84-I125 HydrophobicContact CD1-CD1 4.1Å; L84-I125 HydrophobicContact CD1-CG1 3.77Å; L84-I125 HydrophobicContact CD2-CD1 4.41Å; L84-I125 HydrophobicContact CD2-CG1 3.75Å; L84-I125 HydrophobicContact CG-CD1 4.49Å; L84-I125 HydrophobicContact CG-CG1 4.19Å; G121-I125 PolarHBondContact O-N 2.91Å; G121-I125 VanDerWaalsContact O-N 3.12Å; Q122-I125 PolarHBondContact O-N 3.23Å; E123-I125 PolarHBondContact O-N 3.31Å; I125-L127 VanDerWaalsContact C-N 3.33Å; I125-L127 PolarHBondContact O-N 3.48Å; I125-A128 PolarHBondContact O-N 3.42Å; I125-A128 VanDerWaalsContact O-N 3.11Å; I125-A129 PolarHBondContact O-N 3.45Å; I125-L135 HydrophobicContact CD1-CB 4.12Å; I125-L135 HydrophobicContact CD1-CD2 3.79Å |
| 126 | H | 94.9 | Very high | 94.8 | Very high | 116 Ų | 116 | 45.8 Ų | 45.8 | 54% | 0.537 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -54.7 | -49.8 | -178.5 | -176.4 | 67.5 | 0 | 0 | 0 | 111.9 | Q122 E123 A128 A129 | Q122-H126 WeakPolarHBondContact O-CB 3.46Å; Q122-H126 PolarHBondContact O-N 3.46Å; E123-H126 PolarHBondContact O-N 2.95Å; H126-A128 VanDerWaalsContact C-N 3.31Å; H126-A128 PolarHBondContact O-N 3.15Å; H126-A129 PolarHBondContact O-N 3.06Å |
| 127 | L | 95.2 | Very high | 94.9 | Very high | 6 Ų | 6 | 45.9 Ų | 45.9 | 3% | 0.031 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.5 | -33 | 179.6 | -71.9 | 174.2 | 0 | 0 | 0 | 113.2 | E123 I125 S130 L168 V209 K211 E223 | E123-L127 HydrophobicContact CG-CD1 4.09Å; E123-L127 WeakPolarHBondContact O-CB 3.28Å; E123-L127 WeakPolarHBondContact O-CG 3.34Å; E123-L127 PolarHBondContact O-N 3.37Å; I125-L127 VanDerWaalsContact C-N 3.33Å; I125-L127 PolarHBondContact O-N 3.48Å; L127-S130 PolarHBondContact O-OG 3.49Å; L127-L168 HydrophobicContact CB-CD2 3.93Å; L127-L168 HydrophobicContact CD1-CD2 4.08Å; L127-V209 HydrophobicContact CD1-CB 3.56Å; L127-V209 HydrophobicContact CD1-CG1 3.37Å; L127-K211 HydrophobicContact CB-CD 4.46Å; L127-K211 WeakPolarHBondContact O-CD 3.49Å; L127-K211 PolarHBondContact O-NZ 3.33Å; L127-E223 HydrophobicContact CD2-CB 4.42Å; L127-E223 WeakPolarHBondContact CD2-OE2 3.44Å |
| 128 | A | 95.1 | Very high | 95 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -81.3 | -22.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | L124 I125 H126 S130 E131 L135 F166 | L124-A128 WeakPolarHBondContact O-CB 3.38Å; L124-A128 PolarHBondContact O-N 2.95Å; L124-A128 VanDerWaalsContact O-N 3.16Å; I125-A128 PolarHBondContact O-N 3.42Å; I125-A128 VanDerWaalsContact O-N 3.11Å; H126-A128 VanDerWaalsContact C-N 3.31Å; H126-A128 PolarHBondContact O-N 3.15Å; A128-S130 PolarHBondContact O-N 3.49Å; A128-E131 WeakPolarHBondContact O-CB 3.46Å; A128-E131 PolarHBondContact O-N 3.22Å; A128-L135 HydrophobicContact CB-CB 4.17Å; A128-L135 HydrophobicContact CB-CD1 4.34Å; A128-F166 HydrophobicContact CB-CE2 4.16Å; A128-F166 HydrophobicContact CB-CZ 3.8Å |
| 129 | A | 93.1 | Very high | 95.1 | Very high | 77 Ų | 77 | 40.1 Ų | 40.1 | 64% | 0.636 | 23% | 0.227 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -58.7 | -24 | -177 | 0 | 0 | 0 | 0 | 0 | 114.1 | I125 H126 | I125-A129 PolarHBondContact O-N 3.45Å; H126-A129 PolarHBondContact O-N 3.06Å |
| 130 | S | 91.9 | Very high | 95.2 | Very high | 87 Ų | 87 | 36.4 Ų | 36.4 | 61% | 0.608 | 21% | 0.21 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -91.9 | 1.1 | 177 | 50.7 | 0 | 0 | 0 | 0 | 114.2 | L127 A128 K211 | L127-S130 PolarHBondContact O-OG 3.49Å; A128-S130 PolarHBondContact O-N 3.49Å; S130-K211 PolarHBondContact OG-NZ 3.26Å |
| 131 | E | 94.3 | Very high | 95.2 | Very high | 25 Ų | 25 | 37.8 Ų | 37.8 | 12% | 0.117 | 22% | 0.217 | C | C | . | . | S | Bend | trans | -108.3 | 150.7 | -175.3 | -60.6 | -62.2 | 148.9 | 0 | 0 | 111.8 | A128 C133 G134 F166 K211 | A128-E131 WeakPolarHBondContact O-CB 3.46Å; A128-E131 PolarHBondContact O-N 3.22Å; E131-C133 PolarHBondContact O-N 3.12Å; E131-G134 PolarHBondContact O-N 3.09Å; E131-G134 VanDerWaalsContact O-N 3.12Å; E131-F166 HydrophobicContact CB-CD1 3.58Å; E131-F166 HydrophobicContact CB-CE1 3.37Å; E131-F166 HydrophobicContact CB-CE2 4.4Å; E131-F166 HydrophobicContact CB-CG 4.21Å; E131-F166 HydrophobicContact CB-CZ 3.81Å; E131-F166 HydrophobicContact CG-CB 4.47Å; E131-F166 HydrophobicContact CG-CD1 3.72Å; E131-F166 HydrophobicContact CG-CD2 3.97Å; E131-F166 HydrophobicContact CG-CE1 3.82Å; E131-F166 HydrophobicContact CG-CE2 4.03Å; E131-F166 HydrophobicContact CG-CG 3.8Å; E131-F166 HydrophobicContact CG-CZ 3.96Å; E131-K211 HydrophobicContact CG-CD 3.99Å; E131-K211 WeakPolarHBondContact OE1-CE 3.48Å; E131-K211 IonicContact OE1-NZ 2.87Å; E131-K211 PolarHBondContact OE1-NZ 3.16Å |
| 132 | P | 91.5 | Very high | 95.1 | Very high | 78 Ų | 78 | 38 Ų | 38 | 51% | 0.506 | 22% | 0.218 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -60.9 | 136.6 | 175.1 | 26.5 | -34.4 | 0 | 0 | 0 | 110.7 | G134 | P132-G134 PolarHBondContact O-N 3.41Š|
| 133 | C | 92.1 | Very high | 95 | Very high | 82 Ų | 82 | 33.2 Ų | 33.2 | 55% | 0.554 | 20% | 0.196 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 64.4 | 12.6 | -176.3 | -52.9 | 0 | 0 | 0 | 0 | 114.8 | E131 R136 L162 | E131-C133 PolarHBondContact O-N 3.12Å; C133-R136 WeakPolarHBondContact O-CB 3.36Å; C133-R136 PolarHBondContact O-N 3.33Å; C133-L162 HydrophobicContact CB-CD1 3.95Å |
| 134 | G | 94.1 | Very high | 94.8 | Very high | 12 Ų | 12 | 32 Ų | 32 | 12% | 0.124 | 19% | 0.191 | C | C | . | . | G | 310 helix | trans | 55.1 | -143.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | E131 P132 R136 G137 F166 | E131-G134 PolarHBondContact O-N 3.09Å; E131-G134 VanDerWaalsContact O-N 3.12Å; P132-G134 PolarHBondContact O-N 3.41Å; G134-R136 PolarHBondContact O-N 3.29Å; G134-R136 VanDerWaalsContact O-N 3.13Å; G134-G137 PolarHBondContact O-N 3.44Å; G134-G137 VanDerWaalsContact O-N 3.1Å; G134-F166 WeakPolarHBondContact O-CE1 3.49Å; G134-F166 WeakPolarHBondContact O-CZ 3.02Å |
| 135 | L | 95.8 | Very high | 94.5 | Very high | 3 Ų | 3 | 34.8 Ų | 34.8 | 2% | 0.016 | 20% | 0.204 | C | C | . | . | G | 310 helix | trans | -59.3 | -28.4 | -178.1 | -173.5 | 61.3 | 0 | 0 | 0 | 113 | I83 L84 V87 L124 I125 A128 G137 A138 V158 L168 | I83-L135 HydrophobicContact CG2-CD2 4.27Å; L84-L135 HydrophobicContact CB-CD2 4.45Å; L84-L135 HydrophobicContact CD1-CD2 4.02Å; V87-L135 HydrophobicContact CG2-CD2 4.36Å; L124-L135 HydrophobicContact CB-CD1 4.07Å; I125-L135 HydrophobicContact CD1-CB 4.12Å; I125-L135 HydrophobicContact CD1-CD2 3.79Å; A128-L135 HydrophobicContact CB-CB 4.17Å; A128-L135 HydrophobicContact CB-CD1 4.34Å; L135-G137 PolarHBondContact O-N 2.9Å; L135-A138 HydrophobicContact CD1-CB 4.32Å; L135-A138 WeakPolarHBondContact O-CB 3.48Å; L135-A138 PolarHBondContact O-N 3.46Å; L135-V158 HydrophobicContact CD1-CG2 4.46Å; L135-V158 HydrophobicContact CG-CG1 4.25Å; L135-V158 HydrophobicContact CG-CG2 4.42Å; L135-V158 WeakPolarHBondContact O-CB 3.41Å; L135-V158 WeakPolarHBondContact O-CG1 3.37Å; L135-V158 WeakPolarHBondContact O-CG2 3.09Å; L135-L168 HydrophobicContact CD1-CD1 4.37Å |
| 136 | R | 95.6 | Very high | 93.7 | Very high | 87 Ų | 87 | 36.7 Ų | 36.7 | 33% | 0.328 | 21% | 0.212 | S | C | . | . | G | 310 helix | trans | -62.2 | -29.5 | 178.7 | -64.2 | 173.4 | 60.7 | -153.9 | -2.7 | 113.2 | I83 C133 G134 A138 D159 L162 | I83-R136 HydrophobicContact CD1-CG 3.5Å; I83-R136 HydrophobicContact CG2-CG 4.49Å; C133-R136 WeakPolarHBondContact O-CB 3.36Å; C133-R136 PolarHBondContact O-N 3.33Å; G134-R136 PolarHBondContact O-N 3.29Å; G134-R136 VanDerWaalsContact O-N 3.13Å; R136-A138 PolarHBondContact O-N 3.2Å; R136-D159 HydrophobicContact CB-CB 3.96Å; R136-D159 HydrophobicContact CG-CB 4.47Å; R136-D159 IonicContact CZ-OD2 3.12Å; R136-D159 IonicContact NE-OD2 2.75Å; R136-D159 PolarHBondContact NE-OD2 3.43Å; R136-D159 IonicContact NH2-OD2 2.66Å; R136-D159 PolarHBondContact NH2-OD2 3.4Å; R136-D159 WeakPolarHBondContact O-CB 3.38Å; R136-L162 HydrophobicContact CB-CD1 3.74Å |
| 137 | G | 95.9 | Very high | 92.9 | Very high | 2 Ų | 2 | 34.5 Ų | 34.5 | 2% | 0.021 | 22% | 0.221 | C | C | . | . | G | 310 helix | trans | -77.7 | -0.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | G134 L135 P164 T165 F166 | G134-G137 PolarHBondContact O-N 3.44Å; G134-G137 VanDerWaalsContact O-N 3.1Å; L135-G137 PolarHBondContact O-N 2.9Å; G137-P164 CarbonylContact O-C 3.55Å; G137-P164 VanDerWaalsContact O-CA 3.23Å; G137-P164 WeakPolarHBondContact O-CA 3.32Å; G137-T165 PolarHBondContact O-N 3.16Å; G137-F166 VanDerWaalsContact C-CE1 3.46Å |
| 138 | A | 97.2 | Very high | 91.8 | Very high | 0 Ų | 0 | 39.7 Ų | 39.7 | 0% | 0 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 141.9 | -172 | 0 | 0 | 0 | 0 | 0 | 113.6 | L135 R136 I140 V158 F166 L168 | L135-A138 HydrophobicContact CD1-CB 4.32Å; L135-A138 WeakPolarHBondContact O-CB 3.48Å; L135-A138 PolarHBondContact O-N 3.46Å; R136-A138 PolarHBondContact O-N 3.2Å; A138-I140 HydrophobicContact CB-CG1 4.4Å; A138-V158 HydrophobicContact CB-CG2 3.99Å; A138-V158 PolarHBondContact O-N 3.48Å; A138-V158 VanDerWaalsContact O-N 3.15Å; A138-F166 HydrophobicContact CB-CD2 4.36Å; A138-F166 HydrophobicContact CB-CE1 4.18Å; A138-F166 HydrophobicContact CB-CE2 3.65Å; A138-F166 HydrophobicContact CB-CZ 3.53Å; A138-L168 HydrophobicContact CB-CD1 4.22Å; A138-L168 HydrophobicContact CB-CG 4.47Å |
| 139 | L | 97.6 | Very high | 91.1 | Very high | 21 Ų | 21 | 42 Ų | 42 | 11% | 0.11 | 28% | 0.284 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.5 | 114.3 | 157.4 | -174.7 | 64.4 | 0 | 0 | 0 | 108.5 | Q155 L156 S157 P164 F166 Q167 L168 | L139-Q155 HydrophobicContact CD1-CG 3.49Å; L139-Q155 VanDerWaalsContact CD1-CG 3.49Å; L139-Q155 HydrophobicContact CD2-CG 4.28Å; L139-Q155 HydrophobicContact CG-CG 3.76Å; L139-L156 CarbonylContact C-O 3.37Å; L139-S157 WeakPolarHBondContact CD1-OG 3.23Å; L139-P164 HydrophobicContact CB-CB 3.75Å; L139-P164 HydrophobicContact CB-CG 4.19Å; L139-P164 HydrophobicContact CD1-CG 4.42Å; L139-F166 PolarHBondContact N-O 3.34Å; L139-Q167 HydrophobicContact CB-CB 4.49Å; L139-Q167 CarbonylContact O-C 3.53Å; L139-Q167 WeakPolarHBondContact O-CA 3.4Å; L139-Q167 WeakPolarHBondContact O-CG 3.37Å; L139-L168 PolarHBondContact O-N 3.31Å |
| 140 | I | 97.8 | Very high | 90.7 | Very high | 2 Ų | 2 | 42.2 Ų | 42.2 | 1% | 0.01 | 28% | 0.279 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.2 | 118.7 | -179.2 | -59.2 | 174 | 0 | 0 | 0 | 108.9 | V87 L124 A138 Q155 L156 V158 L168 | V87-I140 HydrophobicContact CG1-CD1 3.47Å; V87-I140 VanDerWaalsContact CG1-CD1 3.47Å; L124-I140 HydrophobicContact CD1-CD1 4.18Å; A138-I140 HydrophobicContact CB-CG1 4.4Å; I140-Q155 CarbonylContact O-C 3.58Å; I140-Q155 WeakPolarHBondContact O-CA 3.18Å; I140-L156 HydrophobicContact CB-CB 4.37Å; I140-L156 PolarHBondContact N-O 2.81Å; I140-L156 PolarHBondContact O-N 2.86Å; I140-V158 HydrophobicContact CD1-CG2 3.65Å; I140-V158 HydrophobicContact CG1-CG2 4.04Å; I140-L168 CarbonylContact C-O 3.5Å; I140-L168 VanDerWaalsContact CA-O 3.3Å; I140-L168 WeakPolarHBondContact CA-O 3.39Å; I140-L168 HydrophobicContact CG1-CB 4.45Å |
| 141 | D | 96.3 | Very high | 90.5 | Very high | 30 Ų | 30 | 42 Ų | 42 | 16% | 0.16 | 27% | 0.269 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 121.6 | 169.1 | -173.6 | 26.5 | 0 | 0 | 0 | 109.1 | L168 T169 L170 | D141-L168 PolarHBondContact N-O 2.93Å; D141-T169 HydrophobicContact CB-CG2 4.26Å; D141-T169 CarbonylContact O-C 3.6Å; D141-T169 WeakPolarHBondContact O-CA 3.45Å; D141-L170 PolarHBondContact O-N 2.96Å |
| 142 | L | 95.7 | Very high | 90.3 | Very high | 8 Ų | 8 | 43.9 Ų | 43.9 | 4% | 0.042 | 28% | 0.284 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.9 | 119.5 | -175.1 | 178.9 | 64.8 | 0 | 0 | 0 | 109.7 | I91 L95 I153 G154 L170 L172 | I91-L142 HydrophobicContact CG2-CD1 4.23Å; I91-L142 HydrophobicContact CG2-CD2 4.32Å; L95-L142 HydrophobicContact CD2-CD2 4.13Å; L95-L142 HydrophobicContact CG-CD2 4.18Å; L142-I153 HydrophobicContact CB-CB 4.33Å; L142-I153 HydrophobicContact CD2-CB 3.98Å; L142-I153 HydrophobicContact CD2-CG2 3.84Å; L142-I153 HydrophobicContact CG-CB 3.91Å; L142-I153 HydrophobicContact CG-CG1 4.22Å; L142-I153 HydrophobicContact CG-CG2 4.35Å; L142-I153 WeakPolarHBondContact O-CA 3.4Å; L142-I153 WeakPolarHBondContact O-CB 3.19Å; L142-I153 PolarHBondContact O-N 2.94Å; L142-G154 WeakPolarHBondContact CB-O 3.23Å; L142-G154 PolarHBondContact N-O 3.27Å; L142-G154 PolarHBondContact O-N 3.33Å; L142-L170 HydrophobicContact CD1-CB 4.37Å; L142-L170 HydrophobicContact CD1-CD2 3.73Å; L142-L170 HydrophobicContact CD1-CG 3.94Å; L142-L172 HydrophobicContact CD1-CD1 3.79Å; L142-L172 HydrophobicContact CD1-CG 4.28Å |
| 143 | C | 93.3 | Very high | 90.3 | Very high | 9 Ų | 9 | 40.7 Ų | 40.7 | 6% | 0.061 | 26% | 0.263 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.2 | 152.3 | -176.8 | -67 | 0 | 0 | 0 | 0 | 111.7 | C150 E151 L170 V171 L172 | C143-C150 VanDerWaalsContact CB-SG 3.52Å; C143-E151 CarbonylContact C-O 3.53Å; C143-E151 VanDerWaalsContact CA-O 3.28Å; C143-E151 WeakPolarHBondContact CA-O 3.31Å; C143-L170 PolarHBondContact N-O 3.47Å; C143-V171 HydrophobicContact CB-CG2 4.46Å; C143-L172 PolarHBondContact O-N 3.4Å |
| 144 | V | 92.1 | Very high | 90.1 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 25% | 0.246 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 122.1 | 173 | 179.9 | 0 | 0 | 0 | 0 | 110.3 | L95 L105 Q146 E151 I153 L172 L174 | L95-V144 HydrophobicContact CD2-CG2 4.18Å; L105-V144 HydrophobicContact CD2-CB 3.8Å; L105-V144 HydrophobicContact CD2-CG1 3.66Å; L105-V144 HydrophobicContact CD2-CG2 3.96Å; V144-Q146 HydrophobicContact CG1-CG 4.36Å; V144-E151 PolarHBondContact N-O 2.85Å; V144-E151 PolarHBondContact O-N 2.76Å; V144-I153 HydrophobicContact CB-CD1 4.25Å; V144-I153 HydrophobicContact CB-CG1 4.44Å; V144-I153 HydrophobicContact CG2-CD1 3.8Å; V144-I153 HydrophobicContact CG2-CG1 3.68Å; V144-L172 CarbonylContact C-O 3.56Å; V144-L172 WeakPolarHBondContact CA-O 3.16Å; V144-L172 HydrophobicContact CG2-CB 4.21Å; V144-L174 HydrophobicContact CG1-CD2 4.02Å; V144-L174 HydrophobicContact CG1-CG 4.08Å |
| 145 | E | 89.4 | Confident | 90.1 | Very high | 59 Ų | 59 | 40.4 Ų | 40.4 | 28% | 0.276 | 26% | 0.255 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 123.6 | 176 | -170.7 | 172.8 | -159.7 | 0 | 0 | 110.5 | A149 V171 L172 R173 | E145-A149 WeakPolarHBondContact CA-O 3.3Å; E145-V171 HydrophobicContact CB-CG1 4.12Å; E145-L172 PolarHBondContact N-O 2.92Å; E145-R173 HydrophobicContact CB-CG 4.17Å; E145-R173 WeakPolarHBondContact OE2-CG 3.46Å; E145-R173 IonicContact OE2-CZ 3.73Å; E145-R173 IonicContact OE2-NE 2.85Å; E145-R173 PolarHBondContact OE2-NE 3.33Å; E145-R173 IonicContact OE2-NH2 3.71Å |
| 146 | Q | 79.9 | Confident | 89.9 | Confident | 67 Ų | 67 | 41.7 Ų | 41.7 | 31% | 0.313 | 26% | 0.262 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127 | 89.7 | 177.5 | -62.2 | -171.6 | 54.7 | 0 | 0 | 109.4 | A104 V144 A148 A149 L174 | A104-Q146 PolarHBondContact O-NE2 3.47Å; V144-Q146 HydrophobicContact CG1-CG 4.36Å; Q146-A148 PolarHBondContact O-N 3.41Å; Q146-A149 PolarHBondContact N-O 3.43Å; Q146-A149 PolarHBondContact O-N 3.46Å; Q146-A149 VanDerWaalsContact O-N 3.17Å; Q146-L174 HydrophobicContact CG-CD1 3.72Å; Q146-L174 HydrophobicContact CG-CG 4.3Å |
| 147 | G | 76.4 | Confident | 89.9 | Confident | 70 Ų | 70 | 40 Ų | 40 | 72% | 0.722 | 26% | 0.264 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.9 | -118.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 148 | A | 73.8 | Confident | 89.9 | Confident | 115 Ų | 115 | 41 Ų | 41 | 95% | 0.95 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.5 | -4.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q146 | Q146-A148 PolarHBondContact O-N 3.41Š|
| 149 | A | 80.3 | Confident | 89.7 | Confident | 49 Ų | 49 | 41.8 Ų | 41.8 | 41% | 0.405 | 27% | 0.273 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 146 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111 | E145 Q146 | E145-A149 WeakPolarHBondContact CA-O 3.3Å; Q146-A149 PolarHBondContact N-O 3.43Å; Q146-A149 PolarHBondContact O-N 3.46Å; Q146-A149 VanDerWaalsContact O-N 3.17Å |
| 150 | C | 84.8 | Confident | 89.3 | Confident | 80 Ų | 80 | 44.8 Ų | 44.8 | 54% | 0.541 | 30% | 0.295 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.8 | 112.7 | 172.4 | -170.5 | 0 | 0 | 0 | 0 | 107.8 | C143 | C143-C150 VanDerWaalsContact CB-SG 3.52Å |
| 151 | E | 87.6 | Confident | 89 | Confident | 83 Ų | 83 | 53.1 Ų | 53.1 | 39% | 0.388 | 33% | 0.327 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.3 | 123.6 | -178.9 | -71.7 | -77.8 | 161.6 | 0 | 0 | 109.6 | A104 C143 V144 | A104-E151 HydrophobicContact CB-CB 4.03Å; C143-E151 CarbonylContact C-O 3.53Å; C143-E151 VanDerWaalsContact CA-O 3.28Å; C143-E151 WeakPolarHBondContact CA-O 3.31Å; V144-E151 PolarHBondContact N-O 2.85Å; V144-E151 PolarHBondContact O-N 2.76Å |
| 152 | S | 89.9 | Confident | 88.8 | Confident | 64 Ų | 64 | 54.2 Ų | 54.2 | 45% | 0.448 | 33% | 0.333 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.3 | 125.9 | 173.8 | -179.8 | 0 | 0 | 0 | 0 | 109.9 | ||
| 153 | I | 90.8 | Very high | 88.8 | Confident | 12 Ų | 12 | 59 Ų | 59 | 6% | 0.062 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.2 | -39.4 | 177.2 | -54.5 | -54.9 | 0 | 0 | 0 | 110.3 | A98 A104 L105 L142 V144 | A98-I153 HydrophobicContact CB-CD1 4.12Å; A98-I153 HydrophobicContact CB-CG2 3.69Å; A104-I153 HydrophobicContact CB-CD1 3.56Å; L105-I153 HydrophobicContact CD2-CD1 4.19Å; L105-I153 HydrophobicContact CG-CD1 4.18Å; L142-I153 HydrophobicContact CB-CB 4.33Å; L142-I153 HydrophobicContact CD2-CB 3.98Å; L142-I153 HydrophobicContact CD2-CG2 3.84Å; L142-I153 HydrophobicContact CG-CB 3.91Å; L142-I153 HydrophobicContact CG-CG1 4.22Å; L142-I153 HydrophobicContact CG-CG2 4.35Å; L142-I153 WeakPolarHBondContact O-CA 3.4Å; L142-I153 WeakPolarHBondContact O-CB 3.19Å; L142-I153 PolarHBondContact O-N 2.94Å; V144-I153 HydrophobicContact CB-CD1 4.25Å; V144-I153 HydrophobicContact CB-CG1 4.44Å; V144-I153 HydrophobicContact CG2-CD1 3.8Å; V144-I153 HydrophobicContact CG2-CG1 3.68Å |
| 154 | G | 89 | Confident | 89 | Confident | 19 Ų | 19 | 59.6 Ų | 59.6 | 20% | 0.196 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 165.7 | 178.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L142 | L142-G154 WeakPolarHBondContact CB-O 3.23Å; L142-G154 PolarHBondContact N-O 3.27Å; L142-G154 PolarHBondContact O-N 3.33Å |
| 155 | Q | 92.4 | Very high | 89.2 | Confident | 68 Ų | 68 | 62 Ų | 62 | 32% | 0.318 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.1 | 116.9 | -174.5 | 178.7 | 178.6 | 76.5 | 0 | 0 | 111.6 | W27 L139 I140 | W27-Q155 HydrophobicContact CH2-CB 4.46Å; W27-Q155 WeakPolarHBondContact CH2-O 3.49Å; W27-Q155 HydrophobicContact CZ2-CB 4.01Å; W27-Q155 WeakPolarHBondContact CZ2-O 3.38Å; W27-Q155 WeakPolarHBondContact CZ3-O 3.5Å; L139-Q155 HydrophobicContact CD1-CG 3.49Å; L139-Q155 VanDerWaalsContact CD1-CG 3.49Å; L139-Q155 HydrophobicContact CD2-CG 4.28Å; L139-Q155 HydrophobicContact CG-CG 3.76Å; I140-Q155 CarbonylContact O-C 3.58Å; I140-Q155 WeakPolarHBondContact O-CA 3.18Å |
| 156 | L | 92.8 | Very high | 89.5 | Confident | 31 Ų | 31 | 59.1 Ų | 59.1 | 16% | 0.162 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.6 | 122.7 | -177.2 | 172.4 | 64.8 | 0 | 0 | 0 | 110.9 | V87 L90 L139 I140 | V87-L156 HydrophobicContact CG1-CD2 4.26Å; V87-L156 HydrophobicContact CG2-CD2 4.38Å; L90-L156 HydrophobicContact CB-CD2 4.05Å; L90-L156 HydrophobicContact CD1-CD1 3.89Å; L90-L156 HydrophobicContact CD1-CD2 3.85Å; L139-L156 CarbonylContact C-O 3.37Å; I140-L156 HydrophobicContact CB-CB 4.37Å; I140-L156 PolarHBondContact N-O 2.81Å; I140-L156 PolarHBondContact O-N 2.86Å |
| 157 | S | 95.4 | Very high | 90.3 | Very high | 51 Ų | 51 | 57.5 Ų | 57.5 | 36% | 0.357 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.7 | 122.5 | 159.5 | -57.6 | 0 | 0 | 0 | 0 | 108.1 | L139 | L139-S157 WeakPolarHBondContact CD1-OG 3.23Å |
| 158 | V | 94.9 | Very high | 91.3 | Very high | 22 Ų | 22 | 54.2 Ų | 54.2 | 13% | 0.133 | 33% | 0.325 | C | S | . | . | S | Bend | trans | -66.5 | -44 | -172.6 | 173.8 | 0 | 0 | 0 | 0 | 111.7 | I83 V87 L135 A138 I140 | I83-V158 HydrophobicContact CG2-CG1 3.58Å; V87-V158 HydrophobicContact CG2-CB 4.4Å; V87-V158 HydrophobicContact CG2-CG1 3.74Å; V87-V158 HydrophobicContact CG2-CG2 4Å; L135-V158 HydrophobicContact CD1-CG2 4.46Å; L135-V158 HydrophobicContact CG-CG1 4.25Å; L135-V158 HydrophobicContact CG-CG2 4.42Å; L135-V158 WeakPolarHBondContact O-CB 3.41Å; L135-V158 WeakPolarHBondContact O-CG1 3.37Å; L135-V158 WeakPolarHBondContact O-CG2 3.09Å; A138-V158 HydrophobicContact CB-CG2 3.99Å; A138-V158 PolarHBondContact O-N 3.48Å; A138-V158 VanDerWaalsContact O-N 3.15Å; I140-V158 HydrophobicContact CD1-CG2 3.65Å; I140-V158 HydrophobicContact CG1-CG2 4.04Å |
| 159 | D | 92.7 | Very high | 92.5 | Very high | 17 Ų | 17 | 49.9 Ų | 49.9 | 9% | 0.091 | 29% | 0.287 | C | S | . | . | trans | -118.9 | 118.4 | 178.6 | -171.3 | -29 | 0 | 0 | 0 | 110.4 | R136 Y161 L162 | R136-D159 HydrophobicContact CB-CB 3.96Å; R136-D159 HydrophobicContact CG-CB 4.47Å; R136-D159 IonicContact CZ-OD2 3.12Å; R136-D159 IonicContact NE-OD2 2.75Å; R136-D159 PolarHBondContact NE-OD2 3.43Å; R136-D159 IonicContact NH2-OD2 2.66Å; R136-D159 PolarHBondContact NH2-OD2 3.4Å; R136-D159 WeakPolarHBondContact O-CB 3.38Å; D159-Y161 PolarHBondContact O-N 3.42Å; D159-Y161 WeakPolarHBondContact OD1-CA 3.5Å; D159-Y161 WeakPolarHBondContact OD1-CB 3.43Å; D159-Y161 WeakPolarHBondContact OD1-CD2 3.38Å; D159-Y161 PolarHBondContact OD1-N 3.28Å; D159-L162 HydrophobicContact CB-CB 4.2Å; D159-L162 HydrophobicContact CB-CD1 4.16Å; D159-L162 HydrophobicContact CB-CG 4.14Å; D159-L162 PolarHBondContact O-N 2.89Å | ||
| 160 | P | 89.5 | Confident | 93.3 | Very high | 85 Ų | 85 | 47.6 Ų | 47.6 | 55% | 0.552 | 27% | 0.268 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.2 | -14.8 | -179.8 | 29.9 | -35.5 | 0 | 0 | 0 | 113.9 | ||
| 161 | Y | 91.5 | Very high | 93.8 | Very high | 176 Ų | 176 | 44.3 Ų | 44.3 | 69% | 0.69 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -92.9 | -6.5 | 179 | -56.3 | -74.6 | 0 | 0 | 0 | 113 | D159 | D159-Y161 PolarHBondContact O-N 3.42Å; D159-Y161 WeakPolarHBondContact OD1-CA 3.5Å; D159-Y161 WeakPolarHBondContact OD1-CB 3.43Å; D159-Y161 WeakPolarHBondContact OD1-CD2 3.38Å; D159-Y161 PolarHBondContact OD1-N 3.28Å |
| 162 | L | 92.8 | Very high | 94.1 | Very high | 54 Ų | 54 | 40.4 Ų | 40.4 | 28% | 0.283 | 23% | 0.227 | S | C | . | . | S | Bend | trans | -112.5 | 148.4 | 176.9 | -61.1 | -178 | 0 | 0 | 0 | 111.1 | C133 R136 D159 P164 | C133-L162 HydrophobicContact CB-CD1 3.95Å; R136-L162 HydrophobicContact CB-CD1 3.74Å; D159-L162 HydrophobicContact CB-CB 4.2Å; D159-L162 HydrophobicContact CB-CD1 4.16Å; D159-L162 HydrophobicContact CB-CG 4.14Å; D159-L162 PolarHBondContact O-N 2.89Å; L162-P164 WeakPolarHBondContact O-CD 3.32Å |
| 163 | V | 96.4 | Very high | 94.2 | Very high | 107 Ų | 107 | 41.5 Ų | 41.5 | 65% | 0.648 | 22% | 0.221 | S | C | * | . | trans | -83 | 123 | 166.4 | 179.3 | 0 | 0 | 0 | 0 | 107.5 | T165 | V163-T165 PolarHBondContact O-N 3.11Š| ||
| 164 | P | 96.8 | Very high | 94.1 | Very high | 22 Ų | 22 | 42.6 Ų | 42.6 | 14% | 0.143 | 23% | 0.227 | C | C | . | . | trans | -60.1 | 137.7 | 177.9 | -24.2 | 33.8 | 0 | 0 | 0 | 112 | G137 L139 L162 L214 Y215 | G137-P164 CarbonylContact O-C 3.55Å; G137-P164 VanDerWaalsContact O-CA 3.23Å; G137-P164 WeakPolarHBondContact O-CA 3.32Å; L139-P164 HydrophobicContact CB-CB 3.75Å; L139-P164 HydrophobicContact CB-CG 4.19Å; L139-P164 HydrophobicContact CD1-CG 4.42Å; L162-P164 WeakPolarHBondContact O-CD 3.32Å; P164-L214 HydrophobicContact CB-CD1 4.1Å; P164-Y215 WeakPolarHBondContact O-CE2 3.38Å | ||
| 165 | T | 95.9 | Very high | 94 | Very high | 50 Ų | 50 | 46.3 Ų | 46.3 | 31% | 0.307 | 24% | 0.239 | S | C | . | . | trans | -111.6 | -18.5 | -178 | 58.7 | 0 | 0 | 0 | 0 | 113 | G137 V163 L214 | G137-T165 PolarHBondContact O-N 3.16Å; V163-T165 PolarHBondContact O-N 3.11Å; T165-L214 WeakPolarHBondContact O-CB 3.33Å; T165-L214 PolarHBondContact O-N 3.06Å | ||
| 166 | F | 96.6 | Very high | 93 | Very high | 0 Ų | 0 | 48.4 Ų | 48.4 | 0% | 0 | 26% | 0.262 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140 | 159.7 | 173.5 | 67.9 | -77.8 | 0 | 0 | 0 | 110.5 | A128 E131 G134 G137 A138 L139 L168 K211 K212 | A128-F166 HydrophobicContact CB-CE2 4.16Å; A128-F166 HydrophobicContact CB-CZ 3.8Å; E131-F166 HydrophobicContact CB-CD1 3.58Å; E131-F166 HydrophobicContact CB-CE1 3.37Å; E131-F166 HydrophobicContact CB-CE2 4.4Å; E131-F166 HydrophobicContact CB-CG 4.21Å; E131-F166 HydrophobicContact CB-CZ 3.81Å; E131-F166 HydrophobicContact CG-CB 4.47Å; E131-F166 HydrophobicContact CG-CD1 3.72Å; E131-F166 HydrophobicContact CG-CD2 3.97Å; E131-F166 HydrophobicContact CG-CE1 3.82Å; E131-F166 HydrophobicContact CG-CE2 4.03Å; E131-F166 HydrophobicContact CG-CG 3.8Å; E131-F166 HydrophobicContact CG-CZ 3.96Å; G134-F166 WeakPolarHBondContact O-CE1 3.49Å; G134-F166 WeakPolarHBondContact O-CZ 3.02Å; G137-F166 VanDerWaalsContact C-CE1 3.46Å; A138-F166 HydrophobicContact CB-CD2 4.36Å; A138-F166 HydrophobicContact CB-CE1 4.18Å; A138-F166 HydrophobicContact CB-CE2 3.65Å; A138-F166 HydrophobicContact CB-CZ 3.53Å; L139-F166 PolarHBondContact N-O 3.34Å; F166-L168 HydrophobicContact CD2-CD2 4.02Å; F166-L168 HydrophobicContact CD2-CG 4.01Å; F166-L168 HydrophobicContact CE2-CD1 3.91Å; F166-L168 HydrophobicContact CE2-CD2 3.93Å; F166-L168 HydrophobicContact CE2-CG 3.73Å; F166-K211 HydrophobicContact CD2-CD 4.13Å; F166-K211 HydrophobicContact CD2-CG 4.17Å; F166-K212 CarbonylContact C-O 3.52Å; F166-K212 VanDerWaalsContact CA-O 3.28Å; F166-K212 WeakPolarHBondContact CA-O 3.42Å |
| 167 | Q | 96.9 | Very high | 91.4 | Very high | 33 Ų | 33 | 49.7 Ų | 49.7 | 15% | 0.154 | 28% | 0.282 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 137.3 | 177.2 | 176.4 | 177.5 | -28.1 | 0 | 0 | 109.8 | L139 T169 K211 K212 L214 | L139-Q167 HydrophobicContact CB-CB 4.49Å; L139-Q167 CarbonylContact O-C 3.53Å; L139-Q167 WeakPolarHBondContact O-CA 3.4Å; L139-Q167 WeakPolarHBondContact O-CG 3.37Å; Q167-T169 PolarHBondContact NE2-OG1 2.97Å; Q167-K211 CarbonylContact O-C 3.52Å; Q167-K211 WeakPolarHBondContact O-CA 3.28Å; Q167-K212 PolarHBondContact N-O 3.06Å; Q167-K212 PolarHBondContact O-N 2.96Å; Q167-L214 HydrophobicContact CB-CD2 3.94Å; Q167-L214 HydrophobicContact CB-CG 4.41Å |
| 168 | L | 97.5 | Very high | 89.4 | Confident | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.8 | 110.9 | 168.7 | -62.5 | 179 | 0 | 0 | 0 | 108.1 | L124 L127 L135 A138 L139 I140 D141 F166 L170 V209 I210 K211 | L124-L168 HydrophobicContact CB-CD1 4.49Å; L124-L168 HydrophobicContact CD2-CB 4.21Å; L124-L168 HydrophobicContact CD2-CD1 3.59Å; L127-L168 HydrophobicContact CB-CD2 3.93Å; L127-L168 HydrophobicContact CD1-CD2 4.08Å; L135-L168 HydrophobicContact CD1-CD1 4.37Å; A138-L168 HydrophobicContact CB-CD1 4.22Å; A138-L168 HydrophobicContact CB-CG 4.47Å; L139-L168 PolarHBondContact O-N 3.31Å; I140-L168 CarbonylContact C-O 3.5Å; I140-L168 VanDerWaalsContact CA-O 3.3Å; I140-L168 WeakPolarHBondContact CA-O 3.39Å; I140-L168 HydrophobicContact CG1-CB 4.45Å; D141-L168 PolarHBondContact N-O 2.93Å; F166-L168 HydrophobicContact CD2-CD2 4.02Å; F166-L168 HydrophobicContact CD2-CG 4.01Å; F166-L168 HydrophobicContact CE2-CD1 3.91Å; F166-L168 HydrophobicContact CE2-CD2 3.93Å; F166-L168 HydrophobicContact CE2-CG 3.73Å; L168-L170 PolarHBondContact O-N 3.27Å; L168-V209 HydrophobicContact CB-CG1 4Å; L168-V209 HydrophobicContact CD2-CG1 4.2Å; L168-I210 WeakPolarHBondContact CA-O 3.37Å; L168-K211 HydrophobicContact CD2-CB 3.78Å; L168-K211 HydrophobicContact CD2-CD 4.18Å; L168-K211 HydrophobicContact CD2-CG 3.84Å |
| 169 | T | 97.3 | Very high | 87.3 | Confident | 25 Ų | 25 | 55.4 Ų | 55.4 | 15% | 0.153 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93 | 101.7 | 176.7 | -50.1 | 0 | 0 | 0 | 0 | 108.7 | D141 Q167 V171 V209 I210 | D141-T169 HydrophobicContact CB-CG2 4.26Å; D141-T169 CarbonylContact O-C 3.6Å; D141-T169 WeakPolarHBondContact O-CA 3.45Å; Q167-T169 PolarHBondContact NE2-OG1 2.97Å; T169-V171 HydrophobicContact CG2-CG2 4.13Å; T169-V209 WeakPolarHBondContact O-CA 3.44Å; T169-I210 PolarHBondContact N-O 2.89Å; T169-I210 PolarHBondContact O-N 3.11Å |
| 170 | L | 97.6 | Very high | 85.6 | Confident | 0 Ų | 0 | 63.5 Ų | 63.5 | 0% | 0 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.1 | 110.4 | 178.3 | 172.9 | 58.8 | 0 | 0 | 0 | 109.7 | I91 I120 D141 L142 C143 L168 L172 F207 V209 | I91-L170 HydrophobicContact CD1-CD2 4Å; I91-L170 HydrophobicContact CG2-CD2 4.29Å; I120-L170 HydrophobicContact CD1-CD1 4.42Å; I120-L170 HydrophobicContact CD1-CD2 4.31Å; I120-L170 HydrophobicContact CG1-CD1 4.14Å; I120-L170 HydrophobicContact CG2-CD1 4.36Å; I120-L170 HydrophobicContact CG2-CD2 3.71Å; D141-L170 PolarHBondContact O-N 2.96Å; L142-L170 HydrophobicContact CD1-CB 4.37Å; L142-L170 HydrophobicContact CD1-CD2 3.73Å; L142-L170 HydrophobicContact CD1-CG 3.94Å; C143-L170 PolarHBondContact N-O 3.47Å; L168-L170 PolarHBondContact O-N 3.27Å; L170-L172 HydrophobicContact CD1-CD2 3.94Å; L170-L172 HydrophobicContact CG-CD2 4.2Å; L170-L172 HydrophobicContact CG-CG 4.32Å; L170-F207 HydrophobicContact CD1-CB 4.37Å; L170-F207 HydrophobicContact CD1-CD2 3.67Å; L170-F207 HydrophobicContact CD1-CE2 4.42Å; L170-F207 HydrophobicContact CD1-CG 4.36Å; L170-V209 HydrophobicContact CD1-CG2 3.81Å |
| 171 | V | 95.7 | Very high | 84 | Confident | 11 Ų | 11 | 64.7 Ų | 64.7 | 7% | 0.067 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.5 | 109.2 | 179.6 | -172.8 | 0 | 0 | 0 | 0 | 109.5 | C143 E145 T169 F207 R208 I210 | C143-V171 HydrophobicContact CB-CG2 4.46Å; E145-V171 HydrophobicContact CB-CG1 4.12Å; T169-V171 HydrophobicContact CG2-CG2 4.13Å; V171-F207 WeakPolarHBondContact O-CA 3.48Å; V171-R208 HydrophobicContact CB-CB 4.46Å; V171-R208 PolarHBondContact N-O 3.47Å; V171-R208 PolarHBondContact O-N 3.1Å; V171-I210 HydrophobicContact CG2-CD1 3.91Å |
| 172 | L | 94.6 | Very high | 82.2 | Confident | 1 Ų | 1 | 65.2 Ų | 65.2 | 1% | 0.005 | 37% | 0.369 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.7 | 149.3 | 176.4 | -58.8 | 174 | 0 | 0 | 0 | 110.5 | L95 L116 I120 L142 C143 V144 E145 L170 L203 F207 | L95-L172 HydrophobicContact CD1-CD1 3.65Å; L95-L172 HydrophobicContact CD2-CD1 3.59Å; L95-L172 HydrophobicContact CG-CD1 4.2Å; L116-L172 HydrophobicContact CD1-CD2 4.5Å; L116-L172 HydrophobicContact CD2-CD2 4.49Å; I120-L172 HydrophobicContact CD1-CD2 3.65Å; L142-L172 HydrophobicContact CD1-CD1 3.79Å; L142-L172 HydrophobicContact CD1-CG 4.28Å; C143-L172 PolarHBondContact O-N 3.4Å; V144-L172 CarbonylContact C-O 3.56Å; V144-L172 WeakPolarHBondContact CA-O 3.16Å; V144-L172 HydrophobicContact CG2-CB 4.21Å; E145-L172 PolarHBondContact N-O 2.92Å; L170-L172 HydrophobicContact CD1-CD2 3.94Å; L170-L172 HydrophobicContact CG-CD2 4.2Å; L170-L172 HydrophobicContact CG-CG 4.32Å; L172-L203 HydrophobicContact CD1-CD1 4.17Å; L172-F207 HydrophobicContact CD2-CB 3.88Å |
| 173 | R | 91.9 | Very high | 80.5 | Confident | 87 Ų | 87 | 65.5 Ų | 65.5 | 33% | 0.328 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.8 | 143.5 | 178.8 | -70 | 170.6 | 169.4 | 166.8 | -2.9 | 110.5 | E145 L203 S204 R208 | E145-R173 HydrophobicContact CB-CG 4.17Å; E145-R173 WeakPolarHBondContact OE2-CG 3.46Å; E145-R173 IonicContact OE2-CZ 3.73Å; E145-R173 IonicContact OE2-NE 2.85Å; E145-R173 PolarHBondContact OE2-NE 3.33Å; E145-R173 IonicContact OE2-NH2 3.71Å; R173-L203 WeakPolarHBondContact O-CA 3.34Å; R173-S204 WeakPolarHBondContact O-CB 3.34Å; R173-S204 PolarHBondContact O-N 2.89Å; R173-R208 VanDerWaalsContact NH2-CD 3.29Å |
| 174 | L | 89 | Confident | 78.5 | Confident | 36 Ų | 36 | 65.2 Ų | 65.2 | 19% | 0.188 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.1 | 143.9 | 164.6 | -63.8 | -175.5 | 0 | 0 | 0 | 109.9 | V144 Q146 S176 L201 L203 | V144-L174 HydrophobicContact CG1-CD2 4.02Å; V144-L174 HydrophobicContact CG1-CG 4.08Å; Q146-L174 HydrophobicContact CG-CD1 3.72Å; Q146-L174 HydrophobicContact CG-CG 4.3Å; L174-S176 PolarHBondContact O-N 3Å; L174-L201 HydrophobicContact CD1-CD1 3.91Å; L174-L201 HydrophobicContact CD1-CD2 4.26Å; L174-L201 HydrophobicContact CD2-CB 4.26Å; L174-L201 HydrophobicContact CD2-CD1 4.23Å; L174-L203 HydrophobicContact CD2-CD2 3.86Å |
| 175 | E | 86.3 | Confident | 76.5 | Confident | 96 Ų | 96 | 66.5 Ų | 66.5 | 45% | 0.449 | 38% | 0.379 | S | S | . | . | trans | -65.1 | 108.4 | 170 | -173.8 | 170.7 | -111.8 | 0 | 0 | 108.3 | G177 K202 | E175-G177 VanDerWaalsContact C-N 3.3Å; E175-G177 PolarHBondContact O-N 3.45Å; E175-K202 HydrophobicContact CB-CB 4.19Å; E175-K202 HydrophobicContact CB-CG 4.25Å; E175-K202 WeakPolarHBondContact CB-O 3.42Å; E175-K202 PolarHBondContact N-O 3.12Å; E175-K202 IonicContact OE1-NZ 3.85Å; E175-K202 PolarHBondContact OE1-NZ 3.39Å; E175-K202 WeakPolarHBondContact OE2-CD 3.44Å; E175-K202 WeakPolarHBondContact OE2-CE 3.47Å; E175-K202 IonicContact OE2-NZ 2.73Å; E175-K202 PolarHBondContact OE2-NZ 3.4Å | ||
| 176 | S | 70.8 | Confident | 74.7 | Confident | 112 Ų | 112 | 70.8 Ų | 70.8 | 78% | 0.783 | 40% | 0.399 | S | S | * | . | trans | -70.6 | 90.5 | 171.4 | 46.9 | 0 | 0 | 0 | 0 | 108.3 | L174 G178 | L174-S176 PolarHBondContact O-N 3Å; S176-G178 PolarHBondContact O-N 3.43Å | ||
| 177 | G | 60.3 | Low | 72.7 | Confident | 58 Ų | 58 | 79 Ų | 79 | 60% | 0.598 | 44% | 0.435 | S | S | * | . | trans | -53.2 | 125.7 | 172 | 0 | 0 | 0 | 0 | 0 | 109.5 | E175 L179 | E175-G177 VanDerWaalsContact C-N 3.3Å; E175-G177 PolarHBondContact O-N 3.45Å; G177-L179 PolarHBondContact O-N 3.26Å | ||
| 178 | G | 52 | Low | 70.6 | Confident | 79 Ų | 79 | 80.9 Ų | 80.9 | 81% | 0.814 | 45% | 0.453 | S | S | * | . | S | Bend | trans | -65.4 | 28.9 | -169.8 | 0 | 0 | 0 | 0 | 0 | 117 | S176 | S176-G178 PolarHBondContact O-N 3.43Š|
| 179 | L | 52.3 | Low | 68.2 | Low | 115 Ų | 115 | 86.6 Ų | 86.6 | 60% | 0.602 | 49% | 0.492 | S | S | * | . | S | Bend | trans | -104.7 | 101.6 | 172 | -88.7 | 144.9 | 0 | 0 | 0 | 108.9 | G177 | G177-L179 PolarHBondContact O-N 3.26Š|
| 180 | W | 56.8 | Low | 65.7 | Low | 187 Ų | 187 | 94.1 Ų | 94.1 | 71% | 0.708 | 52% | 0.523 | S | S | * | . | trans | -30.3 | 128.5 | 171.8 | -58.5 | 79.2 | 0 | 0 | 0 | 112.7 | K182 I183 | W180-K182 PolarHBondContact O-N 3.1Å; W180-I183 HydrophobicContact CB-CD1 3.86Å; W180-I183 HydrophobicContact CB-CG1 3.97Å; W180-I183 HydrophobicContact CG-CD1 4.12Å; W180-I183 PolarHBondContact O-N 3.13Å | ||
| 181 | P | 56 | Low | 63.3 | Low | 110 Ų | 110 | 96.9 Ų | 96.9 | 71% | 0.714 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -51.5 | -30.2 | 177.7 | -27.1 | 32.5 | 0 | 0 | 0 | 113.5 | I183 | P181-I183 VanDerWaalsContact C-N 3.27Å; P181-I183 PolarHBondContact O-N 3.28Å |
| 182 | K | 53 | Low | 61.2 | Low | 186 Ų | 186 | 103 Ų | 103 | 81% | 0.809 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -65.9 | -23.4 | 179.7 | -65.2 | -175.4 | 177.6 | 179.4 | 0 | 114.1 | W180 | W180-K182 PolarHBondContact O-N 3.1Å |
| 183 | I | 57.2 | Low | 59.2 | Low | 61 Ų | 61 | 107.7 Ų | 107.7 | 31% | 0.313 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -99.7 | -23.8 | -175.2 | -43.6 | 171.3 | 0 | 0 | 0 | 111 | W180 P181 G185 L186 F187 | W180-I183 HydrophobicContact CB-CD1 3.86Å; W180-I183 HydrophobicContact CB-CG1 3.97Å; W180-I183 HydrophobicContact CG-CD1 4.12Å; W180-I183 PolarHBondContact O-N 3.13Å; P181-I183 VanDerWaalsContact C-N 3.27Å; P181-I183 PolarHBondContact O-N 3.28Å; I183-G185 PolarHBondContact O-N 3.09Å; I183-L186 HydrophobicContact CG2-CD1 4.4Å; I183-L186 WeakPolarHBondContact O-CB 3.42Å; I183-L186 PolarHBondContact O-N 2.99Å; I183-F187 HydrophobicContact CG2-CD2 4.15Å; I183-F187 HydrophobicContact CG2-CE2 3.7Å; I183-F187 WeakPolarHBondContact O-CD2 3.37Å |
| 184 | Q | 55 | Low | 57.1 | Low | 101 Ų | 101 | 108.1 Ų | 108.1 | 47% | 0.472 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -59.1 | -30.7 | 172 | -71.3 | -172.6 | -24.2 | 0 | 0 | 112.6 | L186 F187 S188 | Q184-L186 PolarHBondContact O-N 2.66Å; Q184-F187 PolarHBondContact O-N 3.12Å; Q184-S188 WeakPolarHBondContact O-CB 3.42Å; Q184-S188 PolarHBondContact O-N 3.04Å; Q184-S188 VanDerWaalsContact O-N 3.13Å; Q184-S188 PolarHBondContact O-OG 2.91Å |
| 185 | G | 54.7 | Low | 55.4 | Low | 48 Ų | 48 | 111.9 Ų | 111.9 | 50% | 0.495 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -67.6 | -17 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | I183 | I183-G185 PolarHBondContact O-N 3.09Å |
| 186 | L | 58 | Low | 54 | Low | 140 Ų | 140 | 111.4 Ų | 111.4 | 73% | 0.733 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -92.1 | -22.2 | -179.5 | -61 | 177.5 | 0 | 0 | 0 | 113.1 | I183 Q184 | I183-L186 HydrophobicContact CG2-CD1 4.4Å; I183-L186 WeakPolarHBondContact O-CB 3.42Å; I183-L186 PolarHBondContact O-N 2.99Å; Q184-L186 PolarHBondContact O-N 2.66Å |
| 187 | F | 54.5 | Low | 53.4 | Low | 172 Ų | 172 | 112 Ų | 112 | 75% | 0.754 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -106.2 | -9.7 | 178.7 | -63 | -71.6 | 0 | 0 | 0 | 113.7 | I183 Q184 S189 | I183-F187 HydrophobicContact CG2-CD2 4.15Å; I183-F187 HydrophobicContact CG2-CE2 3.7Å; I183-F187 WeakPolarHBondContact O-CD2 3.37Å; Q184-F187 PolarHBondContact O-N 3.12Å; F187-S189 PolarHBondContact O-N 3.27Å; F187-S189 VanDerWaalsContact O-N 3.16Å |
| 188 | S | 51.4 | Low | 53.5 | Low | 74 Ų | 74 | 115.7 Ų | 115.7 | 52% | 0.517 | 66% | 0.663 | S | S | . | * | S | Bend | trans | -80.1 | 94.6 | 172 | -61.4 | 0 | 0 | 0 | 0 | 109.4 | Q184 K190 | Q184-S188 WeakPolarHBondContact O-CB 3.42Å; Q184-S188 PolarHBondContact O-N 3.04Å; Q184-S188 VanDerWaalsContact O-N 3.13Å; Q184-S188 PolarHBondContact O-OG 2.91Å; S188-K190 PolarHBondContact O-N 2.75Å |
| 189 | S | 46.7 | Very low | 54.5 | Low | 119 Ų | 119 | 118.4 Ų | 118.4 | 83% | 0.832 | 66% | 0.655 | S | S | * | * | trans | -55.3 | 98.4 | 167.1 | 177.8 | 0 | 0 | 0 | 0 | 109.3 | F187 S191 | F187-S189 PolarHBondContact O-N 3.27Å; F187-S189 VanDerWaalsContact O-N 3.16Å; S189-S191 PolarHBondContact O-N 2.88Å; S189-S191 VanDerWaalsContact O-N 3.1Å | ||
| 190 | K | 46.8 | Very low | 56 | Low | 184 Ų | 184 | 115.4 Ų | 115.4 | 80% | 0.8 | 65% | 0.647 | S | S | * | * | trans | -76.8 | 91.7 | 177.1 | -74.3 | 179 | 178.4 | 179.5 | 0 | 108.8 | S188 | S188-K190 PolarHBondContact O-N 2.75Š| ||
| 191 | S | 46.7 | Very low | 57.4 | Low | 57 Ų | 57 | 108.2 Ų | 108.2 | 40% | 0.399 | 62% | 0.622 | S | S | . | * | trans | -84.3 | 124.7 | 154.2 | -178.6 | 0 | 0 | 0 | 0 | 108.3 | S189 S193 T194 | S189-S191 PolarHBondContact O-N 2.88Å; S189-S191 VanDerWaalsContact O-N 3.1Å; S191-S193 PolarHBondContact O-N 3.36Å; S191-S193 PolarHBondContact OG-OG 3.41Å; S191-T194 PolarHBondContact O-N 3.23Å | ||
| 192 | P | 51.4 | Low | 59 | Low | 139 Ų | 139 | 106.7 Ų | 106.7 | 90% | 0.903 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.7 | 2.2 | -176.2 | 26.2 | -32.9 | 0 | 0 | 0 | 114.7 | ||
| 193 | S | 51.3 | Low | 60.9 | Low | 101 Ų | 101 | 97.9 Ų | 97.9 | 71% | 0.706 | 57% | 0.566 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.3 | 3.6 | -176.2 | 63.1 | 0 | 0 | 0 | 0 | 115.1 | S191 | S191-S193 PolarHBondContact O-N 3.36Å; S191-S193 PolarHBondContact OG-OG 3.41Å |
| 194 | T | 48.6 | Very low | 62.5 | Low | 96 Ų | 96 | 96.5 Ų | 96.5 | 59% | 0.589 | 56% | 0.562 | S | S | * | * | S | Bend | trans | -113.6 | 121.8 | -175.1 | -30.2 | 0 | 0 | 0 | 0 | 110.7 | S191 A196 | S191-T194 PolarHBondContact O-N 3.23Å; T194-A196 PolarHBondContact O-N 2.98Å |
| 195 | P | 53.6 | Low | 64.3 | Low | 115 Ų | 115 | 96 Ų | 96 | 75% | 0.747 | 57% | 0.566 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 134 | 173.3 | 21.9 | -29.7 | 0 | 0 | 0 | 109.1 | ||
| 196 | A | 57.7 | Low | 66.1 | Low | 86 Ų | 86 | 94.9 Ų | 94.9 | 71% | 0.711 | 55% | 0.554 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 133 | -178.8 | 0 | 0 | 0 | 0 | 0 | 110 | T194 R198 | T194-A196 PolarHBondContact O-N 2.98Å; A196-R198 PolarHBondContact O-N 3.42Å |
| 197 | P | 57 | Low | 67.8 | Low | 124 Ų | 124 | 88.9 Ų | 88.9 | 81% | 0.805 | 52% | 0.522 | S | S | * | . | P | Polyproline II helix | trans | -60.6 | 118.3 | 179.4 | 23.7 | -31.6 | 0 | 0 | 0 | 108.8 | Q199 | P197-Q199 PolarHBondContact O-N 3.39Å; P197-Q199 VanDerWaalsContact O-N 3.07Å |
| 198 | R | 63.6 | Low | 69.8 | Low | 135 Ų | 135 | 83.2 Ų | 83.2 | 51% | 0.509 | 50% | 0.496 | S | S | . | . | trans | -60.7 | 113.1 | 176.2 | -67.6 | -175 | -155.7 | 173.5 | 4.7 | 108.5 | T108 A196 | T108-R198 HydrophobicContact CG2-CB 3.43Å; T108-R198 VanDerWaalsContact CG2-CB 3.43Å; T108-R198 HydrophobicContact CG2-CG 4.32Å; T108-R198 PolarHBondContact OG1-O 3.06Å; A196-R198 PolarHBondContact O-N 3.42Å | ||
| 199 | Q | 73.1 | Confident | 72 | Confident | 136 Ų | 136 | 79.7 Ų | 79.7 | 64% | 0.636 | 47% | 0.472 | S | S | * | . | P | Polyproline II helix | trans | -77.6 | 154.2 | -173.7 | -161.9 | 171.6 | 0.2 | 0 | 0 | 111.4 | C107 T108 P197 | C107-Q199 WeakPolarHBondContact CB-O 3.28Å; T108-Q199 PolarHBondContact N-O 3.01Å; P197-Q199 PolarHBondContact O-N 3.39Å; P197-Q199 VanDerWaalsContact O-N 3.07Å |
| 200 | A | 82.9 | Confident | 74.3 | Confident | 52 Ų | 52 | 75.2 Ų | 75.2 | 43% | 0.43 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.9 | 126.5 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109 | K109 | K109-A200 HydrophobicContact CB-CB 4.01Å; K109-A200 CarbonylContact O-C 3.5Å; K109-A200 WeakPolarHBondContact O-CA 3.42Å |
| 201 | L | 86.6 | Confident | 76.6 | Confident | 36 Ų | 36 | 67.5 Ų | 67.5 | 19% | 0.188 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.3 | 145.8 | 175.2 | -63.1 | -178.4 | 0 | 0 | 0 | 109.6 | L105 C107 K109 L110 L111 L174 | L105-L201 HydrophobicContact CB-CD1 4.45Å; L105-L201 WeakPolarHBondContact O-CD1 3.46Å; C107-L201 HydrophobicContact CB-CB 4.28Å; C107-L201 HydrophobicContact CB-CD1 3.62Å; C107-L201 HydrophobicContact CB-CG 3.63Å; K109-L201 PolarHBondContact O-N 3.16Å; L110-L201 CarbonylContact C-O 3.53Å; L110-L201 WeakPolarHBondContact CA-O 3.33Å; L110-L201 HydrophobicContact CD1-CB 4.01Å; L111-L201 PolarHBondContact N-O 3.05Å; L174-L201 HydrophobicContact CD1-CD1 3.91Å; L174-L201 HydrophobicContact CD1-CD2 4.26Å; L174-L201 HydrophobicContact CD2-CB 4.26Å; L174-L201 HydrophobicContact CD2-CD1 4.23Å |
| 202 | K | 90.1 | Very high | 78.9 | Confident | 78 Ų | 78 | 69.5 Ų | 69.5 | 34% | 0.339 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 135 | 171.5 | 178.1 | 158.8 | 162.6 | -121.9 | 0 | 108.8 | L111 E175 | L111-K202 HydrophobicContact CB-CB 3.98Å; L111-K202 HydrophobicContact CB-CD 4.29Å; L111-K202 HydrophobicContact CB-CG 4Å; L111-K202 HydrophobicContact CD1-CB 4.29Å; L111-K202 HydrophobicContact CD1-CD 4.25Å; L111-K202 WeakPolarHBondContact O-CA 3.41Å; E175-K202 HydrophobicContact CB-CB 4.19Å; E175-K202 HydrophobicContact CB-CG 4.25Å; E175-K202 WeakPolarHBondContact CB-O 3.42Å; E175-K202 PolarHBondContact N-O 3.12Å; E175-K202 IonicContact OE1-NZ 3.85Å; E175-K202 PolarHBondContact OE1-NZ 3.39Å; E175-K202 WeakPolarHBondContact OE2-CD 3.44Å; E175-K202 WeakPolarHBondContact OE2-CE 3.47Å; E175-K202 IonicContact OE2-NZ 2.73Å; E175-K202 PolarHBondContact OE2-NZ 3.4Å |
| 203 | L | 91.8 | Very high | 81 | Confident | 1 Ų | 1 | 67.2 Ų | 67.2 | 1% | 0.005 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.5 | 140.7 | 170.1 | -62.6 | -178.3 | 0 | 0 | 0 | 109.5 | L95 L110 L111 I112 P113 L116 L172 R173 L174 | L95-L203 HydrophobicContact CD1-CD1 4Å; L110-L203 HydrophobicContact CD1-CD2 4.13Å; L110-L203 HydrophobicContact CD1-CG 4.16Å; L111-L203 PolarHBondContact O-N 3.41Å; I112-L203 HydrophobicContact CB-CD1 4.5Å; I112-L203 HydrophobicContact CG1-CD1 3.99Å; I112-L203 HydrophobicContact CG2-CD1 4.3Å; P113-L203 VanDerWaalsContact CG-O 3.28Å; P113-L203 WeakPolarHBondContact CG-O 3.47Å; L116-L203 HydrophobicContact CD2-CB 3.8Å; L116-L203 HydrophobicContact CD2-CD1 3.86Å; L116-L203 HydrophobicContact CD2-CG 4.49Å; L172-L203 HydrophobicContact CD1-CD1 4.17Å; R173-L203 WeakPolarHBondContact O-CA 3.34Å; L174-L203 HydrophobicContact CD2-CD2 3.86Å |
| 204 | S | 91.8 | Very high | 82.9 | Confident | 33 Ų | 33 | 65 Ų | 65 | 23% | 0.231 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.8 | 152.6 | 164.9 | -176.3 | 0 | 0 | 0 | 0 | 109.5 | L116 R173 G206 | L116-S204 WeakPolarHBondContact CD2-O 3.37Å; R173-S204 WeakPolarHBondContact O-CB 3.34Å; R173-S204 PolarHBondContact O-N 2.89Å; S204-G206 PolarHBondContact OG-N 3.39Å; S204-G206 VanDerWaalsContact OG-N 3.12Å |
| 205 | T | 92.1 | Very high | 84.9 | Confident | 90 Ų | 90 | 68.8 Ų | 68.8 | 55% | 0.552 | 37% | 0.366 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73.8 | -17.4 | 168.2 | 52.7 | 0 | 0 | 0 | 0 | 112.3 | P113 | P113-T205 HydrophobicContact CB-CG2 3.94Å; P113-T205 HydrophobicContact CG-CG2 4.04Å |
| 206 | G | 91.7 | Very high | 86.1 | Confident | 25 Ų | 25 | 65.6 Ų | 65.6 | 26% | 0.258 | 35% | 0.347 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.5 | 133.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | S204 | S204-G206 PolarHBondContact OG-N 3.39Å; S204-G206 VanDerWaalsContact OG-N 3.12Å |
| 207 | F | 95.3 | Very high | 86.9 | Confident | 13 Ų | 13 | 67.8 Ų | 67.8 | 6% | 0.057 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.3 | 169.9 | 177.7 | 67 | -81 | 0 | 0 | 0 | 109.3 | L116 H119 I120 E123 L170 V171 L172 V209 | L116-F207 HydrophobicContact CD1-CB 4.36Å; L116-F207 HydrophobicContact CD1-CD1 3.65Å; L116-F207 HydrophobicContact CD1-CE1 4.36Å; L116-F207 HydrophobicContact CD1-CG 4.28Å; H119-F207 HydrophobicContact CB-CE1 3.77Å; H119-F207 HydrophobicContact CB-CZ 4.1Å; I120-F207 HydrophobicContact CG1-CD1 4.13Å; I120-F207 HydrophobicContact CG1-CD2 3.95Å; I120-F207 HydrophobicContact CG1-CE1 4.12Å; I120-F207 HydrophobicContact CG1-CE2 3.92Å; I120-F207 HydrophobicContact CG1-CG 4.05Å; I120-F207 HydrophobicContact CG1-CZ 4.02Å; E123-F207 HydrophobicContact CB-CE2 3.89Å; E123-F207 HydrophobicContact CB-CZ 4Å; E123-F207 HydrophobicContact CG-CE2 3.99Å; E123-F207 HydrophobicContact CG-CZ 4.41Å; L170-F207 HydrophobicContact CD1-CB 4.37Å; L170-F207 HydrophobicContact CD1-CD2 3.67Å; L170-F207 HydrophobicContact CD1-CE2 4.42Å; L170-F207 HydrophobicContact CD1-CG 4.36Å; V171-F207 WeakPolarHBondContact O-CA 3.48Å; L172-F207 HydrophobicContact CD2-CB 3.88Å; F207-V209 HydrophobicContact CD2-CG2 3.78Å; F207-V209 HydrophobicContact CE2-CG2 3.68Å |
| 208 | R | 95.4 | Very high | 87.4 | Confident | 53 Ų | 53 | 68 Ų | 68 | 20% | 0.2 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.1 | 144.8 | 174.6 | -69.2 | 166.7 | 62.5 | -140.6 | 3.2 | 109.2 | V171 R173 I210 E224 | V171-R208 HydrophobicContact CB-CB 4.46Å; V171-R208 PolarHBondContact N-O 3.47Å; V171-R208 PolarHBondContact O-N 3.1Å; R173-R208 VanDerWaalsContact NH2-CD 3.29Å; R208-I210 HydrophobicContact CB-CD1 4.47Å; R208-E224 IonicContact NE-OE1 2.94Å |
| 209 | V | 97.4 | Very high | 87.3 | Confident | 1 Ų | 1 | 64.9 Ų | 64.9 | 1% | 0.006 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 123.7 | 171.7 | -169.5 | 0 | 0 | 0 | 0 | 108.5 | E123 L124 L127 L168 T169 L170 F207 | E123-V209 HydrophobicContact CB-CG2 4.47Å; E123-V209 HydrophobicContact CG-CB 4.11Å; E123-V209 HydrophobicContact CG-CG2 3.74Å; L124-V209 HydrophobicContact CD2-CG1 4.2Å; L127-V209 HydrophobicContact CD1-CB 3.56Å; L127-V209 HydrophobicContact CD1-CG1 3.37Å; L168-V209 HydrophobicContact CB-CG1 4Å; L168-V209 HydrophobicContact CD2-CG1 4.2Å; T169-V209 WeakPolarHBondContact O-CA 3.44Å; L170-V209 HydrophobicContact CD1-CG2 3.81Å; F207-V209 HydrophobicContact CD2-CG2 3.78Å; F207-V209 HydrophobicContact CE2-CG2 3.68Å |
| 210 | I | 95.4 | Very high | 86.8 | Confident | 25 Ų | 25 | 63.5 Ų | 63.5 | 13% | 0.128 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108 | 120 | 178.4 | -58.3 | 94.9 | 0 | 0 | 0 | 108.8 | L168 T169 V171 R208 I222 | L168-I210 WeakPolarHBondContact CA-O 3.37Å; T169-I210 PolarHBondContact N-O 2.89Å; T169-I210 PolarHBondContact O-N 3.11Å; V171-I210 HydrophobicContact CG2-CD1 3.91Å; R208-I210 HydrophobicContact CB-CD1 4.47Å; I210-I222 HydrophobicContact CG1-CG1 4.39Å; I210-I222 HydrophobicContact CG1-CG2 4.25Å; I210-I222 HydrophobicContact CG2-CG1 4.1Å |
| 211 | K | 96.1 | Very high | 85.9 | Confident | 21 Ų | 21 | 66.7 Ų | 66.7 | 9% | 0.091 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.8 | 131.8 | 175.5 | -174.6 | 170.6 | 65.2 | 164 | 0 | 111.5 | L127 S130 E131 F166 Q167 L168 L221 | L127-K211 HydrophobicContact CB-CD 4.46Å; L127-K211 WeakPolarHBondContact O-CD 3.49Å; L127-K211 PolarHBondContact O-NZ 3.33Å; S130-K211 PolarHBondContact OG-NZ 3.26Å; E131-K211 HydrophobicContact CG-CD 3.99Å; E131-K211 WeakPolarHBondContact OE1-CE 3.48Å; E131-K211 IonicContact OE1-NZ 2.87Å; E131-K211 PolarHBondContact OE1-NZ 3.16Å; F166-K211 HydrophobicContact CD2-CD 4.13Å; F166-K211 HydrophobicContact CD2-CG 4.17Å; Q167-K211 CarbonylContact O-C 3.52Å; Q167-K211 WeakPolarHBondContact O-CA 3.28Å; L168-K211 HydrophobicContact CD2-CB 3.78Å; L168-K211 HydrophobicContact CD2-CD 4.18Å; L168-K211 HydrophobicContact CD2-CG 3.84Å; K211-L221 PolarHBondContact N-O 2.94Å; K211-L221 PolarHBondContact O-N 2.72Å |
| 212 | K | 94.4 | Very high | 84.8 | Confident | 99 Ų | 99 | 70 Ų | 70 | 43% | 0.43 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.8 | 123.6 | 175.8 | 176.4 | -175.2 | -171.7 | -178.5 | 0 | 110.6 | F166 Q167 L214 L220 | F166-K212 CarbonylContact C-O 3.52Å; F166-K212 VanDerWaalsContact CA-O 3.28Å; F166-K212 WeakPolarHBondContact CA-O 3.42Å; Q167-K212 PolarHBondContact N-O 3.06Å; Q167-K212 PolarHBondContact O-N 2.96Å; K212-L214 PolarHBondContact O-N 2.94Å; K212-L220 HydrophobicContact CB-CD2 3.58Å; K212-L220 HydrophobicContact CD-CD2 3.5Å; K212-L220 VanDerWaalsContact CD-CD2 3.5Å; K212-L220 HydrophobicContact CG-CD2 3.42Å; K212-L220 VanDerWaalsContact CG-CD2 3.42Å |
| 213 | K | 94.1 | Very high | 83.4 | Confident | 91 Ų | 91 | 70.3 Ų | 70.3 | 40% | 0.396 | 38% | 0.382 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67 | 131.7 | 166.7 | -68.2 | -178.4 | -176.7 | 168.3 | 0 | 109.9 | E218 | K213-E218 IonicContact NZ-OE2 2.76Å; K213-E218 PolarHBondContact NZ-OE2 3.07Å |
| 214 | L | 92.9 | Very high | 81.6 | Confident | 54 Ų | 54 | 77.2 Ų | 77.2 | 28% | 0.283 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | -27.8 | -176.2 | -68.8 | 173.8 | 0 | 0 | 0 | 112.8 | P164 T165 Q167 K212 | P164-L214 HydrophobicContact CB-CD1 4.1Å; T165-L214 WeakPolarHBondContact O-CB 3.33Å; T165-L214 PolarHBondContact O-N 3.06Å; Q167-L214 HydrophobicContact CB-CD2 3.94Å; Q167-L214 HydrophobicContact CB-CG 4.41Å; K212-L214 PolarHBondContact O-N 2.94Å |
| 215 | Y | 89.1 | Confident | 79.3 | Confident | 176 Ų | 176 | 81 Ų | 81 | 69% | 0.69 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -125.2 | 41.1 | -174.7 | -49.8 | -73.4 | 0 | 0 | 0 | 112.2 | P164 | P164-Y215 WeakPolarHBondContact O-CE2 3.38Š|
| 216 | S | 79.8 | Confident | 78.7 | Confident | 49 Ų | 49 | 80.6 Ų | 80.6 | 34% | 0.343 | 43% | 0.434 | S | S | . | . | trans | -125.3 | 153.9 | 175 | -172.4 | 0 | 0 | 0 | 0 | 111.2 | E218 | S216-E218 VanDerWaalsContact C-N 3.34Å; S216-E218 WeakPolarHBondContact OG-CB 3.28Å; S216-E218 PolarHBondContact OG-N 3.38Å; S216-E218 VanDerWaalsContact OG-N 3.15Å | ||
| 217 | S | 73.9 | Confident | 78 | Confident | 131 Ų | 131 | 83.5 Ų | 83.5 | 92% | 0.916 | 44% | 0.443 | S | S | * | . | S | Bend | trans | -88 | -4.3 | 169 | 53.1 | 0 | 0 | 0 | 0 | 113 | ||
| 218 | E | 67.3 | Low | 77 | Confident | 130 Ų | 130 | 87.4 Ų | 87.4 | 61% | 0.607 | 46% | 0.464 | S | S | * | . | S | Bend | trans | -70.5 | 144.7 | 174.6 | -65.3 | 176 | 152 | 0 | 0 | 111.7 | K213 S216 | K213-E218 IonicContact NZ-OE2 2.76Å; K213-E218 PolarHBondContact NZ-OE2 3.07Å; S216-E218 VanDerWaalsContact C-N 3.34Å; S216-E218 WeakPolarHBondContact OG-CB 3.28Å; S216-E218 PolarHBondContact OG-N 3.38Å; S216-E218 VanDerWaalsContact OG-N 3.15Å |
| 219 | G | 62.8 | Low | 75.9 | Confident | 68 Ų | 68 | 89.4 Ų | 89.4 | 70% | 0.701 | 48% | 0.48 | S | S | * | . | P | Polyproline II helix | trans | -70.9 | 169.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 220 | L | 62.9 | Low | 74.6 | Confident | 107 Ų | 107 | 94.9 Ų | 94.9 | 56% | 0.56 | 51% | 0.509 | S | S | * | . | P | Polyproline II helix | trans | -65.1 | 134.1 | 179.8 | -62.9 | 173 | 0 | 0 | 0 | 112 | K212 | K212-L220 HydrophobicContact CB-CD2 3.58Å; K212-L220 HydrophobicContact CD-CD2 3.5Å; K212-L220 VanDerWaalsContact CD-CD2 3.5Å; K212-L220 HydrophobicContact CG-CD2 3.42Å; K212-L220 VanDerWaalsContact CG-CD2 3.42Å |
| 221 | L | 62.9 | Low | 73.2 | Confident | 120 Ų | 120 | 99.6 Ų | 99.6 | 63% | 0.628 | 54% | 0.535 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 120.5 | 169 | -62 | 176.9 | 0 | 0 | 0 | 108.5 | K211 | K211-L221 PolarHBondContact N-O 2.94Å; K211-L221 PolarHBondContact O-N 2.72Å |
| 222 | I | 62.9 | Low | 71.6 | Confident | 105 Ų | 105 | 105.2 Ų | 105.2 | 54% | 0.538 | 57% | 0.567 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -107.1 | 115.4 | 176.1 | -58.4 | 174.6 | 0 | 0 | 0 | 107.1 | I210 | I210-I222 HydrophobicContact CG1-CG1 4.39Å; I210-I222 HydrophobicContact CG1-CG2 4.25Å; I210-I222 HydrophobicContact CG2-CG1 4.1Å |
| 223 | E | 61.6 | Low | 69.8 | Low | 85 Ų | 85 | 105.7 Ų | 105.7 | 40% | 0.397 | 58% | 0.577 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -100.8 | 122.9 | 171.6 | -160.2 | 147.1 | -168.5 | 0 | 0 | 107.7 | L127 | L127-E223 HydrophobicContact CD2-CB 4.42Å; L127-E223 WeakPolarHBondContact CD2-OE2 3.44Å |
| 224 | E | 53.9 | Low | 67.8 | Low | 145 Ų | 145 | 106.9 Ų | 106.9 | 68% | 0.678 | 59% | 0.592 | S | S | * | * | trans | -101.7 | 116.6 | 174.6 | -82.1 | -165.2 | 134.3 | 0 | 0 | 108.8 | R208 | R208-E224 IonicContact NE-OE1 2.94Š| ||
| 225 | C | 43.6 | Very low | 65.5 | Low | 113 Ų | 113 | 111.7 Ų | 111.7 | 76% | 0.764 | 62% | 0.62 | S | S | * | * | trans | -105.1 | 0 | 174.6 | -52.5 | 0 | 0 | 0 | 0 | 111.3 | E123 | E123-C225 PolarHBondContact OE1-SG 2.94Å; E123-C225 PolarHBondContact OE2-SG 3.09Å |
Retrieved 225 of 225 residues in 52.6 ms
(Link to these results)