| 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 | 47.1 | Very low | 39.5 | Very low | 237 Ų | 237 | 143.9 Ų | 143.9 | 100% | 1.167 | 86% | 0.864 | S | S | * | * | 0 | 119.8 | 0 | -79.5 | 176.7 | 166.1 | 0 | 0 | 107.4 | |||||
| 2 | E | 34 | Very low | 39.1 | Very low | 172 Ų | 172 | 137.8 Ų | 137.8 | 80% | 0.804 | 85% | 0.853 | S | S | * | * | trans | -69.9 | 175 | 174.2 | -54.1 | 97.4 | 117.6 | 0 | 0 | 109.5 | ||||
| 3 | V | 50.9 | Low | 38.6 | Very low | 137 Ų | 137 | 145.9 Ų | 145.9 | 83% | 0.83 | 86% | 0.858 | S | S | * | * | cis | -145.9 | 150.3 | 44.1 | 172.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 4 | P | 43.7 | Very low | 38.4 | Very low | 109 Ų | 109 | 152.9 Ų | 152.9 | 71% | 0.708 | 86% | 0.862 | S | S | * | * | trans | -114.7 | -179.6 | -161.8 | 43.3 | -34.1 | 0 | 0 | 0 | 115.8 | ||||
| 5 | A | 39 | Very low | 38.4 | Very low | 100 Ų | 100 | 156 Ų | 156 | 83% | 0.826 | 86% | 0.863 | S | S | * | * | trans | 67.9 | 126.9 | 154.1 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 6 | A | 38.6 | Very low | 38.4 | Very low | 107 Ų | 107 | 152.8 Ų | 152.8 | 88% | 0.884 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 134.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||
| 7 | G | 41.4 | Very low | 38.5 | Very low | 78 Ų | 78 | 154.1 Ų | 154.1 | 80% | 0.804 | 86% | 0.858 | S | S | * | * | P | Polyproline II helix | trans | -95.3 | 124.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||
| 8 | T | 33.2 | Very low | 39 | Very low | 142 Ų | 142 | 152.6 Ų | 152.6 | 87% | 0.871 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 119.3 | 175.7 | -50.5 | 0 | 0 | 0 | 0 | 111.1 | ||
| 9 | Q | 39.8 | Very low | 39.6 | Very low | 193 Ų | 193 | 146.7 Ų | 146.7 | 90% | 0.902 | 83% | 0.831 | S | S | * | * | trans | -134.9 | 160.6 | 161.6 | -76.5 | -156.2 | -0.3 | 0 | 0 | 112.5 | ||||
| 10 | S | 32.9 | Very low | 40.3 | Very low | 115 Ų | 115 | 142 Ų | 142 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | trans | -110.1 | 173.8 | -159.6 | -172.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 11 | Q | 33.6 | Very low | 41.6 | Very low | 193 Ų | 193 | 138.7 Ų | 138.7 | 90% | 0.902 | 79% | 0.792 | S | S | * | * | trans | 90.4 | 102.3 | 169.5 | -50.8 | -161.4 | 11.4 | 0 | 0 | 117.4 | ||||
| 12 | G | 34.9 | Very low | 42.1 | Very low | 71 Ų | 71 | 133.7 Ų | 133.7 | 73% | 0.732 | 77% | 0.768 | S | S | * | * | trans | -162.8 | 23.3 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | R14 | G12-R14 PolarHBondContact O-N 2.81Š| ||
| 13 | R | 33 | Very low | 43.4 | Very low | 243 Ų | 243 | 128.1 Ų | 128.1 | 92% | 0.917 | 75% | 0.752 | S | S | * | * | trans | -71.4 | 90.6 | -174 | -168.3 | 176.8 | -172.1 | 176.7 | 3.2 | 110.4 | K15 | R13-K15 PolarHBondContact O-N 2.6Å; R13-K15 VanDerWaalsContact O-N 3.1Å | ||
| 14 | R | 36 | Very low | 44.1 | Very low | 243 Ų | 243 | 125.8 Ų | 125.8 | 92% | 0.917 | 73% | 0.732 | S | S | * | * | trans | -47.9 | 115.9 | 171.7 | -73.3 | -179.5 | 171.6 | 176.6 | -3.4 | 109.2 | G12 S16 | G12-R14 PolarHBondContact O-N 2.81Å; R14-S16 PolarHBondContact O-N 2.71Å | ||
| 15 | K | 37.5 | Very low | 45 | Very low | 200 Ų | 200 | 126.8 Ų | 126.8 | 87% | 0.87 | 72% | 0.722 | S | S | * | * | trans | -72.9 | 116.9 | 174.2 | -64.2 | 179.7 | -178.7 | 178.5 | 0 | 107.6 | R13 L17 | R13-K15 PolarHBondContact O-N 2.6Å; R13-K15 VanDerWaalsContact O-N 3.1Å; K15-L17 PolarHBondContact O-N 3.47Å | ||
| 16 | S | 38.2 | Very low | 46.3 | Very low | 105 Ų | 105 | 126 Ų | 126 | 73% | 0.734 | 71% | 0.707 | S | S | * | * | trans | -62.8 | 117.2 | 166.7 | 38.2 | 0 | 0 | 0 | 0 | 108.2 | R14 V18 | R14-S16 PolarHBondContact O-N 2.71Å; S16-V18 PolarHBondContact O-N 2.93Å | ||
| 17 | L | 41.2 | Very low | 47.7 | Very low | 175 Ų | 175 | 128.8 Ų | 128.8 | 92% | 0.916 | 69% | 0.694 | S | S | * | * | trans | -79.7 | 75.6 | 178.7 | -165 | 75.1 | 0 | 0 | 0 | 108.9 | K15 G19 | K15-L17 PolarHBondContact O-N 3.47Å; L17-G19 PolarHBondContact O-N 3.29Å | ||
| 18 | V | 47.3 | Very low | 48.9 | Very low | 126 Ų | 126 | 129.8 Ų | 129.8 | 76% | 0.764 | 68% | 0.678 | S | S | * | * | trans | -59.6 | 112.1 | 175.9 | -179.6 | 0 | 0 | 0 | 0 | 108 | S16 | S16-V18 PolarHBondContact O-N 2.93Š| ||
| 19 | G | 49.6 | Very low | 50.1 | Low | 42 Ų | 42 | 128.1 Ų | 128.1 | 43% | 0.433 | 66% | 0.663 | S | S | . | * | P | Polyproline II helix | trans | -62.5 | 149.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | L17 S21 | L17-G19 PolarHBondContact O-N 3.29Å; G19-S21 PolarHBondContact O-N 3.12Å |
| 20 | P | 53.2 | Low | 51.2 | Low | 52 Ų | 52 | 122.3 Ų | 122.3 | 34% | 0.338 | 64% | 0.641 | S | S | . | * | P | Polyproline II helix | trans | -54.9 | 135.6 | -175.4 | 19.8 | -31.8 | 0 | 0 | 0 | 111.7 | E24 R25 | P20-E24 HydrophobicContact CB-CB 3.96Å; P20-E24 HydrophobicContact CB-CG 4.13Å; P20-R25 HydrophobicContact CB-CG 4.19Å; P20-R25 HydrophobicContact CG-CG 3.88Å; P20-R25 VanDerWaalsContact O-CZ 3.23Å; P20-R25 PolarHBondContact O-NE 2.88Å; P20-R25 PolarHBondContact O-NH2 3.1Å |
| 21 | S | 67.8 | Low | 52.6 | Low | 73 Ų | 73 | 120.2 Ų | 120.2 | 51% | 0.51 | 63% | 0.626 | S | S | . | * | P | Polyproline II helix | trans | -52.3 | 155.3 | 176.9 | 173.7 | 0 | 0 | 0 | 0 | 111.3 | G19 A23 E24 R25 | G19-S21 PolarHBondContact O-N 3.12Å; S21-A23 PolarHBondContact O-N 3.49Å; S21-A23 PolarHBondContact OG-N 3.44Å; S21-E24 CarbonylContact O-C 3.54Å; S21-E24 WeakPolarHBondContact O-CA 3.3Å; S21-E24 VanDerWaalsContact O-CB 3.29Å; S21-E24 WeakPolarHBondContact O-CB 3.46Å; S21-E24 PolarHBondContact O-N 3.17Å; S21-R25 PolarHBondContact O-N 3.48Å |
| 22 | I | 59.3 | Low | 53.6 | Low | 131 Ų | 131 | 116.9 Ų | 116.9 | 67% | 0.672 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -55.5 | -38.9 | 174.3 | -61.1 | 176.1 | 0 | 0 | 0 | 110.1 | E24 R25 V26 | I22-E24 VanDerWaalsContact C-N 3.26Å; I22-E24 PolarHBondContact O-N 3.13Å; I22-R25 PolarHBondContact O-N 3.36Å; I22-V26 WeakPolarHBondContact O-CB 3.4Å; I22-V26 VanDerWaalsContact O-CG2 3.28Å; I22-V26 WeakPolarHBondContact O-CG2 3.49Å; I22-V26 PolarHBondContact O-N 3.21Å |
| 23 | A | 60.1 | Low | 54.5 | Low | 56 Ų | 56 | 119.9 Ų | 119.9 | 46% | 0.463 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -63.1 | -30.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | S21 R27 | S21-A23 PolarHBondContact O-N 3.49Å; S21-A23 PolarHBondContact OG-N 3.44Å; A23-R27 VanDerWaalsContact O-CG 3.31Å; A23-R27 WeakPolarHBondContact O-CG 3.41Å; A23-R27 PolarHBondContact O-N 2.94Å; A23-R27 VanDerWaalsContact O-N 3.09Å |
| 24 | E | 65 | Low | 55.1 | Low | 87 Ų | 87 | 114.3 Ų | 114.3 | 41% | 0.407 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -80.9 | -41 | -179.6 | -154.4 | 113.5 | -100 | 0 | 0 | 111.7 | P20 S21 I22 V26 R27 Q28 | P20-E24 HydrophobicContact CB-CB 3.96Å; P20-E24 HydrophobicContact CB-CG 4.13Å; S21-E24 CarbonylContact O-C 3.54Å; S21-E24 WeakPolarHBondContact O-CA 3.3Å; S21-E24 VanDerWaalsContact O-CB 3.29Å; S21-E24 WeakPolarHBondContact O-CB 3.46Å; S21-E24 PolarHBondContact O-N 3.17Å; I22-E24 VanDerWaalsContact C-N 3.26Å; I22-E24 PolarHBondContact O-N 3.13Å; E24-V26 VanDerWaalsContact C-N 3.32Å; E24-V26 PolarHBondContact O-N 2.99Å; E24-R27 WeakPolarHBondContact O-CB 3.41Å; E24-R27 PolarHBondContact O-N 3.28Å; E24-R27 IonicContact OE1-NH1 3.08Å; E24-R27 PolarHBondContact OE1-NH1 3.25Å; E24-Q28 WeakPolarHBondContact O-CG 3.28Å; E24-Q28 PolarHBondContact O-N 3.32Å |
| 25 | R | 62.6 | Low | 55.5 | Low | 130 Ų | 130 | 107 Ų | 107 | 49% | 0.491 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -63.1 | -37.4 | 170.4 | -82.8 | 178.8 | -99.9 | -167.4 | -4.3 | 111.8 | P20 S21 I22 Q28 L29 | P20-R25 HydrophobicContact CB-CG 4.19Å; P20-R25 HydrophobicContact CG-CG 3.88Å; P20-R25 VanDerWaalsContact O-CZ 3.23Å; P20-R25 PolarHBondContact O-NE 2.88Å; P20-R25 PolarHBondContact O-NH2 3.1Å; S21-R25 PolarHBondContact O-N 3.48Å; I22-R25 PolarHBondContact O-N 3.36Å; R25-Q28 PolarHBondContact O-N 2.82Å; R25-L29 WeakPolarHBondContact O-CB 3.36Å; R25-L29 WeakPolarHBondContact O-CG 3.44Å; R25-L29 PolarHBondContact O-N 3.45Å |
| 26 | V | 67.5 | Low | 55.5 | Low | 84 Ų | 84 | 103 Ų | 103 | 51% | 0.509 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.7 | -44 | 171.4 | 169 | 0 | 0 | 0 | 0 | 111.3 | I22 E24 Q28 L29 T30 | I22-V26 WeakPolarHBondContact O-CB 3.4Å; I22-V26 VanDerWaalsContact O-CG2 3.28Å; I22-V26 WeakPolarHBondContact O-CG2 3.49Å; I22-V26 PolarHBondContact O-N 3.21Å; E24-V26 VanDerWaalsContact C-N 3.32Å; E24-V26 PolarHBondContact O-N 2.99Å; V26-Q28 PolarHBondContact O-N 3.22Å; V26-L29 PolarHBondContact O-N 3.33Å; V26-T30 PolarHBondContact O-N 3.03Å; V26-T30 PolarHBondContact O-OG1 3.21Å; V26-T30 VanDerWaalsContact O-OG1 3.06Å |
| 27 | R | 67 | Low | 55.3 | Low | 166 Ų | 166 | 102.9 Ų | 102.9 | 63% | 0.626 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -59.9 | -45.1 | 173.9 | -74.8 | 168.4 | -176.2 | 162.9 | -0.7 | 112.5 | A23 E24 T30 S31 | A23-R27 VanDerWaalsContact O-CG 3.31Å; A23-R27 WeakPolarHBondContact O-CG 3.41Å; A23-R27 PolarHBondContact O-N 2.94Å; A23-R27 VanDerWaalsContact O-N 3.09Å; E24-R27 WeakPolarHBondContact O-CB 3.41Å; E24-R27 PolarHBondContact O-N 3.28Å; E24-R27 IonicContact OE1-NH1 3.08Å; E24-R27 PolarHBondContact OE1-NH1 3.25Å; R27-T30 PolarHBondContact O-N 3.1Å; R27-S31 PolarHBondContact O-N 3.28Å; R27-S31 PolarHBondContact O-OG 3.25Å |
| 28 | Q | 67.4 | Low | 54.9 | Low | 99 Ų | 99 | 99.4 Ų | 99.4 | 46% | 0.463 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -60 | -47.6 | 178.1 | -74.8 | 173 | -15.7 | 0 | 0 | 111.3 | E24 R25 V26 T30 S31 M32 | E24-Q28 WeakPolarHBondContact O-CG 3.28Å; E24-Q28 PolarHBondContact O-N 3.32Å; R25-Q28 PolarHBondContact O-N 2.82Å; V26-Q28 PolarHBondContact O-N 3.22Å; Q28-T30 PolarHBondContact O-N 3.49Å; Q28-S31 WeakPolarHBondContact CA-OG 3.22Å; Q28-S31 PolarHBondContact O-N 3.46Å; Q28-S31 PolarHBondContact O-OG 2.92Å; Q28-M32 WeakPolarHBondContact O-CG 3.28Å; Q28-M32 PolarHBondContact O-N 3.24Å |
| 29 | L | 59.1 | Low | 54.2 | Low | 107 Ų | 107 | 96.8 Ų | 96.8 | 56% | 0.56 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -62.4 | -39.1 | 176.3 | -71.1 | 170.5 | 0 | 0 | 0 | 112.7 | R25 V26 M32 L33 | R25-L29 WeakPolarHBondContact O-CB 3.36Å; R25-L29 WeakPolarHBondContact O-CG 3.44Å; R25-L29 PolarHBondContact O-N 3.45Å; V26-L29 PolarHBondContact O-N 3.33Å; L29-M32 PolarHBondContact O-N 2.84Å; L29-L33 WeakPolarHBondContact O-CG 3.28Å; L29-L33 PolarHBondContact O-N 3.41Å |
| 30 | T | 62.5 | Low | 53.5 | Low | 70 Ų | 70 | 103 Ų | 103 | 43% | 0.429 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -62.1 | -45.8 | 172.5 | -57.2 | 0 | 0 | 0 | 0 | 111.3 | V26 R27 Q28 M32 L33 D34 | V26-T30 PolarHBondContact O-N 3.03Å; V26-T30 PolarHBondContact O-OG1 3.21Å; V26-T30 VanDerWaalsContact O-OG1 3.06Å; R27-T30 PolarHBondContact O-N 3.1Å; Q28-T30 PolarHBondContact O-N 3.49Å; T30-M32 VanDerWaalsContact C-N 3.28Å; T30-M32 PolarHBondContact O-N 3.17Å; T30-L33 PolarHBondContact O-N 2.84Å; T30-D34 PolarHBondContact O-N 3.05Å |
| 31 | S | 62.1 | Low | 52.5 | Low | 71 Ų | 71 | 105.2 Ų | 105.2 | 50% | 0.497 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -65.7 | -27.3 | 179.9 | 66.3 | 0 | 0 | 0 | 0 | 114.1 | R27 Q28 S35 | R27-S31 PolarHBondContact O-N 3.28Å; R27-S31 PolarHBondContact O-OG 3.25Å; Q28-S31 WeakPolarHBondContact CA-OG 3.22Å; Q28-S31 PolarHBondContact O-N 3.46Å; Q28-S31 PolarHBondContact O-OG 2.92Å; S31-S35 WeakPolarHBondContact O-CB 3.19Å; S31-S35 PolarHBondContact O-N 3.01Å; S31-S35 PolarHBondContact O-OG 3.46Å |
| 32 | M | 53.6 | Low | 51 | Low | 124 Ų | 124 | 106 Ų | 106 | 61% | 0.611 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -73.8 | -27.8 | 171.5 | -71.9 | 179.2 | 65.3 | 0 | 0 | 112.8 | Q28 L29 T30 S35 T36 | Q28-M32 WeakPolarHBondContact O-CG 3.28Å; Q28-M32 PolarHBondContact O-N 3.24Å; L29-M32 PolarHBondContact O-N 2.84Å; T30-M32 VanDerWaalsContact C-N 3.28Å; T30-M32 PolarHBondContact O-N 3.17Å; M32-S35 WeakPolarHBondContact CA-OG 3.19Å; M32-S35 PolarHBondContact O-OG 2.94Å; M32-T36 PolarHBondContact O-OG1 3.34Å |
| 33 | L | 53.9 | Low | 50 | Low | 133 Ų | 133 | 111.2 Ų | 111.2 | 70% | 0.696 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -81.3 | -42.6 | 177.3 | -68.2 | 168.8 | 0 | 0 | 0 | 111.5 | L29 T30 S35 T36 | L29-L33 WeakPolarHBondContact O-CG 3.28Å; L29-L33 PolarHBondContact O-N 3.41Å; T30-L33 PolarHBondContact O-N 2.84Å; L33-S35 PolarHBondContact O-N 3.42Å; L33-T36 PolarHBondContact O-N 3.01Å |
| 34 | D | 47.2 | Very low | 48.9 | Very low | 127 Ų | 127 | 113.2 Ų | 113.2 | 68% | 0.679 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -66.4 | -20.9 | 176.4 | -76.5 | -27.1 | 0 | 0 | 0 | 113.4 | T30 T36 | T30-D34 PolarHBondContact O-N 3.05Å; D34-T36 VanDerWaalsContact C-N 3.33Å |
| 35 | S | 43.7 | Very low | 48 | Very low | 89 Ų | 89 | 115.9 Ų | 115.9 | 62% | 0.622 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.1 | 0.4 | 175.8 | 45 | 0 | 0 | 0 | 0 | 114.5 | S31 M32 L33 | S31-S35 WeakPolarHBondContact O-CB 3.19Å; S31-S35 PolarHBondContact O-N 3.01Å; S31-S35 PolarHBondContact O-OG 3.46Å; M32-S35 WeakPolarHBondContact CA-OG 3.19Å; M32-S35 PolarHBondContact O-OG 2.94Å; L33-S35 PolarHBondContact O-N 3.42Å |
| 36 | T | 38.3 | Very low | 46.9 | Very low | 116 Ų | 116 | 115.7 Ų | 115.7 | 71% | 0.712 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -109.1 | 38.9 | -176.8 | -44.9 | 0 | 0 | 0 | 0 | 112.9 | M32 L33 D34 | M32-T36 PolarHBondContact O-OG1 3.34Å; L33-T36 PolarHBondContact O-N 3.01Å; D34-T36 VanDerWaalsContact C-N 3.33Å |
| 37 | S | 32.1 | Very low | 45.5 | Very low | 103 Ų | 103 | 115.2 Ų | 115.2 | 72% | 0.72 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -154 | 54.5 | 175.6 | 71.6 | 0 | 0 | 0 | 0 | 116.4 | ||
| 38 | A | 32.9 | Very low | 44 | Very low | 101 Ų | 101 | 114 Ų | 114 | 84% | 0.835 | 71% | 0.711 | S | S | * | * | trans | -155.3 | 133.8 | 167.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 39 | G | 33.8 | Very low | 42.7 | Very low | 71 Ų | 71 | 114.1 Ų | 114.1 | 73% | 0.732 | 72% | 0.72 | S | S | * | * | trans | 75.5 | 133.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 40 | D | 33.7 | Very low | 41.5 | Very low | 173 Ų | 173 | 114.7 Ų | 114.7 | 93% | 0.925 | 73% | 0.728 | S | S | * | * | cis | -142.1 | 159.8 | 4.3 | -86.6 | -43.5 | 0 | 0 | 0 | 111.5 | ||||
| 41 | A | 32.9 | Very low | 40.3 | Very low | 98 Ų | 98 | 118.6 Ų | 118.6 | 81% | 0.81 | 75% | 0.746 | S | S | * | * | trans | -141.6 | 119.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 42 | A | 35.7 | Very low | 39 | Very low | 89 Ų | 89 | 123.6 Ų | 123.6 | 74% | 0.736 | 76% | 0.761 | S | S | * | * | trans | 169.2 | 148.7 | 140.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 43 | R | 38.5 | Very low | 38.2 | Very low | 242 Ų | 242 | 121.2 Ų | 121.2 | 91% | 0.913 | 77% | 0.768 | S | S | * | * | trans | 68.1 | 146.6 | 164.4 | -65.9 | 173.5 | 179.5 | 140.5 | -1.4 | 118.2 | ||||
| 44 | S | 37.6 | Very low | 37.4 | Very low | 97 Ų | 97 | 122.9 Ų | 122.9 | 68% | 0.678 | 77% | 0.773 | S | S | * | * | cis | -173.7 | 134 | -31.6 | 44.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 45 | V | 46.7 | Very low | 36.7 | Very low | 143 Ų | 143 | 126.2 Ų | 126.2 | 87% | 0.867 | 78% | 0.776 | S | S | * | * | trans | 73.1 | 146.6 | 154.8 | 175.8 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 46 | P | 38.7 | Very low | 36.3 | Very low | 127 Ų | 127 | 127.2 Ų | 127.2 | 83% | 0.825 | 77% | 0.77 | S | S | * | * | trans | -118.7 | 175.7 | -162.8 | 42.1 | -28.8 | 0 | 0 | 0 | 115.9 | ||||
| 47 | G | 39.2 | Very low | 36 | Very low | 74 Ų | 74 | 130.4 Ų | 130.4 | 76% | 0.763 | 77% | 0.774 | S | S | * | * | trans | -156.2 | 152.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 48 | T | 35.3 | Very low | 36.1 | Very low | 141 Ų | 141 | 129.9 Ų | 129.9 | 87% | 0.865 | 78% | 0.777 | S | S | * | * | trans | -126.1 | -170.1 | -171.1 | 50.7 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 49 | P | 40.1 | Very low | 35.9 | Very low | 100 Ų | 100 | 132.7 Ų | 132.7 | 65% | 0.649 | 78% | 0.778 | S | S | * | * | -132.8 | -179.6 | -63.4 | 38.7 | -22.7 | 0 | 0 | 0 | 114.4 | |||||
| 50 | T | 33.7 | Very low | 35.7 | Very low | 119 Ų | 119 | 139.3 Ų | 139.3 | 73% | 0.73 | 78% | 0.78 | S | S | * | * | trans | 46.6 | 127.2 | 151.3 | 52.9 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 51 | L | 37.2 | Very low | 35.8 | Very low | 153 Ų | 153 | 136.1 Ų | 136.1 | 80% | 0.801 | 78% | 0.778 | S | S | * | * | 179.3 | 148.6 | 104.7 | -105.1 | 165.7 | 0 | 0 | 0 | 115.9 | |||||
| 52 | H | 34.1 | Very low | 35.9 | Very low | 176 Ų | 176 | 137.7 Ų | 137.7 | 82% | 0.815 | 77% | 0.768 | S | S | * | * | trans | 65.2 | 134.6 | 150.9 | -112 | 68.2 | 0 | 0 | 0 | 122.4 | ||||
| 53 | G | 36.7 | Very low | 35.7 | Very low | 74 Ų | 74 | 140.3 Ų | 140.3 | 76% | 0.763 | 77% | 0.77 | S | S | * | * | trans | 157.7 | 104.2 | 170.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 54 | Q | 36.7 | Very low | 35.5 | Very low | 168 Ų | 168 | 135 Ų | 135 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | trans | -68.7 | 166.7 | -179.6 | -56.3 | 179.5 | -7.1 | 0 | 0 | 111.5 | ||||
| 55 | R | 32.6 | Very low | 35.4 | Very low | 197 Ų | 197 | 139.2 Ų | 139.2 | 74% | 0.743 | 77% | 0.771 | S | S | * | * | cis | -175.4 | 145.5 | 43.3 | -172.7 | 167.1 | 162.7 | 151.5 | 1.8 | 115 | ||||
| 56 | E | 35.4 | Very low | 35 | Very low | 109 Ų | 109 | 136.8 Ų | 136.8 | 51% | 0.509 | 76% | 0.76 | S | S | . | * | trans | 54.1 | 123.9 | 157.4 | -74.3 | -175.9 | 98 | 0 | 0 | 124.1 | ||||
| 57 | K | 31.9 | Very low | 34.9 | Very low | 183 Ų | 183 | 135.7 Ų | 135.7 | 80% | 0.796 | 75% | 0.752 | S | S | * | * | trans | 59.6 | 140.8 | 134.3 | -60.6 | 168 | 179.7 | 162.3 | 0 | 119.1 | ||||
| 58 | A | 34.2 | Very low | 34.7 | Very low | 93 Ų | 93 | 141.4 Ų | 141.4 | 77% | 0.769 | 76% | 0.757 | S | S | * | * | cis | -150.4 | -177.6 | 23.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 59 | D | 30.2 | Very low | 34.9 | Very low | 160 Ų | 160 | 140.2 Ų | 140.2 | 86% | 0.856 | 74% | 0.74 | S | S | * | * | trans | -77 | 173.5 | -169.3 | -55 | -90.4 | 0 | 0 | 0 | 117.2 | ||||
| 60 | R | 29.6 | Very low | 34.6 | Very low | 210 Ų | 210 | 139.8 Ų | 139.8 | 79% | 0.792 | 73% | 0.728 | S | S | * | * | trans | 79.1 | 88.6 | 156.5 | -161 | -174.6 | -171.2 | 105.7 | 3 | 117.7 | E62 | R60-E62 HydrophobicContact CG-CG 4.34Å; R60-E62 IonicContact CZ-OE1 3.82Å; R60-E62 IonicContact NE-OE1 2.62Å; R60-E62 PolarHBondContact NE-OE1 3.39Å; R60-E62 IonicContact NH2-OE1 3.62Å; R60-E62 PolarHBondContact NH2-OE1 3.08Å | ||
| 61 | A | 34.9 | Very low | 34.6 | Very low | 106 Ų | 106 | 143.7 Ų | 143.7 | 88% | 0.876 | 74% | 0.735 | S | S | * | * | trans | -106.3 | 128.4 | 153.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 62 | E | 34.6 | Very low | 34.8 | Very low | 130 Ų | 130 | 141.6 Ų | 141.6 | 61% | 0.607 | 73% | 0.728 | S | S | * | * | trans | -89.6 | 157.8 | -177.5 | -61.9 | -170.3 | 161.4 | 0 | 0 | 112.4 | R60 V64 | R60-E62 HydrophobicContact CG-CG 4.34Å; R60-E62 IonicContact CZ-OE1 3.82Å; R60-E62 IonicContact NE-OE1 2.62Å; R60-E62 PolarHBondContact NE-OE1 3.39Å; R60-E62 IonicContact NH2-OE1 3.62Å; R60-E62 PolarHBondContact NH2-OE1 3.08Å; E62-V64 VanDerWaalsContact C-N 3.33Å; E62-V64 PolarHBondContact O-N 3.42Å | ||
| 63 | N | 31.4 | Very low | 35.1 | Very low | 145 Ų | 145 | 136.2 Ų | 136.2 | 78% | 0.775 | 70% | 0.703 | S | S | * | * | trans | -77.4 | 77.1 | -173.3 | -171.6 | -6.8 | 0 | 0 | 0 | 112 | K65 | N63-K65 PolarHBondContact O-N 2.84Š| ||
| 64 | V | 35.1 | Very low | 35 | Very low | 129 Ų | 129 | 136.5 Ų | 136.5 | 78% | 0.782 | 69% | 0.685 | S | S | * | * | trans | -69.8 | 98 | 177.2 | -178.5 | 0 | 0 | 0 | 0 | 110.2 | E62 S66 | E62-V64 VanDerWaalsContact C-N 3.33Å; E62-V64 PolarHBondContact O-N 3.42Å; V64-S66 PolarHBondContact O-N 3.19Å | ||
| 65 | K | 35.8 | Very low | 35.3 | Very low | 187 Ų | 187 | 133.9 Ų | 133.9 | 81% | 0.813 | 68% | 0.676 | S | S | * | * | trans | -65.5 | 114.8 | 170.8 | -68.9 | -179.6 | 178.6 | 177.6 | 0 | 109.9 | N63 | N63-K65 PolarHBondContact O-N 2.84Š| ||
| 66 | S | 36.9 | Very low | 35.3 | Very low | 91 Ų | 91 | 130.1 Ų | 130.1 | 64% | 0.636 | 68% | 0.677 | S | S | * | * | trans | -75.1 | 153 | -176.8 | 52.9 | 0 | 0 | 0 | 0 | 113.3 | V64 F68 | V64-S66 PolarHBondContact O-N 3.19Å; S66-F68 PolarHBondContact O-N 3.44Å; S66-F68 VanDerWaalsContact O-N 3.13Å | ||
| 67 | P | 37.7 | Very low | 35.2 | Very low | 104 Ų | 104 | 130.8 Ų | 130.8 | 68% | 0.675 | 68% | 0.678 | S | S | * | * | trans | -86.6 | 89.9 | -162.6 | 33.4 | -36.7 | 0 | 0 | 0 | 113.9 | F69 | P67-F69 PolarHBondContact O-N 2.64Š| ||
| 68 | F | 35.8 | Very low | 35.4 | Very low | 195 Ų | 195 | 130.9 Ų | 130.9 | 86% | 0.855 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -62.9 | -18.2 | 166.1 | -105.8 | -91 | 0 | 0 | 0 | 113.7 | S66 F70 | S66-F68 PolarHBondContact O-N 3.44Å; S66-F68 VanDerWaalsContact O-N 3.13Å; F68-F70 VanDerWaalsContact C-N 3.3Å; F68-F70 PolarHBondContact O-N 3.29Å |
| 69 | F | 38.6 | Very low | 35.1 | Very low | 116 Ų | 116 | 130.3 Ų | 130.3 | 51% | 0.509 | 66% | 0.664 | S | S | . | * | G | 310 helix | trans | -62 | -32.6 | -176 | -132.7 | -100.3 | 0 | 0 | 0 | 113.8 | P67 K71 K437 | P67-F69 PolarHBondContact O-N 2.64Å; F69-K71 VanDerWaalsContact C-N 3.33Å; F69-K71 PolarHBondContact O-N 2.95Å; F69-K437 HydrophobicContact CE1-CB 4.49Å; F69-K437 HydrophobicContact CZ-CB 4.39Å; F69-K437 HydrophobicContact CZ-CD 4.34Å |
| 70 | F | 33.6 | Very low | 35.2 | Very low | 91 Ų | 91 | 128.9 Ų | 128.9 | 40% | 0.399 | 67% | 0.667 | S | S | . | * | G | 310 helix | trans | -75 | -17.4 | -164 | -133.7 | -89.9 | 0 | 0 | 0 | 114.7 | F68 M74 F451 | F68-F70 VanDerWaalsContact C-N 3.3Å; F68-F70 PolarHBondContact O-N 3.29Å; F70-M74 HydrophobicContact CD1-CE 4.08Å; F70-M74 HydrophobicContact CD1-SD 4.11Å; F70-M74 HydrophobicContact CE1-CE 3.22Å; F70-M74 HydrophobicContact CE1-SD 3.62Å; F70-M74 HydrophobicContact CE2-CE 4.4Å; F70-M74 HydrophobicContact CZ-CE 3.42Å; F70-M74 VanDerWaalsContact CZ-CE 3.42Å; F70-M74 HydrophobicContact CZ-SD 4.42Å; F70-F451 AromaticContact CE1-CE2 3.74Å; F70-F451 HydrophobicContact CE1-CE2 3.74Å; F70-F451 HydrophobicContact CE1-CZ 4.17Å; F70-F451 AromaticContact CZ-CE2 3.77Å; F70-F451 HydrophobicContact CZ-CE2 3.77Å; F70-F451 AromaticContact CZ-CZ 3.94Å; F70-F451 HydrophobicContact CZ-CZ 3.94Å |
| 71 | K | 33 | Very low | 35.4 | Very low | 200 Ų | 200 | 123.1 Ų | 123.1 | 87% | 0.87 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -98 | -4 | -168.3 | -155.7 | 163.6 | -174.3 | 171.2 | 0 | 115 | F69 | F69-K71 VanDerWaalsContact C-N 3.33Å; F69-K71 PolarHBondContact O-N 2.95Å |
| 72 | T | 41.6 | Very low | 35.3 | Very low | 109 Ų | 109 | 124.7 Ų | 124.7 | 67% | 0.669 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.7 | -22 | -174.3 | -50.7 | 0 | 0 | 0 | 0 | 113.4 | ||
| 73 | F | 40.1 | Very low | 35.2 | Very low | 64 Ų | 64 | 127.7 Ų | 127.7 | 28% | 0.281 | 66% | 0.662 | S | S | . | * | S | Bend | trans | -112.9 | -5.9 | -168.1 | -85.3 | -86.3 | 0 | 0 | 0 | 116.1 | L75 C438 | F73-L75 PolarHBondContact O-N 3.48Å; F73-C438 HydrophobicContact CE1-CB 4.31Å |
| 74 | M | 36.3 | Very low | 35 | Very low | 80 Ų | 80 | 126 Ų | 126 | 39% | 0.394 | 66% | 0.66 | S | S | . | * | P | Polyproline II helix | trans | -81.9 | 116.6 | 173.9 | -80.1 | -166.5 | 170.5 | 0 | 0 | 111.9 | F70 M454 | F70-M74 HydrophobicContact CD1-CE 4.08Å; F70-M74 HydrophobicContact CD1-SD 4.11Å; F70-M74 HydrophobicContact CE1-CE 3.22Å; F70-M74 HydrophobicContact CE1-SD 3.62Å; F70-M74 HydrophobicContact CE2-CE 4.4Å; F70-M74 HydrophobicContact CZ-CE 3.42Å; F70-M74 VanDerWaalsContact CZ-CE 3.42Å; F70-M74 HydrophobicContact CZ-SD 4.42Å; M74-M454 HydrophobicContact CE-CE 4.09Å; M74-M454 HydrophobicContact CE-CG 4.3Å; M74-M454 HydrophobicContact CE-SD 3.31Å; M74-M454 WeakPolarHBondContact CE-SD 3.38Å; M74-M454 HydrophobicContact SD-SD 4.35Å |
| 75 | L | 42.2 | Very low | 34.6 | Very low | 112 Ų | 112 | 128 Ų | 128 | 59% | 0.586 | 67% | 0.666 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 140.6 | 149.3 | -67.9 | 166.9 | 0 | 0 | 0 | 108.5 | F73 F77 | F73-L75 PolarHBondContact O-N 3.48Å; L75-F77 PolarHBondContact O-N 3.47Å |
| 76 | P | 32.9 | Very low | 34.4 | Very low | 119 Ų | 119 | 124 Ų | 124 | 77% | 0.773 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 138.2 | -177.5 | 25.6 | -34 | 0 | 0 | 0 | 111 | R78 | P76-R78 PolarHBondContact O-N 3.44Š|
| 77 | F | 33.5 | Very low | 34 | Very low | 122 Ų | 122 | 128.1 Ų | 128.1 | 54% | 0.535 | 67% | 0.666 | S | S | . | * | trans | -50.3 | 108.3 | 176.4 | -107.2 | -91.7 | 0 | 0 | 0 | 110.7 | L75 S79 M454 | L75-F77 PolarHBondContact O-N 3.47Å; F77-S79 PolarHBondContact O-N 2.92Å; F77-S79 VanDerWaalsContact O-N 3.15Å; F77-M454 HydrophobicContact CD2-CE 4.35Å; F77-M454 HydrophobicContact CE1-CE 4.02Å; F77-M454 HydrophobicContact CE2-CE 3.49Å; F77-M454 VanDerWaalsContact CE2-CE 3.49Å; F77-M454 HydrophobicContact CE2-SD 3.79Å; F77-M454 HydrophobicContact CZ-CE 3.29Å; F77-M454 HydrophobicContact CZ-SD 3.73Å | ||
| 78 | R | 34.8 | Very low | 33.4 | Very low | 186 Ų | 186 | 130.6 Ų | 130.6 | 70% | 0.702 | 67% | 0.669 | S | S | * | * | trans | -80.2 | 97 | 175.9 | -166 | 171.4 | -171.2 | 154.9 | 3.2 | 108.9 | P76 S80 | P76-R78 PolarHBondContact O-N 3.44Å; R78-S80 PolarHBondContact O-N 2.86Å | ||
| 79 | S | 27.7 | Very low | 33.2 | Very low | 80 Ų | 80 | 125.5 Ų | 125.5 | 56% | 0.559 | 65% | 0.654 | S | S | * | * | trans | -56.3 | 135.6 | 174 | -179.6 | 0 | 0 | 0 | 0 | 110.3 | F77 S81 | F77-S79 PolarHBondContact O-N 2.92Å; F77-S79 VanDerWaalsContact O-N 3.15Å; S79-S81 PolarHBondContact O-N 2.93Å; S79-S81 PolarHBondContact OG-OG 3.21Å | ||
| 80 | S | 32.3 | Very low | 32.6 | Very low | 131 Ų | 131 | 125.1 Ų | 125.1 | 92% | 0.916 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77 | 60.2 | -176.1 | -161.6 | 0 | 0 | 0 | 0 | 111.9 | R78 | R78-S80 PolarHBondContact O-N 2.86Š|
| 81 | S | 34.2 | Very low | 32.6 | Very low | 88 Ų | 88 | 125.3 Ų | 125.3 | 62% | 0.615 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -157 | 8 | -169.8 | 61.9 | 0 | 0 | 0 | 0 | 114.8 | S79 | S79-S81 PolarHBondContact O-N 2.93Å; S79-S81 PolarHBondContact OG-OG 3.21Å |
| 82 | E | 34.2 | Very low | 32.5 | Very low | 140 Ų | 140 | 120.8 Ų | 120.8 | 65% | 0.654 | 64% | 0.642 | S | S | * | * | trans | -111.9 | 102.4 | 176.4 | -69.7 | -171.2 | 154.1 | 0 | 0 | 110.1 | ||||
| 83 | E | 30.7 | Very low | 32 | Very low | 192 Ų | 192 | 122.2 Ų | 122.2 | 90% | 0.897 | 64% | 0.636 | S | S | * | * | trans | -66.7 | 158.9 | -178.6 | -65.9 | 178.7 | 123.5 | 0 | 0 | 112.8 | L85 | E83-L85 PolarHBondContact O-N 3.04Å; E83-L85 VanDerWaalsContact O-N 3.08Å | ||
| 84 | C | 27.1 | Very low | 31.6 | Very low | 110 Ų | 110 | 123.2 Ų | 123.2 | 74% | 0.743 | 65% | 0.647 | S | S | * | * | trans | -55.6 | 105.4 | -168.2 | -170.3 | 0 | 0 | 0 | 0 | 115 | ||||
| 85 | L | 27.2 | Very low | 31.4 | Very low | 171 Ų | 171 | 128.9 Ų | 128.9 | 90% | 0.895 | 67% | 0.67 | S | S | * | * | trans | -138.5 | 61.1 | 155.9 | -77.1 | -178.8 | 0 | 0 | 0 | 110.5 | E83 | E83-L85 PolarHBondContact O-N 3.04Å; E83-L85 VanDerWaalsContact O-N 3.08Å | ||
| 86 | T | 31.1 | Very low | 30.7 | Very low | 102 Ų | 102 | 127.4 Ų | 127.4 | 63% | 0.626 | 68% | 0.681 | S | S | * | * | trans | -77.9 | 117.6 | 161.1 | 46.8 | 0 | 0 | 0 | 0 | 108.9 | Q88 | T86-Q88 PolarHBondContact O-N 3.25Š| ||
| 87 | E | 29.4 | Very low | 30.5 | Very low | 179 Ų | 179 | 124.7 Ų | 124.7 | 84% | 0.836 | 68% | 0.676 | S | S | * | * | trans | -58.8 | 132.4 | 164.7 | -72.3 | -166.6 | 148 | 0 | 0 | 109 | T89 | E87-T89 PolarHBondContact O-N 3.48Š| ||
| 88 | Q | 25.7 | Very low | 30.4 | Very low | 155 Ų | 155 | 128.2 Ų | 128.2 | 72% | 0.724 | 69% | 0.69 | S | S | * | * | trans | -77.2 | 90.2 | -169.9 | -176.6 | 175.8 | -13.9 | 0 | 0 | 111 | T86 D90 | T86-Q88 PolarHBondContact O-N 3.25Å; Q88-D90 VanDerWaalsContact C-N 3.3Å; Q88-D90 WeakPolarHBondContact CG-OD1 3.44Å; Q88-D90 VanDerWaalsContact NE2-CG 3.28Å; Q88-D90 PolarHBondContact NE2-OD1 3.41Å; Q88-D90 PolarHBondContact NE2-OD2 3.09Å; Q88-D90 PolarHBondContact O-N 2.88Å | ||
| 89 | T | 31.4 | Very low | 30.1 | Very low | 89 Ų | 89 | 125 Ų | 125 | 55% | 0.546 | 69% | 0.694 | S | S | . | * | trans | -77.2 | 82 | 167.8 | 52.3 | 0 | 0 | 0 | 0 | 110 | E87 F91 | E87-T89 PolarHBondContact O-N 3.48Å; T89-F91 VanDerWaalsContact C-N 3.34Å; T89-F91 PolarHBondContact O-N 2.98Å | ||
| 90 | D | 25.9 | Very low | 30.2 | Very low | 108 Ų | 108 | 129 Ų | 129 | 58% | 0.578 | 71% | 0.709 | S | S | * | * | trans | -65.2 | 90.3 | 172.6 | -76.7 | -31.1 | 0 | 0 | 0 | 110.7 | Q88 I92 | Q88-D90 VanDerWaalsContact C-N 3.3Å; Q88-D90 WeakPolarHBondContact CG-OD1 3.44Å; Q88-D90 VanDerWaalsContact NE2-CG 3.28Å; Q88-D90 PolarHBondContact NE2-OD1 3.41Å; Q88-D90 PolarHBondContact NE2-OD2 3.09Å; Q88-D90 PolarHBondContact O-N 2.88Å; D90-I92 HydrophobicContact CB-CG1 4.22Å; D90-I92 PolarHBondContact O-N 2.82Å | ||
| 91 | F | 32.4 | Very low | 30.1 | Very low | 95 Ų | 95 | 131.4 Ų | 131.4 | 42% | 0.417 | 71% | 0.706 | S | S | . | * | trans | -70 | 78.9 | 160.7 | -72.5 | -72.2 | 0 | 0 | 0 | 109 | T89 Y93 F363 | T89-F91 VanDerWaalsContact C-N 3.34Å; T89-F91 PolarHBondContact O-N 2.98Å; F91-Y93 PolarHBondContact O-N 3.25Å; F91-F363 AromaticContact CD1-CE2 3.9Å; F91-F363 HydrophobicContact CD1-CE2 3.9Å; F91-F363 HydrophobicContact CD2-CE2 4.35Å; F91-F363 HydrophobicContact CE1-CD2 4.1Å; F91-F363 AromaticContact CE1-CE2 3.93Å; F91-F363 HydrophobicContact CE1-CE2 3.93Å; F91-F363 HydrophobicContact CE2-CD2 4.44Å; F91-F363 HydrophobicContact CE2-CE2 4.37Å; F91-F363 HydrophobicContact CG-CE2 4.12Å; F91-F363 HydrophobicContact CZ-CD2 4.05Å; F91-F363 HydrophobicContact CZ-CE2 4.17Å | ||
| 92 | I | 31.2 | Very low | 30 | Very low | 105 Ų | 105 | 135.6 Ų | 135.6 | 54% | 0.538 | 72% | 0.72 | S | S | . | * | trans | -56.8 | 120.5 | 177.2 | -61.2 | 172.5 | 0 | 0 | 0 | 108.7 | D90 V94 | D90-I92 HydrophobicContact CB-CG1 4.22Å; D90-I92 PolarHBondContact O-N 2.82Å; I92-V94 VanDerWaalsContact C-N 3.31Å; I92-V94 HydrophobicContact CG2-CG2 4.3Å; I92-V94 PolarHBondContact O-N 2.99Å | ||
| 93 | Y | 31.5 | Very low | 30.1 | Very low | 139 Ų | 139 | 135.9 Ų | 135.9 | 55% | 0.545 | 73% | 0.725 | S | S | . | * | trans | -64.6 | 91 | 167.2 | -82.5 | -95 | 0 | 0 | 0 | 109.4 | F91 K95 | F91-Y93 PolarHBondContact O-N 3.25Å; Y93-K95 PolarHBondContact O-N 2.96Å | ||
| 94 | V | 32.5 | Very low | 29.9 | Very low | 84 Ų | 84 | 135.4 Ų | 135.4 | 51% | 0.509 | 72% | 0.723 | S | S | . | * | trans | -72.9 | 97.8 | 174.1 | -178.7 | 0 | 0 | 0 | 0 | 108.5 | I92 G96 | I92-V94 VanDerWaalsContact C-N 3.31Å; I92-V94 HydrophobicContact CG2-CG2 4.3Å; I92-V94 PolarHBondContact O-N 2.99Å; V94-G96 PolarHBondContact O-N 3.49Å | ||
| 95 | K | 31.1 | Very low | 30.2 | Very low | 199 Ų | 199 | 134.8 Ų | 134.8 | 87% | 0.865 | 73% | 0.725 | S | S | * | * | trans | -63.6 | 115.8 | 171.1 | -178.3 | 179.2 | -179.2 | 179 | 0 | 109.2 | Y93 G97 | Y93-K95 PolarHBondContact O-N 2.96Å; K95-G97 VanDerWaalsContact C-N 3.33Å; K95-G97 PolarHBondContact O-N 2.99Å | ||
| 96 | G | 28.5 | Very low | 30.5 | Very low | 81 Ų | 81 | 136 Ų | 136 | 84% | 0.835 | 73% | 0.726 | S | S | * | * | trans | -67.1 | 81.5 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | V94 | V94-G96 PolarHBondContact O-N 3.49Š| ||
| 97 | G | 29.2 | Very low | 30.4 | Very low | 63 Ų | 63 | 135.7 Ų | 135.7 | 65% | 0.649 | 73% | 0.734 | S | S | * | * | trans | -82.7 | 127.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | K95 | K95-G97 VanDerWaalsContact C-N 3.33Å; K95-G97 PolarHBondContact O-N 2.99Å | ||
| 98 | K | 30.9 | Very low | 30.7 | Very low | 195 Ų | 195 | 132.6 Ų | 132.6 | 85% | 0.848 | 73% | 0.729 | S | S | * | * | trans | -61.2 | 132.3 | 170.9 | -66.2 | -178.8 | 179.2 | -179.5 | 0 | 109.7 | N100 | K98-N100 PolarHBondContact O-N 2.85Š| ||
| 99 | P | 28.7 | Very low | 31.1 | Very low | 120 Ų | 120 | 130.5 Ų | 130.5 | 78% | 0.779 | 73% | 0.732 | S | S | * | * | trans | -81.1 | 107.2 | 174.3 | 31 | -31.9 | 0 | 0 | 0 | 110.5 | ||||
| 100 | N | 28.9 | Very low | 31.3 | Very low | 162 Ų | 162 | 133.9 Ų | 133.9 | 87% | 0.866 | 74% | 0.742 | S | S | * | * | trans | -178.2 | 168.2 | 147.5 | -96.6 | -28.5 | 0 | 0 | 0 | 111 | K98 | K98-N100 PolarHBondContact O-N 2.85Š| ||
| 101 | E | 30.1 | Very low | 31.8 | Very low | 183 Ų | 183 | 135.4 Ų | 135.4 | 86% | 0.855 | 75% | 0.75 | S | S | * | * | trans | 63.1 | 93.7 | 174.6 | -58 | -166.7 | 151.7 | 0 | 0 | 117.3 | ||||
| 102 | L | 32.6 | Very low | 32 | Very low | 175 Ų | 175 | 134.8 Ų | 134.8 | 92% | 0.916 | 76% | 0.762 | S | S | * | * | trans | -150 | 107.2 | 131.9 | -119.8 | 166.3 | 0 | 0 | 0 | 110.2 | ||||
| 103 | I | 36.2 | Very low | 32.1 | Very low | 147 Ų | 147 | 136.3 Ų | 136.3 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | trans | -91 | 123.4 | -180 | -70.8 | 174.3 | 0 | 0 | 0 | 109.5 | ||||
| 104 | E | 27.2 | Very low | 32.4 | Very low | 182 Ų | 182 | 133.9 Ų | 133.9 | 85% | 0.85 | 79% | 0.785 | S | S | * | * | trans | 28.5 | 113.2 | 141.8 | -166.6 | 170.3 | -137.1 | 0 | 0 | 119.6 | ||||
| 105 | A | 32.7 | Very low | 32.4 | Very low | 96 Ų | 96 | 134.4 Ų | 134.4 | 79% | 0.793 | 79% | 0.793 | S | S | * | * | trans | -150.4 | 74.9 | 165.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 106 | Q | 33.3 | Very low | 32.7 | Very low | 197 Ų | 197 | 131.8 Ų | 131.8 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | trans | 53.3 | 140.2 | 145.6 | -62.7 | 178.8 | -20.9 | 0 | 0 | 122.5 | ||||
| 107 | A | 29.3 | Very low | 33.1 | Very low | 95 Ų | 95 | 134.1 Ų | 134.1 | 79% | 0.785 | 79% | 0.786 | S | S | * | * | trans | -99.4 | -152.2 | 172 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 108 | P | 36.4 | Very low | 33.5 | Very low | 114 Ų | 114 | 136.2 Ų | 136.2 | 74% | 0.74 | 79% | 0.791 | S | S | * | * | cis | -145.6 | -160.6 | 15.1 | 45.8 | -24.1 | 0 | 0 | 0 | 116.9 | ||||
| 109 | S | 33.1 | Very low | 33.8 | Very low | 111 Ų | 111 | 131.3 Ų | 131.3 | 78% | 0.776 | 79% | 0.787 | S | S | * | * | trans | 81.6 | 140.4 | 166 | 77.4 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 110 | E | 36.2 | Very low | 34 | Very low | 161 Ų | 161 | 131 Ų | 131 | 75% | 0.752 | 79% | 0.787 | S | S | * | * | cis | -144.1 | 159.3 | 22.9 | -75 | -169.3 | 127.1 | 0 | 0 | 115 | ||||
| 111 | N | 36.1 | Very low | 34.4 | Very low | 140 Ų | 140 | 129.5 Ų | 129.5 | 75% | 0.749 | 78% | 0.784 | S | S | * | * | trans | 39.3 | 143.7 | 136.9 | -55 | -29.2 | 0 | 0 | 0 | 122 | ||||
| 112 | A | 37.2 | Very low | 34.6 | Very low | 82 Ų | 82 | 125.2 Ų | 125.2 | 68% | 0.678 | 78% | 0.78 | S | S | * | * | cis | -164.2 | 135.5 | -1.6 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 113 | T | 32.9 | Very low | 34.5 | Very low | 137 Ų | 137 | 123.2 Ų | 123.2 | 84% | 0.84 | 78% | 0.775 | S | S | * | * | 85.4 | 135.6 | 94.7 | -55.1 | 0 | 0 | 0 | 0 | 117.2 | |||||
| 114 | A | 37.3 | Very low | 34.2 | Very low | 88 Ų | 88 | 121.7 Ų | 121.7 | 73% | 0.727 | 77% | 0.774 | S | S | * | * | trans | 74.2 | 150.2 | 168 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 115 | S | 32.7 | Very low | 34.3 | Very low | 95 Ų | 95 | 121 Ų | 121 | 66% | 0.664 | 78% | 0.776 | S | S | * | * | cis | 178.7 | 157.8 | -41.7 | 48.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 116 | N | 37.4 | Very low | 34.3 | Very low | 144 Ų | 144 | 123.2 Ų | 123.2 | 77% | 0.77 | 78% | 0.78 | S | S | * | * | trans | 96.5 | 125.1 | 172.1 | -52.9 | -28.5 | 0 | 0 | 0 | 115.3 | ||||
| 117 | T | 36.1 | Very low | 34.5 | Very low | 129 Ų | 129 | 118.7 Ų | 118.7 | 79% | 0.791 | 77% | 0.77 | S | S | * | * | cis | 81 | 120.4 | 47.3 | -58.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 118 | S | 37.5 | Very low | 35 | Very low | 108 Ų | 108 | 120.8 Ų | 120.8 | 76% | 0.755 | 78% | 0.775 | S | S | * | * | cis | -167 | 176.3 | 7.6 | 47.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 119 | A | 37 | Very low | 34.9 | Very low | 92 Ų | 92 | 118 Ų | 118 | 76% | 0.76 | 77% | 0.768 | S | S | * | * | trans | 78.3 | 116.1 | 166.1 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 120 | S | 34.2 | Very low | 34.7 | Very low | 113 Ų | 113 | 120.9 Ų | 120.9 | 79% | 0.79 | 77% | 0.773 | S | S | * | * | 84.5 | 126.1 | 82.5 | -152.7 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 121 | V | 35.7 | Very low | 34.5 | Very low | 130 Ų | 130 | 122.9 Ų | 122.9 | 79% | 0.788 | 78% | 0.78 | S | S | * | * | -155.7 | 155.6 | 50.8 | 163.6 | 0 | 0 | 0 | 0 | 112 | |||||
| 122 | A | 34.8 | Very low | 34.3 | Very low | 93 Ų | 93 | 122.1 Ų | 122.1 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | trans | 66.9 | 114.4 | 159.5 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 123 | T | 30.2 | Very low | 34.2 | Very low | 134 Ų | 134 | 129.1 Ų | 129.1 | 82% | 0.822 | 79% | 0.789 | S | S | * | * | trans | -77.4 | 158.9 | 148.6 | 32 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 124 | P | 31.6 | Very low | 34 | Very low | 114 Ų | 114 | 132 Ų | 132 | 74% | 0.74 | 79% | 0.79 | S | S | * | * | -145 | 155.3 | 55.4 | 40.4 | -20.6 | 0 | 0 | 0 | 119.9 | |||||
| 125 | L | 29.1 | Very low | 33.8 | Very low | 167 Ų | 167 | 134.5 Ų | 134.5 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | trans | 4.5 | 115.8 | 144.8 | -58.7 | 168.3 | 0 | 0 | 0 | 117.9 | ||||
| 126 | T | 32.8 | Very low | 33.9 | Very low | 143 Ų | 143 | 134.1 Ų | 134.1 | 88% | 0.877 | 80% | 0.798 | S | S | * | * | trans | -152.7 | 139.7 | 148.3 | -72.5 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 127 | S | 37.2 | Very low | 33.6 | Very low | 103 Ų | 103 | 131.7 Ų | 131.7 | 72% | 0.72 | 79% | 0.793 | S | S | * | * | trans | -83.4 | 151.6 | -174.6 | 40 | 0 | 0 | 0 | 0 | 113.5 | G129 | S127-G129 PolarHBondContact O-N 2.92Š| ||
| 128 | P | 39.7 | Very low | 33.6 | Very low | 138 Ų | 138 | 131 Ų | 131 | 90% | 0.896 | 79% | 0.793 | S | S | * | * | trans | -75.4 | 89.1 | -177.4 | 29.9 | -34.8 | 0 | 0 | 0 | 113.1 | ||||
| 129 | G | 34 | Very low | 33.6 | Very low | 56 Ų | 56 | 134.2 Ų | 134.2 | 58% | 0.577 | 79% | 0.793 | S | S | * | * | trans | 27.9 | 104 | 151 | 0 | 0 | 0 | 0 | 0 | 120.7 | S127 F131 | S127-G129 PolarHBondContact O-N 2.92Å; G129-F131 PolarHBondContact O-N 3.24Å; G129-F131 VanDerWaalsContact O-N 3.12Å | ||
| 130 | L | 29.5 | Very low | 33.7 | Very low | 171 Ų | 171 | 141.6 Ų | 141.6 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | trans | -60.8 | 104.4 | 155.7 | -87.1 | 156.8 | 0 | 0 | 0 | 111 | V132 | L130-V132 PolarHBondContact O-N 3.36Š| ||
| 131 | F | 31.9 | Very low | 34 | Very low | 204 Ų | 204 | 143.2 Ų | 143.2 | 90% | 0.895 | 80% | 0.8 | S | S | * | * | trans | -81 | 78.7 | 174.9 | -109 | -80.9 | 0 | 0 | 0 | 112.1 | G129 R133 | G129-F131 PolarHBondContact O-N 3.24Å; G129-F131 VanDerWaalsContact O-N 3.12Å; F131-R133 PolarHBondContact O-N 3.33Å | ||
| 132 | V | 31.9 | Very low | 34.2 | Very low | 124 Ų | 124 | 148.7 Ų | 148.7 | 75% | 0.752 | 81% | 0.807 | S | S | * | * | trans | -65 | 100.4 | 175.6 | -179.7 | 0 | 0 | 0 | 0 | 110.5 | L130 K134 | L130-V132 PolarHBondContact O-N 3.36Å; V132-K134 PolarHBondContact O-N 2.55Å | ||
| 133 | R | 33.8 | Very low | 34.3 | Very low | 228 Ų | 228 | 153.7 Ų | 153.7 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | -73.1 | 113.2 | 171.7 | -87.6 | -173.4 | 171.3 | -177.8 | -1.9 | 110.4 | F131 V135 | F131-R133 PolarHBondContact O-N 3.33Å; R133-V135 PolarHBondContact O-N 3.41Å; R133-V135 VanDerWaalsContact O-N 3.12Å | ||
| 134 | K | 30.1 | Very low | 34.8 | Very low | 199 Ų | 199 | 156.6 Ų | 156.6 | 87% | 0.865 | 81% | 0.812 | S | S | * | * | trans | -79.2 | 85.6 | -171.4 | -172.9 | 176.5 | -176.9 | 173.6 | 0 | 112.3 | V132 A136 | V132-K134 PolarHBondContact O-N 2.55Å; K134-A136 PolarHBondContact O-N 3.07Å | ||
| 135 | V | 33.4 | Very low | 35.2 | Very low | 140 Ų | 140 | 160.6 Ų | 160.6 | 85% | 0.848 | 82% | 0.818 | S | S | * | * | trans | -69.1 | 109.1 | 172.6 | -177.6 | 0 | 0 | 0 | 0 | 109.8 | R133 S137 | R133-V135 PolarHBondContact O-N 3.41Å; R133-V135 VanDerWaalsContact O-N 3.12Å; V135-S137 PolarHBondContact O-N 2.94Å | ||
| 136 | A | 33.6 | Very low | 35.3 | Very low | 87 Ų | 87 | 156.9 Ų | 156.9 | 72% | 0.719 | 81% | 0.811 | S | S | * | * | trans | -81 | 98.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | K134 S138 | K134-A136 PolarHBondContact O-N 3.07Å; A136-S138 PolarHBondContact O-N 3.04Å; A136-S138 VanDerWaalsContact O-N 3.11Å | ||
| 137 | S | 31.7 | Very low | 35.6 | Very low | 93 Ų | 93 | 155.6 Ų | 155.6 | 65% | 0.65 | 80% | 0.804 | S | S | * | * | trans | -65 | 108.5 | 171 | -176.7 | 0 | 0 | 0 | 0 | 111 | V135 F139 | V135-S137 PolarHBondContact O-N 2.94Å; S137-F139 PolarHBondContact O-N 3.19Å; S137-F139 VanDerWaalsContact O-N 3.1Å; S137-F139 WeakPolarHBondContact OG-CD2 3.49Å | ||
| 138 | S | 36.9 | Very low | 35.4 | Very low | 113 Ų | 113 | 157.4 Ų | 157.4 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | -87.1 | 69.1 | -176.2 | 52.5 | 0 | 0 | 0 | 0 | 112.5 | A136 R140 | A136-S138 PolarHBondContact O-N 3.04Å; A136-S138 VanDerWaalsContact O-N 3.11Å; S138-R140 PolarHBondContact O-N 2.87Å | ||
| 139 | F | 37.3 | Very low | 35.3 | Very low | 176 Ų | 176 | 158 Ų | 158 | 77% | 0.772 | 80% | 0.796 | S | S | * | * | trans | -57.1 | 103.4 | 172.3 | -90.4 | -87.9 | 0 | 0 | 0 | 111.9 | S137 I141 | S137-F139 PolarHBondContact O-N 3.19Å; S137-F139 VanDerWaalsContact O-N 3.1Å; S137-F139 WeakPolarHBondContact OG-CD2 3.49Å; F139-I141 VanDerWaalsContact C-N 3.28Å; F139-I141 PolarHBondContact O-N 3.38Å | ||
| 140 | R | 39 | Very low | 35.5 | Very low | 247 Ų | 247 | 159 Ų | 159 | 93% | 0.932 | 79% | 0.794 | S | S | * | * | trans | -74.5 | 76.9 | 171.5 | -96.5 | -177.1 | 165.6 | 156 | -4.1 | 111.5 | S138 R142 | S138-R140 PolarHBondContact O-N 2.87Å; R140-R142 PolarHBondContact O-N 2.84Å | ||
| 141 | I | 39.2 | Very low | 35.9 | Very low | 147 Ų | 147 | 159.6 Ų | 159.6 | 75% | 0.754 | 79% | 0.789 | S | S | * | * | trans | -65.2 | 123.9 | 168 | -62 | 174.9 | 0 | 0 | 0 | 109 | F139 K143 | F139-I141 VanDerWaalsContact C-N 3.28Å; F139-I141 PolarHBondContact O-N 3.38Å; I141-K143 PolarHBondContact O-N 3.15Å | ||
| 142 | R | 40.1 | Very low | 36.2 | Very low | 246 Ų | 246 | 155 Ų | 155 | 93% | 0.928 | 78% | 0.783 | S | S | * | * | trans | -71 | 94.5 | 174.7 | -75.2 | -179.2 | 174.1 | 164.3 | -2.3 | 110.5 | R140 K144 | R140-R142 PolarHBondContact O-N 2.84Å; R142-K144 PolarHBondContact O-N 2.89Å | ||
| 143 | K | 37.4 | Very low | 36.5 | Very low | 197 Ų | 197 | 157 Ų | 157 | 86% | 0.857 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -72.5 | 116.4 | 173.5 | -168.7 | 171.6 | -177 | 177.2 | 0 | 110.4 | I141 | I141-K143 PolarHBondContact O-N 3.15Š|
| 144 | K | 40.8 | Very low | 36.5 | Very low | 196 Ų | 196 | 151.3 Ų | 151.3 | 85% | 0.852 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -62 | 142.6 | 168.1 | -96.7 | -176.2 | 172.5 | -178.7 | 0 | 109.9 | R142 | R142-K144 PolarHBondContact O-N 2.89Š|
| 145 | K | 39.3 | Very low | 36.8 | Very low | 197 Ų | 197 | 151.6 Ų | 151.6 | 86% | 0.857 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 147.5 | 170.9 | -173.7 | 175 | 177.5 | -179.2 | 0 | 109.8 | ||
| 146 | A | 31.9 | Very low | 36.6 | Very low | 90 Ų | 90 | 149.9 Ų | 149.9 | 74% | 0.744 | 78% | 0.779 | S | S | * | * | trans | -128.3 | 137.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 147 | T | 38.2 | Very low | 36.9 | Very low | 116 Ų | 116 | 151 Ų | 151 | 71% | 0.712 | 78% | 0.779 | S | S | * | * | trans | 177.6 | 134.7 | 171.8 | 30.6 | 0 | 0 | 0 | 0 | 103.9 | ||||
| 148 | D | 33.8 | Very low | 37 | Very low | 141 Ų | 141 | 152 Ų | 152 | 75% | 0.754 | 78% | 0.781 | S | S | * | * | cis | -158.7 | -171.9 | 2.2 | -141.6 | -37.1 | 0 | 0 | 0 | 110.8 | ||||
| 149 | E | 37.9 | Very low | 36.9 | Very low | 151 Ų | 151 | 153.4 Ų | 153.4 | 71% | 0.706 | 78% | 0.779 | S | S | * | * | trans | 73.3 | 105.9 | 159 | -75.1 | -65.1 | 138.7 | 0 | 0 | 121.4 | ||||
| 150 | S | 37 | Very low | 36.9 | Very low | 75 Ų | 75 | 154.1 Ų | 154.1 | 52% | 0.524 | 78% | 0.784 | S | S | . | * | 69.9 | 111.7 | 123.8 | -76.6 | 0 | 0 | 0 | 0 | 124.8 | |||||
| 151 | K | 38.2 | Very low | 36.5 | Very low | 184 Ų | 184 | 148.7 Ų | 148.7 | 80% | 0.8 | 77% | 0.774 | S | S | * | * | 84.3 | 118.2 | 130 | -63.8 | 167.6 | -174.8 | 164.7 | 0 | 121.8 | |||||
| 152 | S | 39.2 | Very low | 36.3 | Very low | 109 Ų | 109 | 151.9 Ų | 151.9 | 76% | 0.762 | 78% | 0.782 | S | S | * | * | trans | 62.5 | 144.5 | 143.2 | 56.9 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 153 | L | 37.7 | Very low | 35.8 | Very low | 166 Ų | 166 | 145.6 Ų | 145.6 | 87% | 0.869 | 77% | 0.771 | S | S | * | * | cis | -153.1 | 164.1 | -14.6 | -135.2 | 75.2 | 0 | 0 | 0 | 106.4 | ||||
| 154 | P | 33 | Very low | 35.4 | Very low | 107 Ų | 107 | 146.1 Ų | 146.1 | 70% | 0.695 | 77% | 0.774 | S | S | * | * | trans | -100.8 | 159.7 | -169.4 | 38.3 | -32.7 | 0 | 0 | 0 | 114.6 | ||||
| 155 | Q | 37 | Very low | 34.9 | Very low | 205 Ų | 205 | 141.7 Ų | 141.7 | 96% | 0.958 | 76% | 0.763 | S | S | * | * | trans | -168.3 | 154.9 | 141.1 | -107.4 | 157.2 | 38.2 | 0 | 0 | 113.2 | ||||
| 156 | S | 29.5 | Very low | 34.5 | Very low | 105 Ų | 105 | 139.7 Ų | 139.7 | 73% | 0.734 | 76% | 0.761 | S | S | * | * | trans | -134.5 | -179.6 | 168.9 | 63.1 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 157 | P | 39.7 | Very low | 34.7 | Very low | 109 Ų | 109 | 140.9 Ų | 140.9 | 71% | 0.708 | 76% | 0.761 | S | S | * | * | cis | -128.7 | -158.5 | -4.3 | 41.2 | -23.1 | 0 | 0 | 0 | 112.1 | ||||
| 158 | T | 34.6 | Very low | 34.2 | Very low | 114 Ų | 114 | 143.7 Ų | 143.7 | 70% | 0.699 | 77% | 0.771 | S | S | * | * | 150.6 | 116.2 | 127.4 | -58.6 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 159 | I | 34.2 | Very low | 34.1 | Very low | 144 Ų | 144 | 144.6 Ų | 144.6 | 74% | 0.738 | 78% | 0.775 | S | S | * | * | trans | 12.9 | 129.7 | 139.9 | -38.3 | 170.3 | 0 | 0 | 0 | 119.6 | ||||
| 160 | E | 37.3 | Very low | 33.8 | Very low | 190 Ų | 190 | 147.9 Ų | 147.9 | 89% | 0.888 | 78% | 0.781 | S | S | * | * | -179.2 | 157.6 | 115.8 | -99.1 | -173.3 | -156.5 | 0 | 0 | 114.3 | |||||
| 161 | D | 29.6 | Very low | 33.7 | Very low | 134 Ų | 134 | 150.5 Ų | 150.5 | 72% | 0.717 | 80% | 0.795 | S | S | * | * | trans | -85 | 151.5 | -164.3 | -65.7 | -72.8 | 0 | 0 | 0 | 116.3 | ||||
| 162 | K | 35.6 | Very low | 33.7 | Very low | 213 Ų | 213 | 147.5 Ų | 147.5 | 93% | 0.926 | 79% | 0.794 | S | S | * | * | trans | -156.8 | 122.1 | 136.7 | -107 | 130.3 | -163.5 | 157.2 | 0 | 113.2 | ||||
| 163 | V | 28.9 | Very low | 33.7 | Very low | 115 Ų | 115 | 148 Ų | 148 | 70% | 0.697 | 80% | 0.795 | S | S | * | * | trans | -93.4 | 146.2 | 175.4 | 166.6 | 0 | 0 | 0 | 0 | 110.1 | V165 | V163-V165 HydrophobicContact CG1-CG2 3.43Å; V163-V165 VanDerWaalsContact CG1-CG2 3.43Å | ||
| 164 | F | 30.9 | Very low | 33.6 | Very low | 208 Ų | 208 | 148.7 Ų | 148.7 | 91% | 0.912 | 79% | 0.793 | S | S | * | * | trans | -142.3 | 134.4 | 165.3 | -145.1 | -89.8 | 0 | 0 | 0 | 110.3 | ||||
| 165 | V | 29.9 | Very low | 33.4 | Very low | 102 Ų | 102 | 149.5 Ų | 149.5 | 62% | 0.618 | 79% | 0.788 | S | S | * | * | trans | -151.3 | 163.7 | -168.8 | -157.9 | 0 | 0 | 0 | 0 | 110.6 | V163 | V163-V165 HydrophobicContact CG1-CG2 3.43Å; V163-V165 VanDerWaalsContact CG1-CG2 3.43Å | ||
| 166 | L | 31.4 | Very low | 33.5 | Very low | 155 Ų | 155 | 149 Ų | 149 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | 81.2 | 160.3 | 163.7 | -55.9 | 177 | 0 | 0 | 0 | 117.3 | ||||
| 167 | P | 34.2 | Very low | 33.5 | Very low | 115 Ų | 115 | 153.6 Ų | 153.6 | 75% | 0.747 | 78% | 0.784 | S | S | * | * | cis | -126.9 | 162.6 | -11.6 | 16.9 | 6.6 | 0 | 0 | 0 | 115.3 | ||||
| 168 | L | 28.6 | Very low | 33.4 | Very low | 175 Ų | 175 | 156.9 Ų | 156.9 | 92% | 0.916 | 79% | 0.794 | S | S | * | * | trans | -89.4 | 146 | 148.2 | -93.9 | 80.8 | 0 | 0 | 0 | 109.4 | ||||
| 169 | N | 32.5 | Very low | 33.5 | Very low | 160 Ų | 160 | 156.8 Ų | 156.8 | 86% | 0.856 | 80% | 0.798 | S | S | * | * | trans | -152.9 | 172.4 | 145.8 | -146.5 | -10.5 | 0 | 0 | 0 | 112.8 | ||||
| 170 | R | 30.4 | Very low | 33.7 | Very low | 220 Ų | 220 | 152.8 Ų | 152.8 | 83% | 0.83 | 79% | 0.793 | S | S | * | * | trans | -110 | 165.8 | -162.7 | -61.3 | 166 | 167.5 | 163 | -6.8 | 114.4 | ||||
| 171 | T | 36 | Very low | 33.6 | Very low | 131 Ų | 131 | 151.9 Ų | 151.9 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | 125.7 | 126.3 | 135.6 | 66.9 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 172 | P | 36.6 | Very low | 34 | Very low | 121 Ų | 121 | 153.2 Ų | 153.2 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | trans | -108.4 | -163.3 | 165.3 | 45 | -35.2 | 0 | 0 | 0 | 110.6 | ||||
| 173 | P | 41 | Very low | 34.2 | Very low | 120 Ų | 120 | 149.6 Ų | 149.6 | 78% | 0.779 | 80% | 0.795 | S | S | * | * | cis | -123.6 | 180 | -24.4 | 40.1 | -26.5 | 0 | 0 | 0 | 112.9 | ||||
| 174 | E | 34.5 | Very low | 34.5 | Very low | 179 Ų | 179 | 149.1 Ų | 149.1 | 84% | 0.836 | 80% | 0.803 | S | S | * | * | trans | -160.9 | 171.2 | 134.3 | -132.6 | -166.8 | -151.7 | 0 | 0 | 113.1 | ||||
| 175 | E | 30 | Very low | 34.7 | Very low | 124 Ų | 124 | 143.2 Ų | 143.2 | 58% | 0.579 | 79% | 0.793 | S | S | * | * | trans | -128.9 | 123.1 | -163.2 | -179.3 | -147.2 | 151.1 | 0 | 0 | 112.1 | R177 | E175-R177 IonicContact OE1-CZ 3.99Å; E175-R177 IonicContact OE1-NE 3.33Å; E175-R177 IonicContact OE1-NH1 3.8Å; E175-R177 PolarHBondContact OE1-NH1 3.28Å; E175-R177 IonicContact OE1-NH2 3.01Å | ||
| 176 | K | 38.5 | Very low | 34.8 | Very low | 195 Ų | 195 | 146.4 Ų | 146.4 | 85% | 0.848 | 81% | 0.807 | S | S | * | * | trans | -137.1 | 126.8 | 162.7 | -67.6 | -170.1 | 179 | 168.5 | 0 | 113.1 | ||||
| 177 | R | 30.1 | Very low | 35 | Very low | 202 Ų | 202 | 143.5 Ų | 143.5 | 76% | 0.762 | 81% | 0.805 | S | S | * | * | trans | -80.9 | 149.9 | -176.2 | -61.5 | 167.9 | 163.1 | 84.4 | -4.3 | 112.6 | E175 | E175-R177 IonicContact OE1-CZ 3.99Å; E175-R177 IonicContact OE1-NE 3.33Å; E175-R177 IonicContact OE1-NH1 3.8Å; E175-R177 PolarHBondContact OE1-NH1 3.28Å; E175-R177 IonicContact OE1-NH2 3.01Å | ||
| 178 | L | 37.2 | Very low | 35.1 | Very low | 178 Ų | 178 | 146.1 Ų | 146.1 | 93% | 0.932 | 81% | 0.812 | S | S | * | * | trans | 176.7 | 153.2 | 143.9 | -91.7 | 141 | 0 | 0 | 0 | 108 | ||||
| 179 | S | 35.7 | Very low | 35.5 | Very low | 111 Ų | 111 | 144.6 Ų | 144.6 | 78% | 0.776 | 81% | 0.81 | S | S | * | * | cis | -173.4 | 138.2 | -37.7 | 177.3 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 180 | G | 38.6 | Very low | 35.4 | Very low | 61 Ų | 61 | 142.2 Ų | 142.2 | 63% | 0.629 | 81% | 0.806 | S | S | * | * | trans | 82.7 | 149.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 181 | D | 35.3 | Very low | 35.7 | Very low | 171 Ų | 171 | 136.1 Ų | 136.1 | 91% | 0.914 | 80% | 0.802 | S | S | * | * | cis | -138.1 | 157.9 | -2.6 | -88.6 | -37.7 | 0 | 0 | 0 | 113.1 | ||||
| 182 | I | 38.9 | Very low | 35.7 | Very low | 162 Ų | 162 | 136.7 Ų | 136.7 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | trans | -92 | 124.2 | -179.2 | -60.6 | 158.8 | 0 | 0 | 0 | 108.8 | ||||
| 183 | T | 39.1 | Very low | 35.6 | Very low | 137 Ų | 137 | 136.8 Ų | 136.8 | 84% | 0.84 | 80% | 0.804 | S | S | * | * | trans | 167.8 | 103.4 | 141.9 | -75.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 184 | A | 35.4 | Very low | 35.2 | Very low | 104 Ų | 104 | 139.9 Ų | 139.9 | 86% | 0.86 | 81% | 0.81 | S | S | * | * | trans | 179.4 | 52.2 | 156.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 185 | A | 34 | Very low | 35.4 | Very low | 85 Ų | 85 | 139.9 Ų | 139.9 | 70% | 0.702 | 82% | 0.815 | S | S | * | * | trans | -80.6 | 149.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 186 | N | 32.8 | Very low | 35.4 | Very low | 168 Ų | 168 | 142 Ų | 142 | 90% | 0.898 | 83% | 0.827 | S | S | * | * | S | Bend | trans | 61 | 64.3 | 160.8 | -55.6 | -20.2 | 0 | 0 | 0 | 117.6 | ||
| 187 | A | 36.1 | Very low | 35.2 | Very low | 94 Ų | 94 | 137.9 Ų | 137.9 | 78% | 0.777 | 82% | 0.823 | S | S | * | * | trans | -146.2 | 63.2 | 171.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 188 | L | 36.7 | Very low | 35.5 | Very low | 170 Ų | 170 | 134.3 Ų | 134.3 | 89% | 0.89 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -160.9 | 37.7 | 159.7 | -115.9 | 170.1 | 0 | 0 | 0 | 114.4 | ||
| 189 | V | 35.4 | Very low | 35.5 | Very low | 144 Ų | 144 | 136.5 Ų | 136.5 | 87% | 0.873 | 82% | 0.82 | S | S | * | * | S | Bend | trans | -123.4 | 139.5 | 168 | 176.4 | 0 | 0 | 0 | 0 | 108 | ||
| 190 | S | 31.9 | Very low | 35.5 | Very low | 110 Ų | 110 | 139.6 Ų | 139.6 | 77% | 0.769 | 83% | 0.826 | S | S | * | * | trans | 68.7 | 84.6 | -178.5 | -161.8 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 191 | A | 35.5 | Very low | 35.4 | Very low | 91 Ų | 91 | 144.3 Ų | 144.3 | 75% | 0.752 | 84% | 0.836 | S | S | * | * | trans | -149.5 | 31 | 172.9 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 192 | T | 36.2 | Very low | 35.4 | Very low | 144 Ų | 144 | 141.7 Ų | 141.7 | 88% | 0.883 | 83% | 0.829 | S | S | * | * | trans | -161 | 73.1 | 164.8 | -0.9 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 193 | T | 34.3 | Very low | 35.1 | Very low | 122 Ų | 122 | 139.1 Ų | 139.1 | 75% | 0.748 | 83% | 0.825 | S | S | * | * | trans | -138.5 | 66.6 | 172.6 | -50 | 0 | 0 | 0 | 0 | 111 | ||||
| 194 | M | 33.9 | Very low | 34.7 | Very low | 185 Ų | 185 | 137.8 Ų | 137.8 | 91% | 0.911 | 82% | 0.821 | S | S | * | * | trans | -150.7 | 71.2 | 168.9 | -85.5 | -142.1 | 167.7 | 0 | 0 | 113.1 | ||||
| 195 | L | 37.5 | Very low | 34.5 | Very low | 180 Ų | 180 | 144 Ų | 144 | 94% | 0.942 | 82% | 0.824 | S | S | * | * | trans | -143.9 | 74.5 | 146.1 | -84.6 | -172.1 | 0 | 0 | 0 | 108.8 | ||||
| 196 | M | 31.1 | Very low | 34.4 | Very low | 168 Ų | 168 | 145.6 Ų | 145.6 | 83% | 0.828 | 83% | 0.825 | S | S | * | * | trans | -91.9 | 157.3 | 166.9 | -87.9 | -74.3 | -179.9 | 0 | 0 | 110.1 | ||||
| 197 | S | 33.5 | Very low | 34.3 | Very low | 109 Ų | 109 | 145.2 Ų | 145.2 | 76% | 0.762 | 82% | 0.818 | S | S | * | * | trans | 66.2 | 108.7 | 172.2 | -54.9 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 198 | T | 37.4 | Very low | 34.2 | Very low | 126 Ų | 126 | 146.7 Ų | 146.7 | 77% | 0.773 | 82% | 0.822 | S | S | * | * | cis | -166.3 | 177.7 | 50 | 46.8 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 199 | R | 36.2 | Very low | 33.9 | Very low | 225 Ų | 225 | 150.8 Ų | 150.8 | 85% | 0.849 | 83% | 0.826 | S | S | * | * | trans | 83.9 | 68.6 | 166.9 | -52.7 | -172.6 | -176.7 | -147.6 | -1.1 | 118.5 | ||||
| 200 | L | 35.9 | Very low | 33.7 | Very low | 176 Ų | 176 | 150 Ų | 150 | 92% | 0.921 | 83% | 0.827 | S | S | * | * | 48.3 | 128.3 | 118.1 | -58 | 171.3 | 0 | 0 | 0 | 120.9 | |||||
| 201 | L | 36.5 | Very low | 33.7 | Very low | 159 Ų | 159 | 148.9 Ų | 148.9 | 83% | 0.832 | 82% | 0.824 | S | S | * | * | trans | -69.4 | 160.6 | 164.2 | -54.4 | 167.3 | 0 | 0 | 0 | 111.4 | ||||
| 202 | P | 35.5 | Very low | 33.7 | Very low | 117 Ų | 117 | 154 Ų | 154 | 76% | 0.76 | 83% | 0.83 | S | S | * | * | -136.9 | 164.5 | 75.6 | 29.5 | -9.8 | 0 | 0 | 0 | 113.6 | |||||
| 203 | S | 31.4 | Very low | 33.6 | Very low | 108 Ų | 108 | 152 Ų | 152 | 76% | 0.755 | 82% | 0.821 | S | S | * | * | cis | 74.8 | 64.5 | 13.5 | -165.2 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 204 | S | 32.2 | Very low | 33.8 | Very low | 109 Ų | 109 | 151.4 Ų | 151.4 | 76% | 0.762 | 82% | 0.822 | S | S | * | * | trans | -179.3 | 136.2 | 144.1 | 52.9 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 205 | Y | 30.6 | Very low | 34 | Very low | 235 Ų | 235 | 149.2 Ų | 149.2 | 92% | 0.922 | 82% | 0.819 | S | S | * | * | trans | -144.3 | 65.7 | 157.8 | -156.9 | -89.6 | 0 | 0 | 0 | 111 | ||||
| 206 | V | 32.6 | Very low | 34 | Very low | 117 Ų | 117 | 145 Ų | 145 | 71% | 0.709 | 81% | 0.81 | S | S | * | * | trans | -137.3 | 123.7 | 176 | 178.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 207 | Q | 29.8 | Very low | 34.3 | Very low | 161 Ų | 161 | 143.9 Ų | 143.9 | 75% | 0.752 | 80% | 0.802 | S | S | * | * | trans | 41.6 | 118.1 | 156.8 | -60.3 | 168.3 | -3.4 | 0 | 0 | 120 | ||||
| 208 | S | 33.4 | Very low | 34.4 | Very low | 124 Ų | 124 | 146.9 Ų | 146.9 | 87% | 0.867 | 80% | 0.802 | S | S | * | * | trans | -152 | 107.4 | 140.5 | 46.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 209 | R | 30.3 | Very low | 34.2 | Very low | 256 Ų | 256 | 144.9 Ų | 144.9 | 97% | 0.966 | 81% | 0.806 | S | S | * | * | trans | -120.8 | 104.4 | 160.6 | -90.8 | -171.9 | 171.4 | -167.2 | -0.1 | 108.1 | ||||
| 210 | S | 32.9 | Very low | 34.2 | Very low | 128 Ų | 128 | 137.6 Ų | 137.6 | 90% | 0.895 | 80% | 0.801 | S | S | * | * | trans | -174.9 | 149.5 | 143.8 | -159.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 211 | A | 31.1 | Very low | 34.4 | Very low | 87 Ų | 87 | 138.2 Ų | 138.2 | 72% | 0.719 | 80% | 0.797 | S | S | * | * | trans | -59.5 | 156.7 | -171.1 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 212 | K | 35.6 | Very low | 34.5 | Very low | 199 Ų | 199 | 136.3 Ų | 136.3 | 87% | 0.865 | 78% | 0.783 | S | S | * | * | -162.2 | 117.7 | 123.9 | -108.6 | 164.8 | -173.9 | 177.2 | 0 | 115 | |||||
| 213 | S | 32.9 | Very low | 34.6 | Very low | 100 Ų | 100 | 138.4 Ų | 138.4 | 70% | 0.699 | 78% | 0.781 | S | S | * | * | trans | 34.6 | 123.6 | 138.3 | 59.3 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 214 | S | 39 | Very low | 35 | Very low | 110 Ų | 110 | 143.8 Ų | 143.8 | 77% | 0.769 | 78% | 0.784 | S | S | * | * | -174 | 126.8 | 104.7 | 47.9 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 215 | V | 38 | Very low | 35.2 | Very low | 139 Ų | 139 | 144.6 Ų | 144.6 | 84% | 0.842 | 79% | 0.79 | S | S | * | * | trans | 62.6 | 139 | 136.5 | -179.7 | 0 | 0 | 0 | 0 | 122 | ||||
| 216 | A | 37.2 | Very low | 35.5 | Very low | 91 Ų | 91 | 136.2 Ų | 136.2 | 75% | 0.752 | 78% | 0.775 | S | S | * | * | trans | 70.3 | 141.7 | 161.4 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 217 | E | 38.1 | Very low | 35.8 | Very low | 145 Ų | 145 | 139 Ų | 139 | 68% | 0.678 | 78% | 0.777 | S | S | * | * | cis | -163.6 | 154.6 | -27.3 | -140.8 | -151.9 | 142.5 | 0 | 0 | 110.2 | ||||
| 218 | K | 36.8 | Very low | 36.1 | Very low | 172 Ų | 172 | 138.2 Ų | 138.2 | 75% | 0.748 | 77% | 0.774 | S | S | * | * | trans | 55 | 129.6 | 166.1 | -58 | 173.9 | 171.9 | 80.3 | 0 | 117.8 | ||||
| 219 | G | 33.2 | Very low | 36.4 | Very low | 84 Ų | 84 | 139.6 Ų | 139.6 | 87% | 0.866 | 77% | 0.77 | S | S | * | * | cis | 156.6 | 152.9 | -7.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 220 | G | 35.3 | Very low | 36.8 | Very low | 72 Ų | 72 | 134.4 Ų | 134.4 | 74% | 0.742 | 76% | 0.761 | S | S | * | * | trans | 135.1 | 111.2 | 162.7 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 221 | K | 39.2 | Very low | 36.8 | Very low | 190 Ų | 190 | 135.1 Ų | 135.1 | 83% | 0.826 | 76% | 0.76 | S | S | * | * | trans | 52 | 142.2 | 140.8 | -60.9 | 178.6 | 168.7 | -169 | 0 | 120.2 | ||||
| 222 | E | 39.2 | Very low | 37 | Very low | 119 Ų | 119 | 134.6 Ų | 134.6 | 56% | 0.556 | 76% | 0.764 | S | S | * | * | cis | -165.2 | 146.9 | -0.1 | -118.7 | 175 | 85.5 | 0 | 0 | 110.9 | ||||
| 223 | K | 38.6 | Very low | 36.9 | Very low | 161 Ų | 161 | 137.2 Ų | 137.2 | 70% | 0.7 | 77% | 0.768 | S | S | * | * | trans | 53.2 | 149.9 | 146.8 | -65.6 | 168.1 | -173.6 | 159.3 | 0 | 119.7 | ||||
| 224 | R | 38.7 | Very low | 37 | Very low | 220 Ų | 220 | 142.2 Ų | 142.2 | 83% | 0.83 | 78% | 0.777 | S | S | * | * | cis | -166.8 | 146.9 | 2.7 | -126.1 | 172.8 | 176.3 | 173.1 | -4.1 | 110.3 | ||||
| 225 | S | 36.9 | Very low | 37 | Very low | 127 Ų | 127 | 145.7 Ų | 145.7 | 89% | 0.888 | 79% | 0.786 | S | S | * | * | trans | 64.1 | 146.3 | 157.9 | -153 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 226 | G | 35.8 | Very low | 36.9 | Very low | 58 Ų | 58 | 143 Ų | 143 | 60% | 0.598 | 78% | 0.778 | S | S | * | * | cis | 153.1 | 139.6 | -12.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 227 | K | 39.7 | Very low | 36.8 | Very low | 175 Ų | 175 | 145.6 Ų | 145.6 | 76% | 0.761 | 78% | 0.78 | S | S | * | * | trans | 66.2 | 152.6 | -178.1 | -62 | 176.5 | 152 | -77.3 | 0 | 114.6 | ||||
| 228 | E | 36.8 | Very low | 36.8 | Very low | 145 Ų | 145 | 147.6 Ų | 147.6 | 68% | 0.678 | 79% | 0.789 | S | S | * | * | cis | -162.1 | 176.5 | -17.8 | -110.3 | 149.7 | -169.3 | 0 | 0 | 106.7 | ||||
| 229 | L | 39.5 | Very low | 36.8 | Very low | 153 Ų | 153 | 145.9 Ų | 145.9 | 80% | 0.801 | 79% | 0.793 | S | S | * | * | cis | -136.7 | -114.9 | 10.8 | -147.2 | 175 | 0 | 0 | 0 | 110.9 | ||||
| 230 | L | 38 | Very low | 37 | Very low | 147 Ų | 147 | 146.6 Ų | 146.6 | 77% | 0.77 | 79% | 0.785 | S | S | * | * | trans | -155.7 | 177.3 | -175.4 | -130 | 80.9 | 0 | 0 | 0 | 112.9 | ||||
| 231 | T | 33.8 | Very low | 36.9 | Very low | 143 Ų | 143 | 150.8 Ų | 150.8 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | trans | 83.8 | 144.2 | 173.1 | 75.1 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 232 | G | 34.6 | Very low | 36.6 | Very low | 77 Ų | 77 | 147.2 Ų | 147.2 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | cis | -158.1 | 149 | -3.7 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 233 | R | 32.5 | Very low | 36.5 | Very low | 253 Ų | 253 | 150.8 Ų | 150.8 | 96% | 0.955 | 81% | 0.808 | S | S | * | * | trans | -143.8 | 84.6 | -176.5 | -165.2 | -177.4 | -165 | -176.5 | 5.8 | 111.6 | ||||
| 234 | K | 36.8 | Very low | 36.6 | Very low | 205 Ų | 205 | 150.9 Ų | 150.9 | 89% | 0.891 | 82% | 0.815 | S | S | * | * | trans | -160.6 | 124.1 | 172.6 | -97.1 | 178.4 | -179.4 | 178.3 | 0 | 109 | ||||
| 235 | L | 39.1 | Very low | 36.3 | Very low | 183 Ų | 183 | 149.8 Ų | 149.8 | 96% | 0.958 | 82% | 0.817 | S | S | * | * | trans | 177.2 | 127.7 | 137.1 | -99.7 | 166.6 | 0 | 0 | 0 | 109 | ||||
| 236 | A | 35.1 | Very low | 36.2 | Very low | 82 Ų | 82 | 149.4 Ų | 149.4 | 68% | 0.678 | 81% | 0.814 | S | S | * | * | trans | -151.2 | 148.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 237 | N | 34.9 | Very low | 36.4 | Very low | 147 Ų | 147 | 151.7 Ų | 151.7 | 79% | 0.786 | 82% | 0.82 | S | S | * | * | trans | 58.9 | 91.8 | 167.1 | -54.7 | -1.1 | 0 | 0 | 0 | 117.6 | ||||
| 238 | Q | 38 | Very low | 36.5 | Very low | 186 Ų | 186 | 151 Ų | 151 | 87% | 0.869 | 83% | 0.825 | S | S | * | * | trans | -174.5 | 175.7 | 139.4 | -106.6 | 152.9 | 104 | 0 | 0 | 111.7 | ||||
| 239 | V | 37.7 | Very low | 36.1 | Very low | 136 Ų | 136 | 149.1 Ų | 149.1 | 82% | 0.824 | 83% | 0.827 | S | S | * | * | trans | 73.3 | 81.9 | -166.7 | -167.3 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 240 | S | 37.4 | Very low | 36 | Very low | 99 Ų | 99 | 151.3 Ų | 151.3 | 69% | 0.692 | 83% | 0.83 | S | S | * | * | cis | 83.3 | 128.6 | 40.3 | -45.6 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 241 | D | 31.7 | Very low | 35.8 | Very low | 161 Ų | 161 | 153.5 Ų | 153.5 | 86% | 0.861 | 83% | 0.833 | S | S | * | * | trans | -65.4 | 139.7 | 179.8 | -49.9 | -99.9 | 0 | 0 | 0 | 113.3 | ||||
| 242 | S | 32.8 | Very low | 35.8 | Very low | 115 Ų | 115 | 154 Ų | 154 | 80% | 0.804 | 83% | 0.826 | S | S | * | * | trans | 172.2 | 110.6 | 139.5 | 37.6 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 243 | M | 38.2 | Very low | 35.8 | Very low | 193 Ų | 193 | 155.9 Ų | 155.9 | 95% | 0.951 | 82% | 0.821 | S | S | * | * | trans | -164.5 | 107.9 | 141.6 | -116.3 | -175.8 | 179.5 | 0 | 0 | 112.1 | ||||
| 244 | L | 40.4 | Very low | 36 | Very low | 163 Ų | 163 | 149.1 Ų | 149.1 | 85% | 0.853 | 81% | 0.808 | S | S | * | * | trans | -143.1 | 139.6 | 169.4 | -82.8 | 175.7 | 0 | 0 | 0 | 109.5 | ||||
| 245 | K | 31.8 | Very low | 35.9 | Very low | 198 Ų | 198 | 144.6 Ų | 144.6 | 86% | 0.861 | 80% | 0.802 | S | S | * | * | trans | 69 | 87.8 | 162.3 | -59.1 | 170.2 | -178 | 176.3 | 0 | 119.1 | ||||
| 246 | S | 35.6 | Very low | 35.9 | Very low | 118 Ų | 118 | 140.4 Ų | 140.4 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | -170 | 146 | 138.4 | 52.5 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 247 | S | 40.4 | Very low | 36 | Very low | 106 Ų | 106 | 142.1 Ų | 142.1 | 74% | 0.741 | 80% | 0.795 | S | S | * | * | cis | -139.7 | 140.5 | 11.2 | -66.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 248 | L | 41.3 | Very low | 36 | Very low | 162 Ų | 162 | 139.8 Ų | 139.8 | 85% | 0.848 | 79% | 0.79 | S | S | * | * | 65.7 | 73.5 | 75.5 | -84 | 164.7 | 0 | 0 | 0 | 117.2 | |||||
| 249 | S | 28.8 | Very low | 36.1 | Very low | 104 Ų | 104 | 137.3 Ų | 137.3 | 73% | 0.727 | 78% | 0.782 | S | S | * | * | 63.4 | 123.4 | 126.7 | -54.3 | 0 | 0 | 0 | 0 | 123.3 | |||||
| 250 | K | 37.4 | Very low | 36 | Very low | 200 Ų | 200 | 138.9 Ų | 138.9 | 87% | 0.87 | 78% | 0.78 | S | S | * | * | trans | -163.5 | 125.4 | 137.7 | -106.8 | 155.6 | -173 | 173.4 | 0 | 113.3 | ||||
| 251 | K | 33.1 | Very low | 36 | Very low | 192 Ų | 192 | 138.8 Ų | 138.8 | 84% | 0.835 | 78% | 0.78 | S | S | * | * | trans | 22.4 | 143.9 | 142 | -49.4 | -177.9 | -180 | -174.1 | 0 | 119 | ||||
| 252 | H | 34.4 | Very low | 36.1 | Very low | 154 Ų | 154 | 141 Ų | 141 | 71% | 0.713 | 78% | 0.781 | S | S | * | * | cis | -164.8 | 129.1 | 40.7 | -157.3 | -93.5 | 0 | 0 | 0 | 111.5 | ||||
| 253 | V | 33.7 | Very low | 36.1 | Very low | 116 Ų | 116 | 140.5 Ų | 140.5 | 70% | 0.703 | 78% | 0.778 | S | S | * | * | 34.2 | 128.9 | 107.8 | -131.7 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 254 | V | 37.7 | Very low | 35.9 | Very low | 111 Ų | 111 | 138.8 Ų | 138.8 | 67% | 0.673 | 77% | 0.772 | S | S | * | * | -168 | 138.6 | 58.2 | 172.4 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 255 | S | 35.2 | Very low | 35.3 | Very low | 111 Ų | 111 | 135.2 Ų | 135.2 | 78% | 0.776 | 77% | 0.766 | S | S | * | * | trans | 47.3 | 161.3 | 149.9 | -61.3 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 256 | S | 37.6 | Very low | 35.1 | Very low | 95 Ų | 95 | 131.4 Ų | 131.4 | 66% | 0.664 | 76% | 0.764 | S | S | * | * | cis | -175 | 155.6 | -17.1 | 50.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 257 | S | 37.2 | Very low | 34.7 | Very low | 117 Ų | 117 | 135.3 Ų | 135.3 | 82% | 0.818 | 77% | 0.767 | S | S | * | * | trans | 66.9 | 162.5 | 155.9 | 78.8 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 258 | S | 35.1 | Very low | 34.1 | Very low | 98 Ų | 98 | 138.6 Ų | 138.6 | 69% | 0.685 | 77% | 0.771 | S | S | * | * | cis | 177.4 | 151.1 | -16.3 | 159.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 259 | L | 39.8 | Very low | 33.4 | Very low | 134 Ų | 134 | 136 Ų | 136 | 70% | 0.702 | 77% | 0.765 | S | S | * | * | cis | -168.7 | 171.6 | -15 | -97.5 | 173.8 | 0 | 0 | 0 | 108 | ||||
| 260 | H | 36.1 | Very low | 33.5 | Very low | 170 Ų | 170 | 136.9 Ų | 136.9 | 79% | 0.787 | 77% | 0.772 | S | S | * | * | trans | 74.6 | 151.3 | 168.6 | -47.5 | 112.6 | 0 | 0 | 0 | 117.1 | ||||
| 261 | S | 37 | Very low | 33 | Very low | 97 Ų | 97 | 134 Ų | 134 | 68% | 0.678 | 76% | 0.761 | S | S | * | * | cis | -166.3 | 138 | -19.2 | 48.5 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 262 | K | 34.6 | Very low | 33 | Very low | 206 Ų | 206 | 134.5 Ų | 134.5 | 90% | 0.896 | 77% | 0.767 | S | S | * | * | trans | 32.8 | 121.3 | 143.8 | -54.2 | 175 | -176.8 | 176.6 | 0 | 120.6 | ||||
| 263 | S | 33.6 | Very low | 32.8 | Very low | 105 Ų | 105 | 132.1 Ų | 132.1 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | -171.2 | 156.4 | 117.9 | -149.1 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 264 | L | 32.5 | Very low | 33 | Very low | 158 Ų | 158 | 129.7 Ų | 129.7 | 83% | 0.827 | 76% | 0.755 | S | S | * | * | trans | 28.7 | 104.4 | 158.4 | -62 | 161.8 | 0 | 0 | 0 | 117.7 | ||||
| 265 | A | 28.8 | Very low | 33.3 | Very low | 88 Ų | 88 | 128.1 Ų | 128.1 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | cis | 79.8 | 125.6 | 37.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 266 | S | 27.8 | Very low | 34 | Very low | 117 Ų | 117 | 127.1 Ų | 127.1 | 82% | 0.818 | 74% | 0.738 | S | S | * | * | trans | 80.9 | 78.8 | 159.2 | -50.9 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 267 | F | 27.1 | Very low | 34.9 | Very low | 200 Ų | 200 | 126.4 Ų | 126.4 | 88% | 0.877 | 73% | 0.726 | S | S | * | * | -171.1 | 47.7 | 117.1 | -138.1 | -94.9 | 0 | 0 | 0 | 115.6 | |||||
| 268 | E | 28.4 | Very low | 36.4 | Very low | 176 Ų | 176 | 126.6 Ų | 126.6 | 82% | 0.822 | 72% | 0.718 | S | S | * | * | trans | -112.8 | 104 | 176.3 | -73.2 | -177.3 | 137.1 | 0 | 0 | 112 | ||||
| 269 | S | 25.7 | Very low | 38.6 | Very low | 106 Ų | 106 | 126.1 Ų | 126.1 | 74% | 0.741 | 70% | 0.704 | S | S | * | * | trans | -154.9 | 48.8 | 175 | 68.3 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 270 | S | 30 | Very low | 40.7 | Very low | 123 Ų | 123 | 119.9 Ų | 119.9 | 86% | 0.86 | 67% | 0.671 | S | S | * | * | trans | -163.4 | 58.9 | 171.3 | -77 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 271 | Q | 28.3 | Very low | 43.1 | Very low | 139 Ų | 139 | 113 Ų | 113 | 65% | 0.65 | 64% | 0.642 | S | S | * | * | trans | -144.4 | 62.1 | -174.5 | -159.4 | -175.9 | 19.6 | 0 | 0 | 113.6 | ||||
| 272 | E | 32.2 | Very low | 45.5 | Very low | 204 Ų | 204 | 112.3 Ų | 112.3 | 95% | 0.953 | 63% | 0.63 | S | S | * | * | S | Bend | trans | -137.4 | 2.3 | 173.6 | -113.1 | 172.3 | -171.7 | 0 | 0 | 114.3 | ||
| 273 | S | 31.6 | Very low | 48.1 | Very low | 104 Ų | 104 | 103.5 Ų | 103.5 | 73% | 0.727 | 59% | 0.592 | S | S | * | * | S | Bend | trans | -109.6 | -14.5 | -177.5 | 52.8 | 0 | 0 | 0 | 0 | 115.4 | A275 | S273-A275 PolarHBondContact O-N 2.67Š|
| 274 | S | 37.1 | Very low | 50.7 | Low | 64 Ų | 64 | 98.5 Ų | 98.5 | 45% | 0.448 | 56% | 0.557 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.7 | -4.8 | -160.8 | 61.4 | 0 | 0 | 0 | 0 | 116.6 | Q276 | S274-Q276 VanDerWaalsContact C-N 3.31Å; S274-Q276 PolarHBondContact O-N 2.83Å |
| 275 | A | 44.4 | Very low | 53.5 | Low | 79 Ų | 79 | 93.4 Ų | 93.4 | 65% | 0.653 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.7 | -5.3 | -168.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | S273 | S273-A275 PolarHBondContact O-N 2.67Š|
| 276 | Q | 49.2 | Very low | 56.3 | Low | 90 Ų | 90 | 91.8 Ų | 91.8 | 42% | 0.421 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -103.5 | -25.6 | 178.8 | -72.3 | -169.9 | -25.5 | 0 | 0 | 114.1 | S274 D278 | S274-Q276 VanDerWaalsContact C-N 3.31Å; S274-Q276 PolarHBondContact O-N 2.83Å; Q276-D278 VanDerWaalsContact C-N 3.34Å; Q276-D278 PolarHBondContact O-N 3.08Å |
| 277 | D | 57.1 | Low | 59.2 | Low | 79 Ų | 79 | 86.2 Ų | 86.2 | 42% | 0.422 | 46% | 0.464 | S | S | . | . | G | 310 helix | trans | -74.5 | -25.1 | -175.3 | -65.7 | -41.2 | 0 | 0 | 0 | 112.8 | F279 V280 R285 | D277-F279 PolarHBondContact O-N 2.72Å; D277-V280 PolarHBondContact O-N 3.31Å; D277-R285 PolarHBondContact O-NH1 3.22Å; D277-R285 PolarHBondContact O-NH2 2.9Å |
| 278 | D | 67.9 | Low | 62.2 | Low | 122 Ų | 122 | 76.7 Ų | 76.7 | 65% | 0.652 | 42% | 0.423 | S | S | * | . | G | 310 helix | trans | -52 | -28.3 | -176.4 | -83.1 | -12.5 | 0 | 0 | 0 | 114.5 | Q276 R285 | Q276-D278 VanDerWaalsContact C-N 3.34Å; Q276-D278 PolarHBondContact O-N 3.08Å; D278-R285 PolarHBondContact O-NH2 2.87Å; D278-R285 VanDerWaalsContact O-NH2 3.09Å |
| 279 | F | 80.8 | Confident | 65 | Low | 87 Ų | 87 | 72.2 Ų | 72.2 | 38% | 0.382 | 40% | 0.401 | S | S | . | . | G | 310 helix | trans | -77.4 | -16.8 | 179.7 | -60 | -74.4 | 0 | 0 | 0 | 114.9 | D277 E406 A409 | D277-F279 PolarHBondContact O-N 2.72Å; F279-E406 HydrophobicContact CB-CB 4.5Å; F279-E406 HydrophobicContact CD1-CG 3.85Å; F279-E406 HydrophobicContact CE1-CG 4.47Å; F279-A409 HydrophobicContact CB-CB 3.98Å |
| 280 | V | 84.6 | Confident | 67.9 | Low | 3 Ų | 3 | 67.5 Ų | 67.5 | 2% | 0.018 | 37% | 0.368 | C | S | . | . | S | Bend | trans | -77.8 | 128 | -175.6 | -175 | 0 | 0 | 0 | 0 | 110.1 | D277 L282 V284 R285 A409 Y413 | D277-V280 PolarHBondContact O-N 3.31Å; V280-L282 PolarHBondContact O-N 3.45Å; V280-V284 HydrophobicContact CG1-CB 4.11Å; V280-V284 HydrophobicContact CG1-CG1 3.98Å; V280-R285 HydrophobicContact CB-CG 4.08Å; V280-R285 HydrophobicContact CG1-CG 3.77Å; V280-R285 VanDerWaalsContact O-CZ 3.28Å; V280-R285 PolarHBondContact O-NE 3.04Å; V280-R285 PolarHBondContact O-NH2 3.09Å; V280-A409 HydrophobicContact CG2-CB 4.5Å; V280-Y413 HydrophobicContact CG1-CD1 3.75Å; V280-Y413 HydrophobicContact CG1-CE1 4.21Å; V280-Y413 HydrophobicContact CG1-CG 4Å; V280-Y413 HydrophobicContact CG2-CD2 4.48Å; V280-Y413 HydrophobicContact CG2-CG 4.14Å |
| 281 | P | 87.2 | Confident | 70.6 | Confident | 27 Ų | 27 | 61.8 Ų | 61.8 | 18% | 0.175 | 33% | 0.327 | C | S | . | . | trans | -56.9 | 138.1 | 179.9 | -26.9 | 34.6 | 0 | 0 | 0 | 113.4 | F283 V284 R285 F363 T410 | P281-F283 PolarHBondContact O-N 3.03Å; P281-V284 HydrophobicContact CB-CG2 4.19Å; P281-V284 HydrophobicContact CG-CG2 4.4Å; P281-V284 WeakPolarHBondContact O-CB 3.42Å; P281-V284 PolarHBondContact O-N 3.28Å; P281-R285 PolarHBondContact O-N 3.31Å; P281-R285 VanDerWaalsContact O-N 3.09Å; P281-F363 HydrophobicContact CB-CZ 4.12Å; P281-F363 HydrophobicContact CG-CE1 4.44Å; P281-F363 HydrophobicContact CG-CZ 4.17Å; P281-T410 WeakPolarHBondContact CD-OG1 3.49Å | ||
| 282 | L | 86.7 | Confident | 73.3 | Confident | 81 Ų | 81 | 58.1 Ų | 58.1 | 42% | 0.424 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -56.5 | -34.4 | -179 | -64 | 176.2 | 0 | 0 | 0 | 112.9 | V280 R285 K286 | V280-L282 PolarHBondContact O-N 3.45Å; L282-R285 PolarHBondContact O-N 2.99Å; L282-K286 WeakPolarHBondContact O-CB 3.49Å; L282-K286 PolarHBondContact O-N 2.93Å |
| 283 | F | 88.7 | Confident | 75.6 | Confident | 22 Ų | 22 | 52.8 Ų | 52.8 | 10% | 0.096 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -57.1 | -48 | 172.1 | 178.9 | -92 | 0 | 0 | 0 | 112.4 | P281 C287 I333 F337 A359 L360 F363 | P281-F283 PolarHBondContact O-N 3.03Å; F283-C287 VanDerWaalsContact O-CB 3.3Å; F283-C287 WeakPolarHBondContact O-CB 3.32Å; F283-C287 PolarHBondContact O-N 3.33Å; F283-C287 PolarHBondContact O-SG 3.22Å; F283-I333 HydrophobicContact CE2-CG2 4.07Å; F283-F337 HydrophobicContact CB-CD1 4.37Å; F283-F337 HydrophobicContact CB-CE1 4.45Å; F283-F337 HydrophobicContact CD2-CB 3.91Å; F283-F337 AromaticContact CD2-CD1 3.85Å; F283-F337 HydrophobicContact CD2-CD1 3.85Å; F283-F337 AromaticContact CD2-CD2 3.47Å; F283-F337 HydrophobicContact CD2-CD2 3.47Å; F283-F337 VanDerWaalsContact CD2-CD2 3.47Å; F283-F337 HydrophobicContact CD2-CE1 4.15Å; F283-F337 AromaticContact CD2-CE2 3.8Å; F283-F337 HydrophobicContact CD2-CE2 3.8Å; F283-F337 AromaticContact CD2-CG 3.49Å; F283-F337 HydrophobicContact CD2-CG 3.49Å; F283-F337 VanDerWaalsContact CD2-CG 3.49Å; F283-F337 HydrophobicContact CD2-CZ 4.13Å; F283-F337 HydrophobicContact CE2-CB 4.39Å; F283-F337 AromaticContact CE2-CD2 3.6Å; F283-F337 HydrophobicContact CE2-CD2 3.6Å; F283-F337 AromaticContact CE2-CE2 3.95Å; F283-F337 HydrophobicContact CE2-CE2 3.95Å; F283-F337 HydrophobicContact CE2-CG 4.05Å; F283-A359 HydrophobicContact CZ-CB 4.13Å; F283-L360 HydrophobicContact CD1-CD1 4.45Å; F283-L360 HydrophobicContact CE1-CD1 4.18Å; F283-F363 HydrophobicContact CD1-CB 3.92Å; F283-F363 HydrophobicContact CD1-CD1 4.04Å; F283-F363 AromaticContact CD1-CD2 3.77Å; F283-F363 HydrophobicContact CD1-CD2 3.77Å; F283-F363 HydrophobicContact CD1-CE2 4.3Å; F283-F363 AromaticContact CD1-CG 3.63Å; F283-F363 HydrophobicContact CD1-CG 3.63Å; F283-F363 HydrophobicContact CE1-CB 3.41Å; F283-F363 VanDerWaalsContact CE1-CB 3.41Å; F283-F363 HydrophobicContact CE1-CD1 4.34Å; F283-F363 HydrophobicContact CE1-CD2 4.07Å; F283-F363 AromaticContact CE1-CG 3.69Å; F283-F363 HydrophobicContact CE1-CG 3.69Å; F283-F363 HydrophobicContact CG-CD2 4.33Å; F283-F363 HydrophobicContact CZ-CB 4.19Å |
| 284 | V | 89.6 | Confident | 77.5 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65.8 | -45.1 | -179.7 | 175.5 | 0 | 0 | 0 | 0 | 110.1 | V280 P281 C287 V288 L360 F363 F364 Y413 | V280-V284 HydrophobicContact CG1-CB 4.11Å; V280-V284 HydrophobicContact CG1-CG1 3.98Å; P281-V284 HydrophobicContact CB-CG2 4.19Å; P281-V284 HydrophobicContact CG-CG2 4.4Å; P281-V284 WeakPolarHBondContact O-CB 3.42Å; P281-V284 PolarHBondContact O-N 3.28Å; V284-C287 PolarHBondContact O-N 3.22Å; V284-V288 HydrophobicContact CG1-CG2 4.5Å; V284-V288 WeakPolarHBondContact O-CB 3.37Å; V284-V288 WeakPolarHBondContact O-CG2 3.44Å; V284-V288 PolarHBondContact O-N 3.49Å; V284-L360 HydrophobicContact CB-CD1 4.37Å; V284-L360 HydrophobicContact CG1-CD1 4.29Å; V284-L360 HydrophobicContact CG2-CD1 4.07Å; V284-F363 HydrophobicContact CG2-CD1 3.8Å; V284-F363 HydrophobicContact CG2-CE1 3.47Å; V284-F363 VanDerWaalsContact CG2-CE1 3.47Å; V284-F363 HydrophobicContact CG2-CZ 4.31Å; V284-F364 HydrophobicContact CG1-CZ 4.14Å; V284-F364 HydrophobicContact CG2-CE1 4.25Å; V284-F364 HydrophobicContact CG2-CZ 3.89Å; V284-Y413 HydrophobicContact CG1-CD1 3.95Å; V284-Y413 HydrophobicContact CG1-CE1 4.11Å |
| 285 | R | 90.1 | Very high | 78.6 | Confident | 50 Ų | 50 | 47.5 Ų | 47.5 | 19% | 0.189 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -60.1 | -56.5 | 177.4 | -62.6 | -168.4 | -127.8 | -172.2 | 4.4 | 111.7 | D277 D278 V280 P281 L282 C287 V288 E289 Y413 | D277-R285 PolarHBondContact O-NH1 3.22Å; D277-R285 PolarHBondContact O-NH2 2.9Å; D278-R285 PolarHBondContact O-NH2 2.87Å; D278-R285 VanDerWaalsContact O-NH2 3.09Å; V280-R285 HydrophobicContact CB-CG 4.08Å; V280-R285 HydrophobicContact CG1-CG 3.77Å; V280-R285 VanDerWaalsContact O-CZ 3.28Å; V280-R285 PolarHBondContact O-NE 3.04Å; V280-R285 PolarHBondContact O-NH2 3.09Å; P281-R285 PolarHBondContact O-N 3.31Å; P281-R285 VanDerWaalsContact O-N 3.09Å; L282-R285 PolarHBondContact O-N 2.99Å; R285-C287 VanDerWaalsContact C-N 3.31Å; R285-C287 PolarHBondContact O-N 3.03Å; R285-V288 PolarHBondContact O-N 2.99Å; R285-V288 VanDerWaalsContact O-N 3.14Å; R285-E289 WeakPolarHBondContact O-CB 3.47Å; R285-E289 WeakPolarHBondContact O-CG 3.3Å; R285-E289 PolarHBondContact O-N 3.34Å; R285-Y413 HydrophobicContact CG-CE1 4.24Å |
| 286 | K | 87.9 | Confident | 79.4 | Confident | 54 Ų | 54 | 50.5 Ų | 50.5 | 24% | 0.235 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -59.7 | -36.7 | 179.8 | -75.5 | -164.1 | 175.3 | -171.5 | 0 | 113.5 | L282 F290 F337 D342 L344 | L282-K286 WeakPolarHBondContact O-CB 3.49Å; L282-K286 PolarHBondContact O-N 2.93Å; K286-F290 WeakPolarHBondContact O-CB 3.36Å; K286-F290 PolarHBondContact O-N 3.12Å; K286-F337 HydrophobicContact CB-CE1 4.2Å; K286-F337 HydrophobicContact CB-CZ 3.87Å; K286-F337 HydrophobicContact CD-CE1 3.97Å; K286-F337 HydrophobicContact CD-CZ 4.14Å; K286-D342 PolarHBondContact NZ-O 3.44Å; K286-L344 PolarHBondContact NZ-O 3.17Å |
| 287 | C | 88.9 | Confident | 79.4 | Confident | 0 Ų | 0 | 50.5 Ų | 50.5 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -66.8 | -46.6 | 175.2 | -71.3 | 0 | 0 | 0 | 0 | 111.8 | F283 V284 R285 F290 I291 V356 L360 | F283-C287 VanDerWaalsContact O-CB 3.3Å; F283-C287 WeakPolarHBondContact O-CB 3.32Å; F283-C287 PolarHBondContact O-N 3.33Å; F283-C287 PolarHBondContact O-SG 3.22Å; V284-C287 PolarHBondContact O-N 3.22Å; R285-C287 VanDerWaalsContact C-N 3.31Å; R285-C287 PolarHBondContact O-N 3.03Å; C287-F290 PolarHBondContact O-N 3.32Å; C287-I291 VanDerWaalsContact O-CD1 3.24Å; C287-I291 WeakPolarHBondContact O-CD1 3.31Å; C287-I291 WeakPolarHBondContact O-CG1 3.45Å; C287-I291 PolarHBondContact O-N 2.87Å; C287-V356 HydrophobicContact CB-CG1 3.82Å; C287-L360 HydrophobicContact CB-CB 4.45Å; C287-L360 HydrophobicContact CB-CD1 4.24Å; C287-L360 HydrophobicContact CB-CD2 4.19Å |
| 288 | V | 89.3 | Confident | 79 | Confident | 1 Ų | 1 | 49.8 Ų | 49.8 | 1% | 0.006 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.5 | -49.4 | 177.1 | 163.6 | 0 | 0 | 0 | 0 | 111 | V284 R285 F290 I291 E292 L360 Y413 H417 | V284-V288 HydrophobicContact CG1-CG2 4.5Å; V284-V288 WeakPolarHBondContact O-CB 3.37Å; V284-V288 WeakPolarHBondContact O-CG2 3.44Å; V284-V288 PolarHBondContact O-N 3.49Å; R285-V288 PolarHBondContact O-N 2.99Å; R285-V288 VanDerWaalsContact O-N 3.14Å; V288-F290 VanDerWaalsContact C-N 3.29Å; V288-F290 PolarHBondContact O-N 3.46Å; V288-I291 PolarHBondContact O-N 3.49Å; V288-I291 VanDerWaalsContact O-N 3.08Å; V288-E292 HydrophobicContact CG1-CG 4.43Å; V288-E292 WeakPolarHBondContact O-CG 3.34Å; V288-E292 PolarHBondContact O-N 3.1Å; V288-L360 HydrophobicContact CG2-CD2 4.1Å; V288-Y413 HydrophobicContact CB-CE1 3.75Å; V288-Y413 HydrophobicContact CG1-CE1 3.81Å; V288-Y413 HydrophobicContact CG2-CD1 4.45Å; V288-Y413 HydrophobicContact CG2-CE1 3.81Å; V288-H417 HydrophobicContact CG1-CB 3.86Å; V288-H417 HydrophobicContact CG2-CB 4.11Å |
| 289 | E | 87.2 | Confident | 78.1 | Confident | 81 Ų | 81 | 50.4 Ų | 50.4 | 38% | 0.379 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -53.5 | -44.2 | 175.1 | -76.5 | 174.6 | -136.6 | 0 | 0 | 112.3 | R285 R293 | R285-E289 WeakPolarHBondContact O-CB 3.47Å; R285-E289 WeakPolarHBondContact O-CG 3.3Å; R285-E289 PolarHBondContact O-N 3.34Å; E289-R293 WeakPolarHBondContact O-CB 3.42Å; E289-R293 PolarHBondContact O-N 2.91Å; E289-R293 IonicContact OE2-NH2 2.67Å; E289-R293 PolarHBondContact OE2-NH2 3.09Å; E289-R293 VanDerWaalsContact OE2-NH2 3.08Å |
| 290 | F | 86.8 | Confident | 76.2 | Confident | 8 Ų | 8 | 55.6 Ų | 55.6 | 4% | 0.035 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -65.6 | -43 | 177.1 | 178.1 | -92.5 | 0 | 0 | 0 | 112 | K286 C287 V288 E292 E294 L346 V353 V356 | K286-F290 WeakPolarHBondContact O-CB 3.36Å; K286-F290 PolarHBondContact O-N 3.12Å; C287-F290 PolarHBondContact O-N 3.32Å; V288-F290 VanDerWaalsContact C-N 3.29Å; V288-F290 PolarHBondContact O-N 3.46Å; F290-E292 VanDerWaalsContact C-N 3.33Å; F290-E292 PolarHBondContact O-N 2.89Å; F290-E294 VanDerWaalsContact O-CB 3.32Å; F290-E294 WeakPolarHBondContact O-CB 3.34Å; F290-E294 PolarHBondContact O-N 2.9Å; F290-L346 HydrophobicContact CB-CB 4.21Å; F290-L346 HydrophobicContact CB-CD1 3.75Å; F290-L346 HydrophobicContact CD2-CB 3.48Å; F290-L346 VanDerWaalsContact CD2-CB 3.48Å; F290-L346 HydrophobicContact CE2-CB 3.93Å; F290-L346 HydrophobicContact CG-CB 3.83Å; F290-L346 HydrophobicContact CG-CD1 4.02Å; F290-V353 HydrophobicContact CE1-CG2 4.38Å; F290-V356 HydrophobicContact CD1-CB 4.15Å; F290-V356 HydrophobicContact CD1-CG1 4.1Å; F290-V356 HydrophobicContact CD1-CG2 3.71Å; F290-V356 HydrophobicContact CE1-CB 4.4Å; F290-V356 HydrophobicContact CE1-CG2 3.66Å |
| 291 | I | 86.8 | Confident | 74.1 | Confident | 2 Ų | 2 | 66.1 Ų | 66.1 | 1% | 0.01 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -63.8 | -38.7 | 178.9 | -65.6 | 158.3 | 0 | 0 | 0 | 111.2 | C287 V288 M315 V353 V356 T357 L360 | C287-I291 VanDerWaalsContact O-CD1 3.24Å; C287-I291 WeakPolarHBondContact O-CD1 3.31Å; C287-I291 WeakPolarHBondContact O-CG1 3.45Å; C287-I291 PolarHBondContact O-N 2.87Å; V288-I291 PolarHBondContact O-N 3.49Å; V288-I291 VanDerWaalsContact O-N 3.08Å; I291-M315 HydrophobicContact CG2-CE 3.4Å; I291-M315 VanDerWaalsContact CG2-CE 3.4Å; I291-M315 WeakPolarHBondContact O-CE 3.34Å; I291-V353 HydrophobicContact CB-CG1 4.2Å; I291-V353 HydrophobicContact CG1-CG1 3.82Å; I291-V353 HydrophobicContact CG2-CG1 3.97Å; I291-V356 HydrophobicContact CD1-CG1 4.12Å; I291-V356 HydrophobicContact CG1-CB 4.48Å; I291-V356 HydrophobicContact CG1-CG1 4.04Å; I291-T357 HydrophobicContact CD1-CG2 3.58Å; I291-T357 HydrophobicContact CG1-CG2 4Å; I291-T357 HydrophobicContact CG2-CG2 4.43Å; I291-L360 HydrophobicContact CD1-CD2 4.07Å |
| 292 | E | 84.5 | Confident | 72 | Confident | 63 Ų | 63 | 71.9 Ų | 71.9 | 29% | 0.294 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -78.5 | -41.4 | 178.3 | -65.5 | -173.4 | 156.8 | 0 | 0 | 112.2 | V288 F290 E294 G295 E296 H417 C420 | V288-E292 HydrophobicContact CG1-CG 4.43Å; V288-E292 WeakPolarHBondContact O-CG 3.34Å; V288-E292 PolarHBondContact O-N 3.1Å; F290-E292 VanDerWaalsContact C-N 3.33Å; F290-E292 PolarHBondContact O-N 2.89Å; E292-E294 PolarHBondContact O-N 2.83Å; E292-G295 CarbonylContact O-C 3.58Å; E292-G295 WeakPolarHBondContact O-CA 3.26Å; E292-G295 PolarHBondContact O-N 3.04Å; E292-E296 PolarHBondContact O-N 3.07Å; E292-H417 VanDerWaalsContact CD-ND1 3.34Å; E292-H417 WeakPolarHBondContact CG-ND1 3.48Å; E292-H417 IonicContact OE1-CE1 2.67Å; E292-H417 IonicContact OE1-CG 3.22Å; E292-H417 IonicContact OE1-ND1 2.7Å; E292-H417 PolarHBondContact OE1-ND1 3.02Å; E292-C420 WeakPolarHBondContact OE1-CB 3.46Å |
| 293 | R | 80.6 | Confident | 70 | Confident | 92 Ų | 92 | 74.6 Ų | 74.6 | 35% | 0.347 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64.1 | -38 | 176 | -172.9 | -171.9 | -56.5 | 141.7 | 8.6 | 112.4 | E289 G295 E296 K297 D347 | E289-R293 WeakPolarHBondContact O-CB 3.42Å; E289-R293 PolarHBondContact O-N 2.91Å; E289-R293 IonicContact OE2-NH2 2.67Å; E289-R293 PolarHBondContact OE2-NH2 3.09Å; E289-R293 VanDerWaalsContact OE2-NH2 3.08Å; R293-G295 PolarHBondContact O-N 3.33Å; R293-E296 PolarHBondContact O-N 2.75Å; R293-E296 VanDerWaalsContact O-N 3.11Å; R293-K297 VanDerWaalsContact O-CG 3.3Å; R293-K297 WeakPolarHBondContact O-CG 3.05Å; R293-K297 PolarHBondContact O-N 3.05Å; R293-D347 IonicContact NH1-OD2 2.87Å; R293-D347 PolarHBondContact NH1-OD2 3.32Å |
| 294 | E | 71.6 | Confident | 68.1 | Low | 56 Ų | 56 | 81 Ų | 81 | 26% | 0.262 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.6 | -25.8 | 172.2 | -165.7 | 58.6 | -141.7 | 0 | 0 | 111.8 | F290 E292 K297 V353 | F290-E294 VanDerWaalsContact O-CB 3.32Å; F290-E294 WeakPolarHBondContact O-CB 3.34Å; F290-E294 PolarHBondContact O-N 2.9Å; E292-E294 PolarHBondContact O-N 2.83Å; E294-K297 WeakPolarHBondContact OE2-CD 3.48Å; E294-K297 WeakPolarHBondContact OE2-CE 3.26Å; E294-K297 IonicContact OE2-NZ 2.75Å; E294-K297 PolarHBondContact OE2-NZ 3.47Å; E294-V353 HydrophobicContact CB-CG2 4.04Å; E294-V353 HydrophobicContact CG-CG2 3.61Å |
| 295 | G | 61.4 | Low | 66.3 | Low | 1 Ų | 1 | 88 Ų | 88 | 1% | 0.01 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -65.9 | -56.6 | 163.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | E292 R293 K297 S298 G314 | E292-G295 CarbonylContact O-C 3.58Å; E292-G295 WeakPolarHBondContact O-CA 3.26Å; E292-G295 PolarHBondContact O-N 3.04Å; R293-G295 PolarHBondContact O-N 3.33Å; G295-K297 VanDerWaalsContact C-N 3.3Å; G295-K297 PolarHBondContact O-N 3.47Å; G295-S298 PolarHBondContact O-N 2.99Å; G295-G314 CarbonylContact C-O 3.59Å; G295-G314 WeakPolarHBondContact CA-O 3.42Å |
| 296 | E | 59.6 | Low | 64.5 | Low | 141 Ų | 141 | 89.6 Ų | 89.6 | 66% | 0.659 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -64.6 | -27.1 | -177.4 | -64.6 | -169.8 | 145.9 | 0 | 0 | 114.3 | E292 R293 S298 F299 | E292-E296 PolarHBondContact O-N 3.07Å; R293-E296 PolarHBondContact O-N 2.75Å; R293-E296 VanDerWaalsContact O-N 3.11Å; E296-S298 PolarHBondContact O-N 3.3Å; E296-S298 VanDerWaalsContact O-N 3.15Å; E296-F299 WeakPolarHBondContact O-CB 3.35Å; E296-F299 PolarHBondContact O-N 3.34Å |
| 297 | K | 51.1 | Low | 62.6 | Low | 91 Ų | 91 | 91.7 Ų | 91.7 | 40% | 0.396 | 46% | 0.464 | S | S | . | . | G | 310 helix | trans | -54.9 | -31.9 | 175.6 | -80.7 | 173.9 | -163.1 | 171.4 | 0 | 112.8 | R293 E294 G295 F299 D347 | R293-K297 VanDerWaalsContact O-CG 3.3Å; R293-K297 WeakPolarHBondContact O-CG 3.05Å; R293-K297 PolarHBondContact O-N 3.05Å; E294-K297 WeakPolarHBondContact OE2-CD 3.48Å; E294-K297 WeakPolarHBondContact OE2-CE 3.26Å; E294-K297 IonicContact OE2-NZ 2.75Å; E294-K297 PolarHBondContact OE2-NZ 3.47Å; G295-K297 VanDerWaalsContact C-N 3.3Å; G295-K297 PolarHBondContact O-N 3.47Å; K297-F299 PolarHBondContact O-N 3.27Å; K297-D347 WeakPolarHBondContact CE-OD1 3.37Å; K297-D347 IonicContact NZ-OD1 3.14Å; K297-D347 PolarHBondContact NZ-OD1 3.23Å |
| 298 | S | 48 | Very low | 60.3 | Low | 64 Ų | 64 | 103.3 Ų | 103.3 | 45% | 0.448 | 51% | 0.508 | S | S | . | . | G | 310 helix | trans | -71.5 | -7.8 | 176 | -71.3 | 0 | 0 | 0 | 0 | 114.1 | G295 E296 I313 T316 | G295-S298 PolarHBondContact O-N 2.99Å; E296-S298 PolarHBondContact O-N 3.3Å; E296-S298 VanDerWaalsContact O-N 3.15Å; S298-I313 WeakPolarHBondContact CB-O 3.49Å; S298-T316 VanDerWaalsContact OG-CG2 3.29Å; S298-T316 WeakPolarHBondContact OG-CG2 3.37Å |
| 299 | F | 47.7 | Very low | 58.2 | Low | 135 Ų | 135 | 109 Ų | 109 | 59% | 0.592 | 54% | 0.537 | S | S | * | . | G | 310 helix | trans | -86 | -13.1 | -179 | -152.4 | -111.2 | 0 | 0 | 0 | 113.8 | E296 K297 L312 | E296-F299 WeakPolarHBondContact O-CB 3.35Å; E296-F299 PolarHBondContact O-N 3.34Å; K297-F299 PolarHBondContact O-N 3.27Å; F299-L312 HydrophobicContact CE2-CD1 3.9Å |
| 300 | Y | 42.8 | Very low | 56 | Low | 196 Ų | 196 | 113.4 Ų | 113.4 | 77% | 0.769 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -121.4 | 71.5 | -171.6 | -82.7 | -84.4 | 0 | 0 | 0 | 114.5 | ||
| 301 | W | 39.9 | Very low | 54 | Low | 224 Ų | 224 | 118.2 Ų | 118.2 | 85% | 0.848 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -153.2 | -31.2 | 158.7 | -162.9 | -111.9 | 0 | 0 | 0 | 115.4 | V303 | W301-V303 PolarHBondContact O-N 3.03Š|
| 302 | I | 43 | Very low | 52 | Low | 147 Ų | 147 | 123.5 Ų | 123.5 | 75% | 0.754 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | 70.4 | -170.9 | -48.6 | -178.9 | 0 | 0 | 0 | 111.8 | ||
| 303 | V | 44.8 | Very low | 50 | Low | 138 Ų | 138 | 124 Ų | 124 | 84% | 0.836 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.1 | -20.2 | 172.8 | 180 | 0 | 0 | 0 | 0 | 112.7 | W301 | W301-V303 PolarHBondContact O-N 3.03Š|
| 304 | L | 48.2 | Very low | 48.3 | Very low | 158 Ų | 158 | 120.5 Ų | 120.5 | 83% | 0.827 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -83.4 | -24.8 | -167.7 | -84.1 | 167.3 | 0 | 0 | 0 | 116.8 | ||
| 305 | I | 52.1 | Low | 47.8 | Very low | 146 Ų | 146 | 118.2 Ų | 118.2 | 75% | 0.749 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -141 | 100.7 | -175.1 | -51 | -178.9 | 0 | 0 | 0 | 113.3 | C307 | I305-C307 VanDerWaalsContact C-N 3.32Å; I305-C307 PolarHBondContact O-N 3.45Å |
| 306 | G | 53.1 | Low | 47.9 | Very low | 83 Ų | 83 | 121.6 Ų | 121.6 | 86% | 0.856 | 62% | 0.622 | S | S | * | * | S | Bend | trans | 70.3 | -37.7 | 140.5 | 0 | 0 | 0 | 0 | 0 | 121.1 | R308 | G306-R308 PolarHBondContact O-N 3.28Š|
| 307 | C | 47.8 | Very low | 48.7 | Very low | 98 Ų | 98 | 116.4 Ų | 116.4 | 66% | 0.662 | 60% | 0.6 | S | S | * | * | trans | -90.6 | 102 | -167 | -78 | 0 | 0 | 0 | 0 | 113.3 | I305 I309 | I305-C307 VanDerWaalsContact C-N 3.32Å; I305-C307 PolarHBondContact O-N 3.45Å; C307-I309 PolarHBondContact O-N 2.95Å | ||
| 308 | R | 39.7 | Very low | 50.3 | Low | 244 Ų | 244 | 118.4 Ų | 118.4 | 92% | 0.921 | 61% | 0.611 | S | S | * | * | trans | -77.9 | 61.3 | -179.4 | -171 | 169.4 | 170 | 153.9 | -6.3 | 112.7 | G306 | G306-R308 PolarHBondContact O-N 3.28Š| ||
| 309 | I | 45.8 | Very low | 52.1 | Low | 122 Ų | 122 | 115.3 Ų | 115.3 | 63% | 0.626 | 59% | 0.589 | S | S | * | * | trans | -114.9 | 97.7 | -179.7 | -68.5 | 176.9 | 0 | 0 | 0 | 109.1 | C307 I311 | C307-I309 PolarHBondContact O-N 2.95Å; I309-I311 HydrophobicContact CG2-CD1 3.57Å; I309-I311 HydrophobicContact CG2-CG1 3.62Å; I309-I311 PolarHBondContact O-N 2.92Å | ||
| 310 | N | 41 | Very low | 53.9 | Low | 172 Ų | 172 | 109 Ų | 109 | 92% | 0.92 | 56% | 0.562 | S | S | * | * | trans | -75.6 | 99.7 | 170.7 | -75.3 | -12 | 0 | 0 | 0 | 109.1 | ||||
| 311 | I | 44.8 | Very low | 56.2 | Low | 109 Ų | 109 | 99.7 Ų | 99.7 | 56% | 0.559 | 53% | 0.525 | S | S | * | . | trans | -116.5 | 123 | 163.3 | -53.9 | 162.2 | 0 | 0 | 0 | 107.8 | I309 I313 | I309-I311 HydrophobicContact CG2-CD1 3.57Å; I309-I311 HydrophobicContact CG2-CG1 3.62Å; I309-I311 PolarHBondContact O-N 2.92Å; I311-I313 HydrophobicContact CB-CD1 4.24Å; I311-I313 HydrophobicContact CB-CG1 3.82Å; I311-I313 HydrophobicContact CG2-CD1 4.06Å; I311-I313 HydrophobicContact CG2-CG1 3.36Å; I311-I313 PolarHBondContact O-N 3.41Å | ||
| 312 | L | 44.4 | Very low | 58.7 | Low | 114 Ų | 114 | 93.6 Ų | 93.6 | 60% | 0.597 | 50% | 0.502 | S | S | * | . | trans | -78.8 | 66.5 | 176.8 | -161.7 | 78.6 | 0 | 0 | 0 | 109.5 | F299 G314 | F299-L312 HydrophobicContact CE2-CD1 3.9Å; L312-G314 PolarHBondContact O-N 3Å | ||
| 313 | I | 42.6 | Very low | 60.9 | Low | 72 Ų | 72 | 89 Ų | 89 | 37% | 0.369 | 48% | 0.481 | S | S | . | . | trans | -75.8 | 57.4 | -179.3 | -47 | -179.7 | 0 | 0 | 0 | 109.7 | S298 I311 M315 T316 T427 | S298-I313 WeakPolarHBondContact CB-O 3.49Å; I311-I313 HydrophobicContact CB-CD1 4.24Å; I311-I313 HydrophobicContact CB-CG1 3.82Å; I311-I313 HydrophobicContact CG2-CD1 4.06Å; I311-I313 HydrophobicContact CG2-CG1 3.36Å; I311-I313 PolarHBondContact O-N 3.41Å; I313-M315 VanDerWaalsContact C-N 3.29Å; I313-M315 PolarHBondContact O-N 3.45Å; I313-T316 HydrophobicContact CG2-CG2 4.23Å; I313-T427 HydrophobicContact CG2-CG2 3.97Å | ||
| 314 | G | 45.9 | Very low | 63 | Low | 19 Ų | 19 | 86.3 Ų | 86.3 | 20% | 0.196 | 47% | 0.466 | C | S | . | . | trans | -86.3 | 16.1 | -168.8 | 0 | 0 | 0 | 0 | 0 | 115 | G295 L312 N424 | G295-G314 CarbonylContact C-O 3.59Å; G295-G314 WeakPolarHBondContact CA-O 3.42Å; L312-G314 PolarHBondContact O-N 3Å; G314-N424 PolarHBondContact O-ND2 2.92Å | ||
| 315 | M | 59.2 | Low | 65 | Low | 8 Ų | 8 | 79.4 Ų | 79.4 | 4% | 0.039 | 43% | 0.433 | C | S | . | . | trans | -168 | 101.8 | 169.3 | -70.2 | -159.9 | 119.8 | 0 | 0 | 109.3 | I291 I313 T317 L320 V421 N424 T427 T428 | I291-M315 HydrophobicContact CG2-CE 3.4Å; I291-M315 VanDerWaalsContact CG2-CE 3.4Å; I291-M315 WeakPolarHBondContact O-CE 3.34Å; I313-M315 VanDerWaalsContact C-N 3.29Å; I313-M315 PolarHBondContact O-N 3.45Å; M315-T317 PolarHBondContact O-N 3.13Å; M315-L320 HydrophobicContact CB-CD1 4.37Å; M315-L320 HydrophobicContact CE-CD1 3.49Å; M315-L320 VanDerWaalsContact CE-CD1 3.49Å; M315-L320 HydrophobicContact CG-CD1 4.41Å; M315-L320 HydrophobicContact SD-CD1 3.39Å; M315-L320 WeakPolarHBondContact SD-CD1 3.31Å; M315-V421 HydrophobicContact CE-CG2 3.85Å; M315-V421 HydrophobicContact SD-CB 4.09Å; M315-V421 HydrophobicContact SD-CG1 3.94Å; M315-V421 HydrophobicContact SD-CG2 3.88Å; M315-N424 HydrophobicContact CG-CB 4.37Å; M315-T427 WeakPolarHBondContact O-CB 3.34Å; M315-T427 WeakPolarHBondContact O-CG2 3.32Å; M315-T428 HydrophobicContact CB-CG2 3.53Å; M315-T428 HydrophobicContact CG-CG2 4.02Å; M315-T428 HydrophobicContact SD-CG2 3.56Å; M315-T428 VanDerWaalsContact SD-CG2 3.56Å | ||
| 316 | T | 63.9 | Low | 66.9 | Low | 72 Ų | 72 | 76.7 Ų | 76.7 | 44% | 0.442 | 42% | 0.42 | S | S | . | . | trans | -75.6 | -15.7 | -171.7 | 54.4 | 0 | 0 | 0 | 0 | 115.6 | S298 I313 | S298-T316 VanDerWaalsContact OG-CG2 3.29Å; S298-T316 WeakPolarHBondContact OG-CG2 3.37Å; I313-T316 HydrophobicContact CG2-CG2 4.23Å | ||
| 317 | T | 77.5 | Confident | 68.7 | Low | 32 Ų | 32 | 77.5 Ų | 77.5 | 20% | 0.196 | 40% | 0.401 | C | S | . | . | trans | -93.5 | 116.2 | -172.2 | -62 | 0 | 0 | 0 | 0 | 111.7 | M315 L320 N354 | M315-T317 PolarHBondContact O-N 3.13Å; T317-L320 HydrophobicContact CG2-CD2 3.92Å; T317-L320 HydrophobicContact CG2-CG 4.47Å; T317-N354 WeakPolarHBondContact CG2-ND2 3.47Å; T317-N354 WeakPolarHBondContact CG2-OD1 3.3Å | ||
| 318 | E | 83.8 | Confident | 70.8 | Confident | 133 Ų | 133 | 77.2 Ų | 77.2 | 62% | 0.621 | 40% | 0.4 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.8 | 137.6 | 171.4 | -72 | -171.5 | -163.4 | 0 | 0 | 112.3 | ||
| 319 | G | 85.2 | Confident | 73.2 | Confident | 0 Ų | 0 | 67.9 Ų | 67.9 | 0% | 0 | 37% | 0.367 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 74.7 | 32.9 | 169.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | R322 V323 T428 | G319-R322 CarbonylContact O-C 3.6Å; G319-R322 WeakPolarHBondContact O-CA 3.14Å; G319-R322 WeakPolarHBondContact O-CB 3.41Å; G319-R322 PolarHBondContact O-N 3.42Å; G319-V323 PolarHBondContact O-N 2.81Å; G319-T428 PolarHBondContact N-O 2.99Å |
| 320 | L | 87.4 | Confident | 75.4 | Confident | 2 Ų | 2 | 62 Ų | 62 | 1% | 0.01 | 34% | 0.338 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -48.2 | 140.4 | 169.8 | -68 | 171.2 | 0 | 0 | 0 | 111.3 | M315 T317 R322 V353 T357 V421 T428 M430 | M315-L320 HydrophobicContact CB-CD1 4.37Å; M315-L320 HydrophobicContact CE-CD1 3.49Å; M315-L320 VanDerWaalsContact CE-CD1 3.49Å; M315-L320 HydrophobicContact CG-CD1 4.41Å; M315-L320 HydrophobicContact SD-CD1 3.39Å; M315-L320 WeakPolarHBondContact SD-CD1 3.31Å; T317-L320 HydrophobicContact CG2-CD2 3.92Å; T317-L320 HydrophobicContact CG2-CG 4.47Å; L320-R322 PolarHBondContact O-N 3.08Å; L320-V353 HydrophobicContact CD2-CB 4.11Å; L320-V353 HydrophobicContact CD2-CG1 3.59Å; L320-T357 HydrophobicContact CD2-CG2 4.09Å; L320-V421 HydrophobicContact CB-CG1 4.25Å; L320-V421 HydrophobicContact CD1-CG1 4.1Å; L320-T428 HydrophobicContact CD1-CG2 4.07Å; L320-M430 WeakPolarHBondContact O-CE 3.35Å |
| 321 | Y | 90.9 | Very high | 77.8 | Confident | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 32% | 0.317 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 60.9 | -26.7 | -169.2 | -58.8 | -76.6 | 0 | 0 | 0 | 116.7 | T357 L360 K361 F414 H417 L418 V421 L439 | Y321-T357 HydrophobicContact CD1-CG2 4.26Å; Y321-T357 HydrophobicContact CD2-CG2 4.43Å; Y321-T357 HydrophobicContact CE1-CG2 3.91Å; Y321-T357 HydrophobicContact CE2-CG2 4.07Å; Y321-L360 HydrophobicContact CE1-CD2 4.44Å; Y321-K361 HydrophobicContact CD1-CD 4.1Å; Y321-K361 HydrophobicContact CD1-CG 3.99Å; Y321-K361 PolarHBondContact O-NZ 2.87Å; Y321-F414 HydrophobicContact CE1-CE2 4.13Å; Y321-F414 HydrophobicContact CE1-CZ 4.16Å; Y321-H417 AromaticContact CE2-NE2 3.95Å; Y321-H417 AromaticContact CZ-NE2 3.93Å; Y321-H417 PolarHBondContact OH-CD2 3.15Å; Y321-H417 PolarHBondContact OH-NE2 3.36Å; Y321-L418 HydrophobicContact CD2-CD2 3.75Å; Y321-L418 HydrophobicContact CE2-CD2 3.4Å; Y321-L418 VanDerWaalsContact CE2-CD2 3.4Å; Y321-L418 HydrophobicContact CG-CD2 4.47Å; Y321-V421 HydrophobicContact CE2-CG2 4.33Å; Y321-L439 HydrophobicContact CD1-CD1 4.42Å; Y321-L439 HydrophobicContact CD1-CD2 3.91Å; Y321-L439 HydrophobicContact CG-CD1 4.29Å; Y321-L439 HydrophobicContact CG-CD2 4.27Å |
| 322 | R | 91.6 | Very high | 79.9 | Confident | 96 Ų | 96 | 55.6 Ų | 55.6 | 36% | 0.362 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.1 | -42.4 | 174.6 | -178.6 | -174.1 | 73.5 | -159.5 | 3.5 | 112.3 | G319 L320 M430 | G319-R322 CarbonylContact O-C 3.6Å; G319-R322 WeakPolarHBondContact O-CA 3.14Å; G319-R322 WeakPolarHBondContact O-CB 3.41Å; G319-R322 PolarHBondContact O-N 3.42Å; L320-R322 PolarHBondContact O-N 3.08Å; R322-M430 HydrophobicContact CB-CE 3.94Å; R322-M430 HydrophobicContact CB-SD 3.76Å; R322-M430 HydrophobicContact CG-SD 4.49Å |
| 323 | V | 89 | Confident | 82 | Confident | 52 Ų | 52 | 50.1 Ų | 50.1 | 32% | 0.315 | 28% | 0.278 | S | S | . | . | S | Bend | trans | -87.2 | 125.2 | -179.8 | -179.6 | 0 | 0 | 0 | 0 | 109.7 | G319 | G319-V323 PolarHBondContact O-N 2.81Š|
| 324 | P | 89.9 | Confident | 84.1 | Confident | 81 Ų | 81 | 49.4 Ų | 49.4 | 53% | 0.526 | 27% | 0.273 | S | S | . | . | P | Polyproline II helix | trans | -77.7 | 138.7 | 172.5 | 31.4 | -33.1 | 0 | 0 | 0 | 111.1 | ||
| 325 | G | 88.9 | Confident | 86.1 | Confident | 12 Ų | 12 | 53.2 Ų | 53.2 | 12% | 0.124 | 29% | 0.286 | C | S | . | . | P | Polyproline II helix | trans | -79.9 | 173.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | Q327 N354 T358 | G325-Q327 PolarHBondContact O-N 2.93Å; G325-Q327 PolarHBondContact O-NE2 3.27Å; G325-N354 WeakPolarHBondContact CA-O 3.26Å; G325-N354 PolarHBondContact N-O 3.46Å; G325-N354 VanDerWaalsContact N-O 3.17Å; G325-T358 PolarHBondContact N-OG1 3.14Å |
| 326 | N | 91.5 | Very high | 87.3 | Confident | 89 Ų | 89 | 55.8 Ų | 55.8 | 48% | 0.476 | 30% | 0.297 | S | S | . | . | P | Polyproline II helix | trans | -65.6 | 117.7 | 176 | 179.8 | 2.9 | 0 | 0 | 0 | 110.6 | S328 Q329 V330 | N326-S328 PolarHBondContact O-N 3.34Å; N326-S328 VanDerWaalsContact O-N 3.14Å; N326-S328 PolarHBondContact OD1-N 3Å; N326-Q329 HydrophobicContact CB-CB 4.48Å; N326-Q329 HydrophobicContact CB-CG 4.49Å; N326-Q329 PolarHBondContact O-N 3.44Å; N326-V330 WeakPolarHBondContact O-CG2 3.24Å; N326-V330 PolarHBondContact O-N 2.95Å |
| 327 | Q | 92.1 | Very high | 88.2 | Confident | 100 Ų | 100 | 54.4 Ų | 54.4 | 47% | 0.467 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -58 | -30.7 | -176.4 | -62.6 | -61.1 | -57.1 | 0 | 0 | 113.1 | G325 Q329 V330 V331 | G325-Q327 PolarHBondContact O-N 2.93Å; G325-Q327 PolarHBondContact O-NE2 3.27Å; Q327-Q329 VanDerWaalsContact C-N 3.32Å; Q327-Q329 PolarHBondContact O-N 3.49Å; Q327-V330 PolarHBondContact O-N 3.18Å; Q327-V331 WeakPolarHBondContact O-CG2 3.49Å; Q327-V331 PolarHBondContact O-N 3.12Å |
| 328 | S | 92.1 | Very high | 88.4 | Confident | 92 Ų | 92 | 59.2 Ų | 59.2 | 64% | 0.643 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -66.5 | -32.2 | 175.6 | -54.8 | 0 | 0 | 0 | 0 | 113.2 | N326 L332 | N326-S328 PolarHBondContact O-N 3.34Å; N326-S328 VanDerWaalsContact O-N 3.14Å; N326-S328 PolarHBondContact OD1-N 3Å; S328-L332 WeakPolarHBondContact O-CB 3.31Å; S328-L332 PolarHBondContact O-N 2.66Å |
| 329 | Q | 90.4 | Very high | 88.1 | Confident | 48 Ų | 48 | 57.2 Ų | 57.2 | 22% | 0.224 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -80 | -34.2 | 174.5 | -72.6 | 173 | -49.6 | 0 | 0 | 111.3 | N326 Q327 L332 I333 I351 A355 | N326-Q329 HydrophobicContact CB-CB 4.48Å; N326-Q329 HydrophobicContact CB-CG 4.49Å; N326-Q329 PolarHBondContact O-N 3.44Å; Q327-Q329 VanDerWaalsContact C-N 3.32Å; Q327-Q329 PolarHBondContact O-N 3.49Å; Q329-L332 WeakPolarHBondContact O-CB 3.46Å; Q329-L332 PolarHBondContact O-N 3.15Å; Q329-I333 WeakPolarHBondContact O-CG1 3.32Å; Q329-I333 PolarHBondContact O-N 3.01Å; Q329-I351 HydrophobicContact CB-CD1 4.42Å; Q329-I351 HydrophobicContact CB-CG2 4.09Å; Q329-I351 HydrophobicContact CG-CG1 4.46Å; Q329-A355 HydrophobicContact CB-CB 3.98Å |
| 330 | V | 91.1 | Very high | 87.1 | Confident | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.4 | -51 | 174.2 | 173.6 | 0 | 0 | 0 | 0 | 110.9 | N326 Q327 L332 I333 E334 A355 T358 A359 N362 | N326-V330 WeakPolarHBondContact O-CG2 3.24Å; N326-V330 PolarHBondContact O-N 2.95Å; Q327-V330 PolarHBondContact O-N 3.18Å; V330-L332 VanDerWaalsContact C-N 3.28Å; V330-L332 PolarHBondContact O-N 3.46Å; V330-I333 WeakPolarHBondContact O-CB 3.47Å; V330-I333 PolarHBondContact O-N 3.03Å; V330-E334 VanDerWaalsContact CG1-OE1 3.26Å; V330-E334 WeakPolarHBondContact CG1-OE1 3.39Å; V330-E334 WeakPolarHBondContact O-CG 3.5Å; V330-E334 PolarHBondContact O-N 2.78Å; V330-A355 HydrophobicContact CG2-CB 4.12Å; V330-T358 HydrophobicContact CG1-CG2 4.44Å; V330-T358 HydrophobicContact CG2-CG2 3.78Å; V330-A359 HydrophobicContact CG1-CB 4.06Å; V330-N362 WeakPolarHBondContact CG1-ND2 3.5Å |
| 331 | V | 90.9 | Very high | 85.8 | Confident | 79 Ų | 79 | 66 Ų | 66 | 48% | 0.479 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -64 | -32.5 | 176.4 | 174.2 | 0 | 0 | 0 | 0 | 111.9 | Q327 E334 Q335 | Q327-V331 WeakPolarHBondContact O-CG2 3.49Å; Q327-V331 PolarHBondContact O-N 3.12Å; V331-E334 PolarHBondContact O-N 3.5Å; V331-Q335 VanDerWaalsContact O-CB 3.29Å; V331-Q335 WeakPolarHBondContact O-CB 3.29Å; V331-Q335 PolarHBondContact O-N 3.43Å |
| 332 | L | 90 | Very high | 84.4 | Confident | 66 Ų | 66 | 71.3 Ų | 71.3 | 35% | 0.346 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -65.4 | -41.8 | 173.9 | -179.8 | 63.5 | 0 | 0 | 0 | 112.1 | S328 Q329 V330 K336 I351 | S328-L332 WeakPolarHBondContact O-CB 3.31Å; S328-L332 PolarHBondContact O-N 2.66Å; Q329-L332 WeakPolarHBondContact O-CB 3.46Å; Q329-L332 PolarHBondContact O-N 3.15Å; V330-L332 VanDerWaalsContact C-N 3.28Å; V330-L332 PolarHBondContact O-N 3.46Å; L332-K336 HydrophobicContact CD1-CG 4.36Å; L332-K336 VanDerWaalsContact O-CB 3.32Å; L332-K336 WeakPolarHBondContact O-CB 3.45Å; L332-K336 VanDerWaalsContact O-CG 3.24Å; L332-K336 WeakPolarHBondContact O-CG 3.39Å; L332-K336 PolarHBondContact O-N 3.11Å; L332-I351 HydrophobicContact CD2-CD1 4.41Å |
| 333 | I | 88.1 | Confident | 83 | Confident | 0 Ų | 0 | 73.9 Ų | 73.9 | 0% | 0 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -60.9 | -53.1 | 172.9 | -65.4 | 160.5 | 0 | 0 | 0 | 109.8 | F283 Q329 V330 Q335 K336 F337 L346 I351 A355 V356 A359 | F283-I333 HydrophobicContact CE2-CG2 4.07Å; Q329-I333 WeakPolarHBondContact O-CG1 3.32Å; Q329-I333 PolarHBondContact O-N 3.01Å; V330-I333 WeakPolarHBondContact O-CB 3.47Å; V330-I333 PolarHBondContact O-N 3.03Å; I333-Q335 PolarHBondContact O-N 3.29Å; I333-K336 PolarHBondContact O-N 3.1Å; I333-K336 VanDerWaalsContact O-N 3.13Å; I333-F337 HydrophobicContact CG2-CD2 3.74Å; I333-F337 HydrophobicContact CG2-CE2 3.8Å; I333-F337 WeakPolarHBondContact O-CD2 3.44Å; I333-F337 PolarHBondContact O-N 2.77Å; I333-L346 HydrophobicContact CG1-CD2 4.24Å; I333-L346 HydrophobicContact CG2-CD2 4.23Å; I333-I351 HydrophobicContact CD1-CD1 4.22Å; I333-I351 HydrophobicContact CD1-CG2 4.02Å; I333-I351 HydrophobicContact CG1-CD1 3.71Å; I333-A355 HydrophobicContact CD1-CB 4.44Å; I333-V356 HydrophobicContact CD1-CG2 3.88Å; I333-A359 HydrophobicContact CB-CB 4.29Å; I333-A359 HydrophobicContact CD1-CB 4.09Å; I333-A359 HydrophobicContact CG2-CB 4.08Å |
| 334 | E | 87 | Confident | 81.9 | Confident | 56 Ų | 56 | 72.7 Ų | 72.7 | 26% | 0.262 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -56.6 | -47.8 | -178.2 | -70 | 166.5 | -177.2 | 0 | 0 | 111.1 | V330 V331 F337 M338 N362 | V330-E334 VanDerWaalsContact CG1-OE1 3.26Å; V330-E334 WeakPolarHBondContact CG1-OE1 3.39Å; V330-E334 WeakPolarHBondContact O-CG 3.5Å; V330-E334 PolarHBondContact O-N 2.78Å; V331-E334 PolarHBondContact O-N 3.5Å; E334-F337 PolarHBondContact O-N 3.3Å; E334-M338 WeakPolarHBondContact O-CG 3.11Å; E334-M338 PolarHBondContact O-N 3.29Å; E334-M338 VanDerWaalsContact O-N 3.1Å; E334-N362 WeakPolarHBondContact OE1-CB 3.45Å; E334-N362 PolarHBondContact OE1-ND2 3.01Å |
| 335 | Q | 87 | Confident | 81 | Confident | 100 Ų | 100 | 71.5 Ų | 71.5 | 47% | 0.467 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60.7 | -45.8 | 174.7 | -178.5 | -177.3 | -28.1 | 0 | 0 | 112.1 | V331 I333 F337 M338 E339 | V331-Q335 VanDerWaalsContact O-CB 3.29Å; V331-Q335 WeakPolarHBondContact O-CB 3.29Å; V331-Q335 PolarHBondContact O-N 3.43Å; I333-Q335 PolarHBondContact O-N 3.29Å; Q335-F337 VanDerWaalsContact C-N 3.35Å; Q335-F337 PolarHBondContact O-N 3.41Å; Q335-M338 WeakPolarHBondContact O-CA 3.41Å; Q335-M338 WeakPolarHBondContact O-CB 3.29Å; Q335-M338 PolarHBondContact O-N 3.24Å; Q335-M338 VanDerWaalsContact O-N 3.08Å; Q335-E339 PolarHBondContact NE2-OE1 2.77Å; Q335-E339 WeakPolarHBondContact O-CG 3.29Å; Q335-E339 PolarHBondContact O-N 3.46Å |
| 336 | K | 85.4 | Confident | 80.4 | Confident | 62 Ų | 62 | 71.4 Ų | 71.4 | 27% | 0.27 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -58.4 | -46.6 | -179.3 | -81.9 | -75.8 | 157.4 | -148.4 | 0 | 111.4 | L332 I333 M338 E339 L344 | L332-K336 HydrophobicContact CD1-CG 4.36Å; L332-K336 VanDerWaalsContact O-CB 3.32Å; L332-K336 WeakPolarHBondContact O-CB 3.45Å; L332-K336 VanDerWaalsContact O-CG 3.24Å; L332-K336 WeakPolarHBondContact O-CG 3.39Å; L332-K336 PolarHBondContact O-N 3.11Å; I333-K336 PolarHBondContact O-N 3.1Å; I333-K336 VanDerWaalsContact O-N 3.13Å; K336-M338 VanDerWaalsContact C-N 3.31Å; K336-M338 PolarHBondContact O-N 3.08Å; K336-E339 IonicContact NZ-OE2 3.7Å; K336-E339 PolarHBondContact NZ-OE2 3.27Å; K336-E339 WeakPolarHBondContact O-CB 3.47Å; K336-E339 PolarHBondContact O-N 2.95Å; K336-E339 VanDerWaalsContact O-N 3.07Å; K336-L344 VanDerWaalsContact C-CD1 3.49Å; K336-L344 HydrophobicContact CB-CD1 3.98Å; K336-L344 HydrophobicContact CB-CD2 4.14Å; K336-L344 HydrophobicContact CD-CD2 3.85Å; K336-L344 HydrophobicContact CG-CD2 4.43Å; K336-L344 VanDerWaalsContact O-CD1 3.23Å; K336-L344 WeakPolarHBondContact O-CD1 3.4Å |
| 337 | F | 83.4 | Confident | 79.5 | Confident | 42 Ų | 42 | 69.8 Ų | 69.8 | 18% | 0.184 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65.1 | -32.2 | 175.7 | -82.8 | -83.5 | 0 | 0 | 0 | 113.3 | F283 K286 I333 E334 Q335 E339 K340 L346 | F283-F337 HydrophobicContact CB-CD1 4.37Å; F283-F337 HydrophobicContact CB-CE1 4.45Å; F283-F337 HydrophobicContact CD2-CB 3.91Å; F283-F337 AromaticContact CD2-CD1 3.85Å; F283-F337 HydrophobicContact CD2-CD1 3.85Å; F283-F337 AromaticContact CD2-CD2 3.47Å; F283-F337 HydrophobicContact CD2-CD2 3.47Å; F283-F337 VanDerWaalsContact CD2-CD2 3.47Å; F283-F337 HydrophobicContact CD2-CE1 4.15Å; F283-F337 AromaticContact CD2-CE2 3.8Å; F283-F337 HydrophobicContact CD2-CE2 3.8Å; F283-F337 AromaticContact CD2-CG 3.49Å; F283-F337 HydrophobicContact CD2-CG 3.49Å; F283-F337 VanDerWaalsContact CD2-CG 3.49Å; F283-F337 HydrophobicContact CD2-CZ 4.13Å; F283-F337 HydrophobicContact CE2-CB 4.39Å; F283-F337 AromaticContact CE2-CD2 3.6Å; F283-F337 HydrophobicContact CE2-CD2 3.6Å; F283-F337 AromaticContact CE2-CE2 3.95Å; F283-F337 HydrophobicContact CE2-CE2 3.95Å; F283-F337 HydrophobicContact CE2-CG 4.05Å; K286-F337 HydrophobicContact CB-CE1 4.2Å; K286-F337 HydrophobicContact CB-CZ 3.87Å; K286-F337 HydrophobicContact CD-CE1 3.97Å; K286-F337 HydrophobicContact CD-CZ 4.14Å; I333-F337 HydrophobicContact CG2-CD2 3.74Å; I333-F337 HydrophobicContact CG2-CE2 3.8Å; I333-F337 WeakPolarHBondContact O-CD2 3.44Å; I333-F337 PolarHBondContact O-N 2.77Å; E334-F337 PolarHBondContact O-N 3.3Å; Q335-F337 VanDerWaalsContact C-N 3.35Å; Q335-F337 PolarHBondContact O-N 3.41Å; F337-E339 VanDerWaalsContact C-N 3.28Å; F337-E339 PolarHBondContact O-N 3.2Å; F337-K340 PolarHBondContact O-N 2.99Å; F337-L346 HydrophobicContact CE2-CD2 4.14Å; F337-L346 HydrophobicContact CE2-CG 4.5Å |
| 338 | M | 80.8 | Confident | 78.7 | Confident | 133 Ų | 133 | 71.5 Ų | 71.5 | 66% | 0.655 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -67.6 | -25.7 | 171.5 | -69.3 | 178 | 73.1 | 0 | 0 | 113.4 | E334 Q335 K336 K340 | E334-M338 WeakPolarHBondContact O-CG 3.11Å; E334-M338 PolarHBondContact O-N 3.29Å; E334-M338 VanDerWaalsContact O-N 3.1Å; Q335-M338 WeakPolarHBondContact O-CA 3.41Å; Q335-M338 WeakPolarHBondContact O-CB 3.29Å; Q335-M338 PolarHBondContact O-N 3.24Å; Q335-M338 VanDerWaalsContact O-N 3.08Å; K336-M338 VanDerWaalsContact C-N 3.31Å; K336-M338 PolarHBondContact O-N 3.08Å; M338-K340 PolarHBondContact O-N 3.38Å |
| 339 | E | 77.3 | Confident | 77.9 | Confident | 91 Ų | 91 | 69.6 Ų | 69.6 | 43% | 0.425 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.2 | 3 | 174.7 | -69.5 | 170.2 | -179 | 0 | 0 | 113.5 | Q335 K336 F337 S341 | Q335-E339 PolarHBondContact NE2-OE1 2.77Å; Q335-E339 WeakPolarHBondContact O-CG 3.29Å; Q335-E339 PolarHBondContact O-N 3.46Å; K336-E339 IonicContact NZ-OE2 3.7Å; K336-E339 PolarHBondContact NZ-OE2 3.27Å; K336-E339 WeakPolarHBondContact O-CB 3.47Å; K336-E339 PolarHBondContact O-N 2.95Å; K336-E339 VanDerWaalsContact O-N 3.07Å; F337-E339 VanDerWaalsContact C-N 3.28Å; F337-E339 PolarHBondContact O-N 3.2Å; E339-S341 VanDerWaalsContact C-N 3.31Å; E339-S341 PolarHBondContact O-N 3.08Å |
| 340 | K | 64 | Low | 77.5 | Confident | 141 Ų | 141 | 74.4 Ų | 74.4 | 61% | 0.613 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.2 | 39 | 171.5 | -64.9 | -172.7 | 177.8 | -178.2 | 0 | 115.5 | F337 M338 D342 | F337-K340 PolarHBondContact O-N 2.99Å; M338-K340 PolarHBondContact O-N 3.38Å; K340-D342 PolarHBondContact O-N 3.33Å |
| 341 | S | 60.1 | Low | 77.1 | Confident | 46 Ų | 46 | 74.9 Ų | 74.9 | 32% | 0.322 | 39% | 0.388 | S | S | . | . | trans | -87.3 | 98.8 | 167.3 | 14.5 | 0 | 0 | 0 | 0 | 109.4 | E339 D343 L344 | E339-S341 VanDerWaalsContact C-N 3.31Å; E339-S341 PolarHBondContact O-N 3.08Å; S341-D343 PolarHBondContact O-N 3.31Å; S341-D343 VanDerWaalsContact O-N 3.12Å; S341-L344 WeakPolarHBondContact O-CB 3.33Å; S341-L344 WeakPolarHBondContact O-CD1 3.36Å; S341-L344 WeakPolarHBondContact O-CG 3.38Å; S341-L344 PolarHBondContact O-N 2.88Å; S341-L344 WeakPolarHBondContact OG-CG 3.41Å | ||
| 342 | D | 62 | Low | 76.9 | Confident | 112 Ų | 112 | 74.2 Ų | 74.2 | 60% | 0.599 | 39% | 0.385 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -19.2 | 177.1 | -72.2 | -40.5 | 0 | 0 | 0 | 112.3 | K286 K340 L344 | K286-D342 PolarHBondContact NZ-O 3.44Å; K340-D342 PolarHBondContact O-N 3.33Å; D342-L344 VanDerWaalsContact C-N 3.33Å; D342-L344 PolarHBondContact O-N 3.35Å |
| 343 | D | 61.5 | Low | 76.8 | Confident | 149 Ų | 149 | 71.6 Ų | 71.6 | 80% | 0.797 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.3 | 1.5 | 174.2 | -55.4 | -54.8 | 0 | 0 | 0 | 114.8 | S341 S345 | S341-D343 PolarHBondContact O-N 3.31Å; S341-D343 VanDerWaalsContact O-N 3.12Å; D343-S345 PolarHBondContact O-N 3.01Å |
| 344 | L | 65.7 | Low | 76.9 | Confident | 28 Ų | 28 | 73.1 Ų | 73.1 | 15% | 0.147 | 38% | 0.38 | C | S | . | . | trans | -58.8 | 109.4 | -178.3 | -79 | 165.6 | 0 | 0 | 0 | 112.6 | K286 K336 S341 D342 | K286-L344 PolarHBondContact NZ-O 3.17Å; K336-L344 VanDerWaalsContact C-CD1 3.49Å; K336-L344 HydrophobicContact CB-CD1 3.98Å; K336-L344 HydrophobicContact CB-CD2 4.14Å; K336-L344 HydrophobicContact CD-CD2 3.85Å; K336-L344 HydrophobicContact CG-CD2 4.43Å; K336-L344 VanDerWaalsContact O-CD1 3.23Å; K336-L344 WeakPolarHBondContact O-CD1 3.4Å; S341-L344 WeakPolarHBondContact O-CB 3.33Å; S341-L344 WeakPolarHBondContact O-CD1 3.36Å; S341-L344 WeakPolarHBondContact O-CG 3.38Å; S341-L344 PolarHBondContact O-N 2.88Å; S341-L344 WeakPolarHBondContact OG-CG 3.41Å; D342-L344 VanDerWaalsContact C-N 3.33Å; D342-L344 PolarHBondContact O-N 3.35Å | ||
| 345 | S | 71.3 | Confident | 77 | Confident | 55 Ų | 55 | 70.4 Ų | 70.4 | 39% | 0.385 | 37% | 0.368 | S | S | . | . | trans | -91.8 | 117.3 | 165.2 | -60.3 | 0 | 0 | 0 | 0 | 108.6 | D343 D347 D348 | D343-S345 PolarHBondContact O-N 3.01Å; S345-D347 PolarHBondContact O-N 3.44Å; S345-D348 WeakPolarHBondContact CB-OD2 3.36Å; S345-D348 PolarHBondContact O-N 3.04Å; S345-D348 VanDerWaalsContact O-N 3.15Å | ||
| 346 | L | 75.9 | Confident | 77.2 | Confident | 10 Ų | 10 | 65.7 Ų | 65.7 | 5% | 0.052 | 35% | 0.345 | C | S | . | . | G | 310 helix | trans | -61.2 | -25.2 | 174.6 | -77.1 | 171.6 | 0 | 0 | 0 | 111.9 | F290 I333 F337 D348 L349 V356 | F290-L346 HydrophobicContact CB-CB 4.21Å; F290-L346 HydrophobicContact CB-CD1 3.75Å; F290-L346 HydrophobicContact CD2-CB 3.48Å; F290-L346 VanDerWaalsContact CD2-CB 3.48Å; F290-L346 HydrophobicContact CE2-CB 3.93Å; F290-L346 HydrophobicContact CG-CB 3.83Å; F290-L346 HydrophobicContact CG-CD1 4.02Å; I333-L346 HydrophobicContact CG1-CD2 4.24Å; I333-L346 HydrophobicContact CG2-CD2 4.23Å; F337-L346 HydrophobicContact CE2-CD2 4.14Å; F337-L346 HydrophobicContact CE2-CG 4.5Å; L346-D348 VanDerWaalsContact C-N 3.27Å; L346-D348 PolarHBondContact O-N 3.25Å; L346-L349 HydrophobicContact CD2-CD1 4.23Å; L346-L349 PolarHBondContact O-N 3.45Å; L346-V356 HydrophobicContact CD1-CG1 4.1Å; L346-V356 HydrophobicContact CD1-CG2 4.46Å |
| 347 | D | 72.9 | Confident | 77.5 | Confident | 55 Ų | 55 | 62.7 Ų | 62.7 | 29% | 0.294 | 33% | 0.332 | S | S | . | . | G | 310 helix | trans | -57.2 | -32.5 | 173.7 | -61.9 | -71 | 0 | 0 | 0 | 113.5 | R293 K297 S345 L349 | R293-D347 IonicContact NH1-OD2 2.87Å; R293-D347 PolarHBondContact NH1-OD2 3.32Å; K297-D347 WeakPolarHBondContact CE-OD1 3.37Å; K297-D347 IonicContact NZ-OD1 3.14Å; K297-D347 PolarHBondContact NZ-OD1 3.23Å; S345-D347 PolarHBondContact O-N 3.44Å; D347-L349 VanDerWaalsContact C-N 3.28Å; D347-L349 PolarHBondContact O-N 3Å |
| 348 | D | 75.5 | Confident | 77.9 | Confident | 136 Ų | 136 | 61 Ų | 61 | 73% | 0.727 | 33% | 0.325 | S | S | * | . | G | 310 helix | trans | -75.2 | -13.6 | -178.3 | -66.1 | -32.7 | 0 | 0 | 0 | 113.9 | S345 L346 | S345-D348 WeakPolarHBondContact CB-OD2 3.36Å; S345-D348 PolarHBondContact O-N 3.04Å; S345-D348 VanDerWaalsContact O-N 3.15Å; L346-D348 VanDerWaalsContact C-N 3.27Å; L346-D348 PolarHBondContact O-N 3.25Å |
| 349 | L | 76.7 | Confident | 78.5 | Confident | 52 Ų | 52 | 54.6 Ų | 54.6 | 27% | 0.272 | 29% | 0.294 | S | S | . | . | G | 310 helix | trans | -95.1 | -7.1 | -171.1 | -63.6 | 170.9 | 0 | 0 | 0 | 114 | L346 D347 I351 | L346-L349 HydrophobicContact CD2-CD1 4.23Å; L346-L349 PolarHBondContact O-N 3.45Å; D347-L349 VanDerWaalsContact C-N 3.28Å; D347-L349 PolarHBondContact O-N 3Å; L349-I351 VanDerWaalsContact C-N 3.32Å; L349-I351 HydrophobicContact CB-CD1 3.63Å; L349-I351 HydrophobicContact CB-CG1 3.69Å; L349-I351 HydrophobicContact CD1-CD1 3.96Å; L349-I351 HydrophobicContact CG-CD1 4.4Å; L349-I351 WeakPolarHBondContact O-CG1 3.22Å; L349-I351 PolarHBondContact O-N 3.11Å |
| 350 | D | 81.1 | Confident | 79.2 | Confident | 150 Ų | 150 | 50.3 Ų | 50.3 | 80% | 0.802 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.1 | 48.9 | -174.6 | -166.1 | 25.7 | 0 | 0 | 0 | 112.9 | ||
| 351 | I | 83.3 | Confident | 80.5 | Confident | 9 Ų | 9 | 44.8 Ų | 44.8 | 5% | 0.046 | 25% | 0.25 | C | C | . | . | trans | -103.5 | 127.6 | -175.8 | -63.6 | 179.9 | 0 | 0 | 0 | 110.9 | Q329 L332 I333 L349 A355 V356 | Q329-I351 HydrophobicContact CB-CD1 4.42Å; Q329-I351 HydrophobicContact CB-CG2 4.09Å; Q329-I351 HydrophobicContact CG-CG1 4.46Å; L332-I351 HydrophobicContact CD2-CD1 4.41Å; I333-I351 HydrophobicContact CD1-CD1 4.22Å; I333-I351 HydrophobicContact CD1-CG2 4.02Å; I333-I351 HydrophobicContact CG1-CD1 3.71Å; L349-I351 VanDerWaalsContact C-N 3.32Å; L349-I351 HydrophobicContact CB-CD1 3.63Å; L349-I351 HydrophobicContact CB-CG1 3.69Å; L349-I351 HydrophobicContact CD1-CD1 3.96Å; L349-I351 HydrophobicContact CG-CD1 4.4Å; L349-I351 WeakPolarHBondContact O-CG1 3.22Å; L349-I351 PolarHBondContact O-N 3.11Å; I351-A355 HydrophobicContact CG2-CB 3.54Å; I351-V356 HydrophobicContact CG2-CG2 4.32Å | ||
| 352 | P | 85.8 | Confident | 82 | Confident | 66 Ų | 66 | 45 Ų | 45 | 43% | 0.429 | 25% | 0.248 | S | C | . | . | trans | -65.3 | 144.8 | 177.4 | 26.8 | -35.6 | 0 | 0 | 0 | 112.5 | N354 A355 | P352-N354 PolarHBondContact O-N 2.89Å; P352-A355 WeakPolarHBondContact O-CB 3.15Å; P352-A355 PolarHBondContact O-N 3.11Å | ||
| 353 | V | 88.3 | Confident | 83.4 | Confident | 10 Ų | 10 | 40.2 Ų | 40.2 | 6% | 0.061 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -52.3 | -30.2 | -179.2 | -163.7 | 0 | 0 | 0 | 0 | 113.5 | F290 I291 E294 L320 A355 V356 T357 | F290-V353 HydrophobicContact CE1-CG2 4.38Å; I291-V353 HydrophobicContact CB-CG1 4.2Å; I291-V353 HydrophobicContact CG1-CG1 3.82Å; I291-V353 HydrophobicContact CG2-CG1 3.97Å; E294-V353 HydrophobicContact CB-CG2 4.04Å; E294-V353 HydrophobicContact CG-CG2 3.61Å; L320-V353 HydrophobicContact CD2-CB 4.11Å; L320-V353 HydrophobicContact CD2-CG1 3.59Å; V353-A355 VanDerWaalsContact C-N 3.29Å; V353-A355 PolarHBondContact O-N 2.81Å; V353-V356 PolarHBondContact O-N 2.97Å; V353-T357 HydrophobicContact CG1-CG2 4.34Å; V353-T357 PolarHBondContact O-N 3.48Å; V353-T357 PolarHBondContact O-OG1 3.48Å |
| 354 | N | 89.5 | Confident | 84.8 | Confident | 32 Ų | 32 | 33.2 Ų | 33.2 | 17% | 0.171 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -63.8 | -28.9 | 175 | -72.9 | -27.6 | 0 | 0 | 0 | 113.6 | T317 G325 P352 T357 T358 | T317-N354 WeakPolarHBondContact CG2-ND2 3.47Å; T317-N354 WeakPolarHBondContact CG2-OD1 3.3Å; G325-N354 WeakPolarHBondContact CA-O 3.26Å; G325-N354 PolarHBondContact N-O 3.46Å; G325-N354 VanDerWaalsContact N-O 3.17Å; P352-N354 PolarHBondContact O-N 2.89Å; N354-T357 WeakPolarHBondContact CA-OG1 3.13Å; N354-T357 PolarHBondContact O-OG1 3.05Å; N354-T358 VanDerWaalsContact O-CB 3.32Å; N354-T358 WeakPolarHBondContact O-CB 3.39Å; N354-T358 PolarHBondContact O-N 3.33Å; N354-T358 PolarHBondContact O-OG1 2.88Å |
| 355 | A | 89.9 | Confident | 85.9 | Confident | 0 Ų | 0 | 33.7 Ų | 33.7 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -77.5 | -41.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q329 V330 I333 I351 P352 V353 T358 A359 | Q329-A355 HydrophobicContact CB-CB 3.98Å; V330-A355 HydrophobicContact CG2-CB 4.12Å; I333-A355 HydrophobicContact CD1-CB 4.44Å; I351-A355 HydrophobicContact CG2-CB 3.54Å; P352-A355 WeakPolarHBondContact O-CB 3.15Å; P352-A355 PolarHBondContact O-N 3.11Å; V353-A355 VanDerWaalsContact C-N 3.29Å; V353-A355 PolarHBondContact O-N 2.81Å; A355-T358 CarbonylContact O-C 3.48Å; A355-T358 WeakPolarHBondContact O-CA 3.19Å; A355-T358 PolarHBondContact O-N 2.94Å; A355-A359 PolarHBondContact O-N 3.31Å |
| 356 | V | 90.7 | Very high | 86.7 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -63.2 | -46.4 | 176.6 | -177.5 | 0 | 0 | 0 | 0 | 111.7 | C287 F290 I291 I333 L346 I351 V353 T358 A359 L360 | C287-V356 HydrophobicContact CB-CG1 3.82Å; F290-V356 HydrophobicContact CD1-CB 4.15Å; F290-V356 HydrophobicContact CD1-CG1 4.1Å; F290-V356 HydrophobicContact CD1-CG2 3.71Å; F290-V356 HydrophobicContact CE1-CB 4.4Å; F290-V356 HydrophobicContact CE1-CG2 3.66Å; I291-V356 HydrophobicContact CD1-CG1 4.12Å; I291-V356 HydrophobicContact CG1-CB 4.48Å; I291-V356 HydrophobicContact CG1-CG1 4.04Å; I333-V356 HydrophobicContact CD1-CG2 3.88Å; L346-V356 HydrophobicContact CD1-CG1 4.1Å; L346-V356 HydrophobicContact CD1-CG2 4.46Å; I351-V356 HydrophobicContact CG2-CG2 4.32Å; V353-V356 PolarHBondContact O-N 2.97Å; V356-T358 PolarHBondContact O-N 3.46Å; V356-A359 PolarHBondContact O-N 2.99Å; V356-L360 WeakPolarHBondContact O-CB 3.45Å; V356-L360 PolarHBondContact O-N 3.22Å |
| 357 | T | 91.9 | Very high | 87.2 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -63.3 | -23.3 | 172.5 | 51 | 0 | 0 | 0 | 0 | 113.6 | I291 L320 Y321 V353 N354 K361 | I291-T357 HydrophobicContact CD1-CG2 3.58Å; I291-T357 HydrophobicContact CG1-CG2 4Å; I291-T357 HydrophobicContact CG2-CG2 4.43Å; L320-T357 HydrophobicContact CD2-CG2 4.09Å; Y321-T357 HydrophobicContact CD1-CG2 4.26Å; Y321-T357 HydrophobicContact CD2-CG2 4.43Å; Y321-T357 HydrophobicContact CE1-CG2 3.91Å; Y321-T357 HydrophobicContact CE2-CG2 4.07Å; V353-T357 HydrophobicContact CG1-CG2 4.34Å; V353-T357 PolarHBondContact O-N 3.48Å; V353-T357 PolarHBondContact O-OG1 3.48Å; N354-T357 WeakPolarHBondContact CA-OG1 3.13Å; N354-T357 PolarHBondContact O-OG1 3.05Å; T357-K361 WeakPolarHBondContact O-CE 3.44Å; T357-K361 WeakPolarHBondContact O-CG 3.43Å; T357-K361 PolarHBondContact O-N 3.3Å |
| 358 | T | 92.4 | Very high | 87.6 | Confident | 5 Ų | 5 | 39 Ų | 39 | 3% | 0.031 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -81.2 | -42.9 | 174.1 | -61.2 | 0 | 0 | 0 | 0 | 111.7 | G325 V330 N354 A355 V356 L360 K361 N362 | G325-T358 PolarHBondContact N-OG1 3.14Å; V330-T358 HydrophobicContact CG1-CG2 4.44Å; V330-T358 HydrophobicContact CG2-CG2 3.78Å; N354-T358 VanDerWaalsContact O-CB 3.32Å; N354-T358 WeakPolarHBondContact O-CB 3.39Å; N354-T358 PolarHBondContact O-N 3.33Å; N354-T358 PolarHBondContact O-OG1 2.88Å; A355-T358 CarbonylContact O-C 3.48Å; A355-T358 WeakPolarHBondContact O-CA 3.19Å; A355-T358 PolarHBondContact O-N 2.94Å; V356-T358 PolarHBondContact O-N 3.46Å; T358-L360 VanDerWaalsContact C-N 3.27Å; T358-L360 PolarHBondContact O-N 3.01Å; T358-K361 PolarHBondContact O-N 3.39Å; T358-N362 PolarHBondContact O-N 3.08Å; T358-N362 PolarHBondContact O-OD1 3.15Å |
| 359 | A | 92.1 | Very high | 87.9 | Confident | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.2 | -38.8 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | F283 V330 I333 A355 V356 N362 F363 | F283-A359 HydrophobicContact CZ-CB 4.13Å; V330-A359 HydrophobicContact CG1-CB 4.06Å; I333-A359 HydrophobicContact CB-CB 4.29Å; I333-A359 HydrophobicContact CD1-CB 4.09Å; I333-A359 HydrophobicContact CG2-CB 4.08Å; A355-A359 PolarHBondContact O-N 3.31Å; V356-A359 PolarHBondContact O-N 2.99Å; A359-N362 WeakPolarHBondContact O-CB 3.39Å; A359-N362 PolarHBondContact O-N 2.86Å; A359-F363 PolarHBondContact O-N 3.3Å |
| 360 | L | 92.6 | Very high | 88.2 | Confident | 0 Ų | 0 | 34.4 Ų | 34.4 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -65.8 | -39.1 | 175.5 | -172 | 56.2 | 0 | 0 | 0 | 112.9 | F283 V284 C287 V288 I291 Y321 V356 T358 F364 F414 | F283-L360 HydrophobicContact CD1-CD1 4.45Å; F283-L360 HydrophobicContact CE1-CD1 4.18Å; V284-L360 HydrophobicContact CB-CD1 4.37Å; V284-L360 HydrophobicContact CG1-CD1 4.29Å; V284-L360 HydrophobicContact CG2-CD1 4.07Å; C287-L360 HydrophobicContact CB-CB 4.45Å; C287-L360 HydrophobicContact CB-CD1 4.24Å; C287-L360 HydrophobicContact CB-CD2 4.19Å; V288-L360 HydrophobicContact CG2-CD2 4.1Å; I291-L360 HydrophobicContact CD1-CD2 4.07Å; Y321-L360 HydrophobicContact CE1-CD2 4.44Å; V356-L360 WeakPolarHBondContact O-CB 3.45Å; V356-L360 PolarHBondContact O-N 3.22Å; T358-L360 VanDerWaalsContact C-N 3.27Å; T358-L360 PolarHBondContact O-N 3.01Å; L360-F364 HydrophobicContact CD1-CD2 4.38Å; L360-F364 HydrophobicContact CD1-CE2 3.71Å; L360-F364 HydrophobicContact CD1-CZ 4.31Å; L360-F364 HydrophobicContact CG-CD2 4.48Å; L360-F364 HydrophobicContact CG-CE2 4.01Å; L360-F364 WeakPolarHBondContact O-CD2 3.43Å; L360-F364 PolarHBondContact O-N 3.05Å; L360-F414 HydrophobicContact CD2-CD2 4.3Å; L360-F414 HydrophobicContact CD2-CE2 3.84Å; L360-F414 HydrophobicContact CG-CE2 4.17Å |
| 361 | K | 92.2 | Very high | 88.3 | Confident | 25 Ų | 25 | 27.5 Ų | 27.5 | 11% | 0.109 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -66.5 | -40.8 | 170.3 | -75.7 | -179.8 | -64 | 175.9 | 0 | 112.3 | Y321 T357 T358 F364 A365 L439 T442 | Y321-K361 HydrophobicContact CD1-CD 4.1Å; Y321-K361 HydrophobicContact CD1-CG 3.99Å; Y321-K361 PolarHBondContact O-NZ 2.87Å; T357-K361 WeakPolarHBondContact O-CE 3.44Å; T357-K361 WeakPolarHBondContact O-CG 3.43Å; T357-K361 PolarHBondContact O-N 3.3Å; T358-K361 PolarHBondContact O-N 3.39Å; K361-F364 PolarHBondContact O-N 2.93Å; K361-A365 WeakPolarHBondContact O-CB 3.28Å; K361-A365 PolarHBondContact O-N 2.99Å; K361-L439 HydrophobicContact CD-CD2 3.8Å; K361-L439 HydrophobicContact CG-CD2 3.73Å; K361-T442 WeakPolarHBondContact O-CG2 3.39Å |
| 362 | N | 91.6 | Very high | 88.3 | Confident | 52 Ų | 52 | 27.3 Ų | 27.3 | 28% | 0.278 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -60.4 | -44.6 | 177.6 | -79.5 | 9.2 | 0 | 0 | 0 | 111.3 | V330 E334 T358 A359 F364 A365 S366 | V330-N362 WeakPolarHBondContact CG1-ND2 3.5Å; E334-N362 WeakPolarHBondContact OE1-CB 3.45Å; E334-N362 PolarHBondContact OE1-ND2 3.01Å; T358-N362 PolarHBondContact O-N 3.08Å; T358-N362 PolarHBondContact O-OD1 3.15Å; A359-N362 WeakPolarHBondContact O-CB 3.39Å; A359-N362 PolarHBondContact O-N 2.86Å; N362-F364 PolarHBondContact O-N 3.35Å; N362-A365 CarbonylContact O-C 3.38Å; N362-A365 WeakPolarHBondContact O-CA 3.5Å; N362-A365 WeakPolarHBondContact O-CB 3.28Å; N362-A365 PolarHBondContact O-N 3.16Å; N362-A365 VanDerWaalsContact O-N 3.08Å; N362-S366 WeakPolarHBondContact O-CB 3.33Å; N362-S366 PolarHBondContact O-N 3.04Å; N362-S366 PolarHBondContact O-OG 2.98Å |
| 363 | F | 91.2 | Very high | 88.1 | Confident | 11 Ų | 11 | 25 Ų | 25 | 5% | 0.048 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -55.3 | -52.8 | 176.1 | 176.6 | -99 | 0 | 0 | 0 | 112 | F91 P281 F283 V284 A359 A365 S366 L367 | F91-F363 AromaticContact CD1-CE2 3.9Å; F91-F363 HydrophobicContact CD1-CE2 3.9Å; F91-F363 HydrophobicContact CD2-CE2 4.35Å; F91-F363 HydrophobicContact CE1-CD2 4.1Å; F91-F363 AromaticContact CE1-CE2 3.93Å; F91-F363 HydrophobicContact CE1-CE2 3.93Å; F91-F363 HydrophobicContact CE2-CD2 4.44Å; F91-F363 HydrophobicContact CE2-CE2 4.37Å; F91-F363 HydrophobicContact CG-CE2 4.12Å; F91-F363 HydrophobicContact CZ-CD2 4.05Å; F91-F363 HydrophobicContact CZ-CE2 4.17Å; P281-F363 HydrophobicContact CB-CZ 4.12Å; P281-F363 HydrophobicContact CG-CE1 4.44Å; P281-F363 HydrophobicContact CG-CZ 4.17Å; F283-F363 HydrophobicContact CD1-CB 3.92Å; F283-F363 HydrophobicContact CD1-CD1 4.04Å; F283-F363 AromaticContact CD1-CD2 3.77Å; F283-F363 HydrophobicContact CD1-CD2 3.77Å; F283-F363 HydrophobicContact CD1-CE2 4.3Å; F283-F363 AromaticContact CD1-CG 3.63Å; F283-F363 HydrophobicContact CD1-CG 3.63Å; F283-F363 HydrophobicContact CE1-CB 3.41Å; F283-F363 VanDerWaalsContact CE1-CB 3.41Å; F283-F363 HydrophobicContact CE1-CD1 4.34Å; F283-F363 HydrophobicContact CE1-CD2 4.07Å; F283-F363 AromaticContact CE1-CG 3.69Å; F283-F363 HydrophobicContact CE1-CG 3.69Å; F283-F363 HydrophobicContact CG-CD2 4.33Å; F283-F363 HydrophobicContact CZ-CB 4.19Å; V284-F363 HydrophobicContact CG2-CD1 3.8Å; V284-F363 HydrophobicContact CG2-CE1 3.47Å; V284-F363 VanDerWaalsContact CG2-CE1 3.47Å; V284-F363 HydrophobicContact CG2-CZ 4.31Å; A359-F363 PolarHBondContact O-N 3.3Å; F363-A365 PolarHBondContact O-N 3.24Å; F363-S366 PolarHBondContact O-N 3.2Å; F363-S366 VanDerWaalsContact O-N 3.1Å; F363-S366 PolarHBondContact O-OG 3.05Å; F363-S366 VanDerWaalsContact O-OG 3.11Å; F363-L367 HydrophobicContact CE1-CD2 4.14Å; F363-L367 HydrophobicContact CE2-CD2 4.33Å; F363-L367 HydrophobicContact CZ-CD2 3.93Å; F363-L367 WeakPolarHBondContact O-CG 3.26Å; F363-L367 PolarHBondContact O-N 3.31Å; F363-L367 VanDerWaalsContact O-N 3.08Å |
| 364 | F | 90.9 | Very high | 87.7 | Confident | 1 Ų | 1 | 27.7 Ų | 27.7 | 0% | 0.004 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -65.2 | -26.5 | 176.3 | -66.9 | -57.6 | 0 | 0 | 0 | 113.5 | V284 L360 K361 N362 L367 L371 T410 F414 T442 R445 | V284-F364 HydrophobicContact CG1-CZ 4.14Å; V284-F364 HydrophobicContact CG2-CE1 4.25Å; V284-F364 HydrophobicContact CG2-CZ 3.89Å; L360-F364 HydrophobicContact CD1-CD2 4.38Å; L360-F364 HydrophobicContact CD1-CE2 3.71Å; L360-F364 HydrophobicContact CD1-CZ 4.31Å; L360-F364 HydrophobicContact CG-CD2 4.48Å; L360-F364 HydrophobicContact CG-CE2 4.01Å; L360-F364 WeakPolarHBondContact O-CD2 3.43Å; L360-F364 PolarHBondContact O-N 3.05Å; K361-F364 PolarHBondContact O-N 2.93Å; N362-F364 PolarHBondContact O-N 3.35Å; F364-L367 HydrophobicContact CD1-CD1 4.02Å; F364-L371 HydrophobicContact CD1-CD2 3.99Å; F364-L371 HydrophobicContact CE1-CD2 3.79Å; F364-L371 HydrophobicContact CZ-CD2 4.46Å; F364-T410 HydrophobicContact CE1-CG2 3.91Å; F364-T410 HydrophobicContact CZ-CG2 4.32Å; F364-F414 HydrophobicContact CD2-CD1 4.42Å; F364-F414 HydrophobicContact CD2-CE1 4.13Å; F364-F414 HydrophobicContact CD2-CZ 4.2Å; F364-F414 HydrophobicContact CE2-CB 4.49Å; F364-F414 AromaticContact CE2-CD1 3.83Å; F364-F414 HydrophobicContact CE2-CD1 3.83Å; F364-F414 AromaticContact CE2-CD2 3.75Å; F364-F414 HydrophobicContact CE2-CD2 3.75Å; F364-F414 AromaticContact CE2-CE1 3.88Å; F364-F414 HydrophobicContact CE2-CE1 3.88Å; F364-F414 AromaticContact CE2-CE2 3.83Å; F364-F414 HydrophobicContact CE2-CE2 3.83Å; F364-F414 AromaticContact CE2-CG 3.76Å; F364-F414 HydrophobicContact CE2-CG 3.76Å; F364-F414 AromaticContact CE2-CZ 3.89Å; F364-F414 HydrophobicContact CE2-CZ 3.89Å; F364-F414 HydrophobicContact CZ-CB 4.2Å; F364-F414 HydrophobicContact CZ-CD1 4.2Å; F364-F414 HydrophobicContact CZ-CD2 4.23Å; F364-F414 AromaticContact CZ-CG 3.96Å; F364-F414 HydrophobicContact CZ-CG 3.96Å; F364-T442 HydrophobicContact CB-CG2 3.6Å; F364-R445 PolarHBondContact O-NH1 3.12Å |
| 365 | A | 88.7 | Confident | 87.4 | Confident | 38 Ų | 38 | 29.9 Ų | 29.9 | 31% | 0.314 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -77.2 | -25 | 173 | 0 | 0 | 0 | 0 | 0 | 113.6 | K361 N362 F363 T442 R445 | K361-A365 WeakPolarHBondContact O-CB 3.28Å; K361-A365 PolarHBondContact O-N 2.99Å; N362-A365 CarbonylContact O-C 3.38Å; N362-A365 WeakPolarHBondContact O-CA 3.5Å; N362-A365 WeakPolarHBondContact O-CB 3.28Å; N362-A365 PolarHBondContact O-N 3.16Å; N362-A365 VanDerWaalsContact O-N 3.08Å; F363-A365 PolarHBondContact O-N 3.24Å; A365-T442 HydrophobicContact CB-CG2 4.37Å; A365-R445 PolarHBondContact O-NH1 2.85Å |
| 366 | S | 87 | Confident | 87.2 | Confident | 61 Ų | 61 | 30.9 Ų | 30.9 | 43% | 0.427 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -97 | -13.5 | -177.6 | 66.7 | 0 | 0 | 0 | 0 | 114.7 | N362 F363 S368 | N362-S366 WeakPolarHBondContact O-CB 3.33Å; N362-S366 PolarHBondContact O-N 3.04Å; N362-S366 PolarHBondContact O-OG 2.98Å; F363-S366 PolarHBondContact O-N 3.2Å; F363-S366 VanDerWaalsContact O-N 3.1Å; F363-S366 PolarHBondContact O-OG 3.05Å; F363-S366 VanDerWaalsContact O-OG 3.11Å; S366-S368 PolarHBondContact O-N 3.26Å |
| 367 | L | 86.2 | Confident | 87 | Confident | 42 Ų | 42 | 32.6 Ų | 32.6 | 22% | 0.22 | 21% | 0.205 | C | C | . | . | S | Bend | trans | -49 | 139.8 | 167.9 | -66.5 | -179.2 | 0 | 0 | 0 | 110.9 | F363 F364 E369 R445 | F363-L367 HydrophobicContact CE1-CD2 4.14Å; F363-L367 HydrophobicContact CE2-CD2 4.33Å; F363-L367 HydrophobicContact CZ-CD2 3.93Å; F363-L367 WeakPolarHBondContact O-CG 3.26Å; F363-L367 PolarHBondContact O-N 3.31Å; F363-L367 VanDerWaalsContact O-N 3.08Å; F364-L367 HydrophobicContact CD1-CD1 4.02Å; L367-E369 VanDerWaalsContact CB-O 3.29Å; L367-E369 WeakPolarHBondContact CB-O 3.49Å; L367-R445 VanDerWaalsContact O-CZ 3.22Å; L367-R445 PolarHBondContact O-NH1 3.28Å; L367-R445 PolarHBondContact O-NH2 3.4Å |
| 368 | S | 81.3 | Confident | 86.7 | Confident | 129 Ų | 129 | 40 Ų | 40 | 90% | 0.902 | 24% | 0.236 | S | C | * | . | S | Bend | trans | -59.1 | -51.1 | -179.2 | 48.4 | 0 | 0 | 0 | 0 | 112.4 | S366 R445 | S366-S368 PolarHBondContact O-N 3.26Å; S368-R445 PolarHBondContact O-NH2 3.46Å; S368-R445 VanDerWaalsContact O-NH2 3.1Å |
| 369 | E | 82 | Confident | 86.7 | Confident | 86 Ų | 86 | 41.4 Ų | 41.4 | 40% | 0.402 | 25% | 0.246 | S | C | . | . | S | Bend | trans | -97 | 143.6 | 168.1 | -164.8 | 177.1 | -168.2 | 0 | 0 | 110.2 | L367 S373 | L367-E369 VanDerWaalsContact CB-O 3.29Å; L367-E369 WeakPolarHBondContact CB-O 3.49Å; E369-S373 WeakPolarHBondContact OE1-CA 3Å; E369-S373 WeakPolarHBondContact OE1-CB 3.41Å; E369-S373 PolarHBondContact OE1-OG 3.19Å |
| 370 | P | 83.7 | Confident | 86.6 | Confident | 5 Ų | 5 | 41.5 Ų | 41.5 | 3% | 0.032 | 25% | 0.246 | C | C | . | . | trans | -60.5 | 149 | 168 | 23.8 | -32.9 | 0 | 0 | 0 | 111.6 | V372 S373 C374 R445 | P370-V372 WeakPolarHBondContact CB-O 3.21Å; P370-V372 VanDerWaalsContact CG-O 3.31Å; P370-V372 WeakPolarHBondContact CG-O 3.49Å; P370-V372 CarbonylContact O-C 3.55Å; P370-V372 PolarHBondContact O-N 2.9Å; P370-V372 VanDerWaalsContact O-N 3.12Å; P370-S373 PolarHBondContact O-N 2.93Å; P370-C374 WeakPolarHBondContact CG-SG 3.49Å; P370-R445 HydrophobicContact CB-CB 4.12Å; P370-R445 HydrophobicContact CB-CG 3.99Å | ||
| 371 | L | 82.9 | Confident | 86.5 | Confident | 5 Ų | 5 | 42.7 Ų | 42.7 | 3% | 0.026 | 25% | 0.252 | C | S | . | . | S | Bend | trans | -56.4 | -32.4 | 179.8 | -173.3 | 62 | 0 | 0 | 0 | 112.2 | F364 N407 T410 L411 L443 | F364-L371 HydrophobicContact CD1-CD2 3.99Å; F364-L371 HydrophobicContact CE1-CD2 3.79Å; F364-L371 HydrophobicContact CZ-CD2 4.46Å; L371-N407 HydrophobicContact CD1-CB 4.21Å; L371-T410 HydrophobicContact CD1-CG2 4.11Å; L371-L411 HydrophobicContact CD1-CB 4.49Å; L371-L411 HydrophobicContact CD2-CB 4.01Å; L371-L411 HydrophobicContact CD2-CD1 3.82Å; L371-L411 HydrophobicContact CG-CB 4.1Å; L371-L411 HydrophobicContact CG-CD1 4.25Å; L371-L443 HydrophobicContact CD2-CD2 3.94Å |
| 372 | V | 83.1 | Confident | 86.4 | Confident | 6 Ų | 6 | 47.5 Ų | 47.5 | 4% | 0.036 | 28% | 0.275 | C | S | . | . | S | Bend | trans | -99.7 | 104.3 | 162.2 | -179.5 | 0 | 0 | 0 | 0 | 109 | P370 L380 L411 L443 | P370-V372 WeakPolarHBondContact CB-O 3.21Å; P370-V372 VanDerWaalsContact CG-O 3.31Å; P370-V372 WeakPolarHBondContact CG-O 3.49Å; P370-V372 CarbonylContact O-C 3.55Å; P370-V372 PolarHBondContact O-N 2.9Å; P370-V372 VanDerWaalsContact O-N 3.12Å; V372-L380 HydrophobicContact CG1-CD1 3.36Å; V372-L411 HydrophobicContact CG2-CD2 4.16Å; V372-L443 PolarHBondContact N-O 3.39Å |
| 373 | S | 81.3 | Confident | 86.5 | Confident | 16 Ų | 16 | 45.2 Ų | 45.2 | 11% | 0.112 | 26% | 0.264 | C | S | . | . | trans | -47.4 | 135.3 | -178.5 | 177.8 | 0 | 0 | 0 | 0 | 113.9 | E369 P370 A375 L376 | E369-S373 WeakPolarHBondContact OE1-CA 3Å; E369-S373 WeakPolarHBondContact OE1-CB 3.41Å; E369-S373 PolarHBondContact OE1-OG 3.19Å; P370-S373 PolarHBondContact O-N 2.93Å; S373-A375 PolarHBondContact O-N 3.4Å; S373-A375 VanDerWaalsContact O-N 3.07Å; S373-A375 PolarHBondContact OG-N 3.25Å; S373-L376 PolarHBondContact O-N 3.12Å | ||
| 374 | C | 80 | Confident | 86.5 | Confident | 68 Ų | 68 | 45.7 Ų | 45.7 | 46% | 0.459 | 27% | 0.266 | S | S | . | . | G | 310 helix | trans | -54.2 | -29.8 | 175.5 | -59 | 0 | 0 | 0 | 0 | 112.7 | P370 L376 Y377 | P370-C374 WeakPolarHBondContact CG-SG 3.49Å; C374-L376 VanDerWaalsContact C-N 3.29Å; C374-L376 PolarHBondContact O-N 3.4Å; C374-Y377 VanDerWaalsContact O-CB 3.24Å; C374-Y377 WeakPolarHBondContact O-CB 3.32Å; C374-Y377 PolarHBondContact O-N 2.95Å |
| 375 | A | 83.9 | Confident | 86.5 | Confident | 78 Ų | 78 | 50.1 Ų | 50.1 | 65% | 0.645 | 30% | 0.297 | S | S | * | . | G | 310 helix | trans | -67.7 | -27.2 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | S373 | S373-A375 PolarHBondContact O-N 3.4Å; S373-A375 VanDerWaalsContact O-N 3.07Å; S373-A375 PolarHBondContact OG-N 3.25Å |
| 376 | L | 86.3 | Confident | 86.7 | Confident | 20 Ų | 20 | 50.2 Ų | 50.2 | 11% | 0.105 | 29% | 0.293 | C | S | . | . | G | 310 helix | trans | -89.6 | -9.9 | 178.6 | -58.7 | -177.2 | 0 | 0 | 0 | 113 | S373 C374 K378 P379 L380 I399 R402 L403 | S373-L376 PolarHBondContact O-N 3.12Å; C374-L376 VanDerWaalsContact C-N 3.29Å; C374-L376 PolarHBondContact O-N 3.4Å; L376-K378 PolarHBondContact O-N 3.18Å; L376-P379 WeakPolarHBondContact O-CD 3.36Å; L376-L380 HydrophobicContact CB-CD1 4.38Å; L376-L380 VanDerWaalsContact O-CG 3.31Å; L376-L380 WeakPolarHBondContact O-CG 3.15Å; L376-L380 PolarHBondContact O-N 3.49Å; L376-I399 HydrophobicContact CB-CG2 4.13Å; L376-I399 HydrophobicContact CD1-CG2 4.43Å; L376-I399 HydrophobicContact CD2-CG2 4.28Å; L376-R402 HydrophobicContact CD1-CB 4.48Å; L376-R402 HydrophobicContact CD2-CB 4.24Å; L376-L403 HydrophobicContact CD1-CD2 3.59Å; L376-L403 HydrophobicContact CD1-CG 3.74Å |
| 377 | Y | 85.2 | Confident | 86.8 | Confident | 37 Ų | 37 | 55.5 Ų | 55.5 | 15% | 0.145 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -51.6 | -51.8 | -178.5 | -178.8 | -96.5 | 0 | 0 | 0 | 113.4 | C374 L380 I381 V444 P446 L461 | C374-Y377 VanDerWaalsContact O-CB 3.24Å; C374-Y377 WeakPolarHBondContact O-CB 3.32Å; C374-Y377 PolarHBondContact O-N 2.95Å; Y377-L380 PolarHBondContact O-N 3.49Å; Y377-I381 HydrophobicContact CD1-CG1 4.37Å; Y377-I381 HydrophobicContact CE1-CG1 3.9Å; Y377-I381 HydrophobicContact CE2-CG1 4.22Å; Y377-I381 WeakPolarHBondContact O-CG1 3.29Å; Y377-I381 PolarHBondContact O-N 3.43Å; Y377-V444 HydrophobicContact CD2-CG1 3.52Å; Y377-V444 HydrophobicContact CE2-CG1 3.74Å; Y377-P446 HydrophobicContact CD2-CB 4.36Å; Y377-P446 HydrophobicContact CE2-CB 3.6Å; Y377-L461 HydrophobicContact CE2-CD1 4.31Å; Y377-L461 HydrophobicContact CE2-CD2 3.7Å |
| 378 | K | 87 | Confident | 87.2 | Confident | 154 Ų | 154 | 59.1 Ų | 59.1 | 67% | 0.67 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -62.8 | -51.8 | -177.5 | -67.4 | 176.8 | -178.5 | 177.2 | 0 | 111.7 | L376 L380 I381 E382 | L376-K378 PolarHBondContact O-N 3.18Å; K378-L380 VanDerWaalsContact C-N 3.29Å; K378-L380 PolarHBondContact O-N 3.08Å; K378-I381 PolarHBondContact O-N 3.28Å; K378-E382 WeakPolarHBondContact O-CB 3.24Å; K378-E382 WeakPolarHBondContact O-CG 3.32Å; K378-E382 PolarHBondContact O-N 2.98Å |
| 379 | P | 90.8 | Very high | 87.6 | Confident | 35 Ų | 35 | 56.3 Ų | 56.3 | 23% | 0.227 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -52.1 | -38.7 | 170 | -30.4 | 34.4 | 0 | 0 | 0 | 115.4 | L376 E382 A383 I399 | L376-P379 WeakPolarHBondContact O-CD 3.36Å; P379-E382 PolarHBondContact O-N 3.27Å; P379-A383 WeakPolarHBondContact O-CB 3.44Å; P379-A383 PolarHBondContact O-N 3Å; P379-I399 HydrophobicContact CB-CD1 3.79Å; P379-I399 HydrophobicContact CB-CG1 4.01Å; P379-I399 HydrophobicContact CB-CG2 4.1Å; P379-I399 VanDerWaalsContact O-CD1 3.26Å; P379-I399 WeakPolarHBondContact O-CD1 3.4Å |
| 380 | L | 90.9 | Very high | 88 | Confident | 2 Ų | 2 | 58.5 Ų | 58.5 | 1% | 0.01 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -68.6 | -42 | 179.6 | -69.6 | 169.5 | 0 | 0 | 0 | 112 | V372 L376 Y377 K378 A383 M384 L396 I399 L400 L464 | V372-L380 HydrophobicContact CG1-CD1 3.36Å; L376-L380 HydrophobicContact CB-CD1 4.38Å; L376-L380 VanDerWaalsContact O-CG 3.31Å; L376-L380 WeakPolarHBondContact O-CG 3.15Å; L376-L380 PolarHBondContact O-N 3.49Å; Y377-L380 PolarHBondContact O-N 3.49Å; K378-L380 VanDerWaalsContact C-N 3.29Å; K378-L380 PolarHBondContact O-N 3.08Å; L380-A383 PolarHBondContact O-N 2.98Å; L380-M384 WeakPolarHBondContact O-CG 3.5Å; L380-M384 PolarHBondContact O-N 3.16Å; L380-L396 HydrophobicContact CD2-CD2 3.62Å; L380-I399 HydrophobicContact CD2-CB 4.09Å; L380-I399 HydrophobicContact CD2-CD1 4.36Å; L380-I399 HydrophobicContact CD2-CG2 3.64Å; L380-I399 HydrophobicContact CG-CG2 3.86Å; L380-L400 HydrophobicContact CD2-CD2 4.39Å; L380-L400 HydrophobicContact CD2-CG 4.36Å; L380-L464 HydrophobicContact CB-CD1 4.48Å; L380-L464 HydrophobicContact CB-CD2 4.12Å; L380-L464 HydrophobicContact CD1-CD2 4.49Å |
| 381 | I | 90 | Very high | 88.4 | Confident | 25 Ų | 25 | 62.3 Ų | 62.3 | 13% | 0.128 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -66.2 | -40.8 | 174.1 | -65.9 | -62.7 | 0 | 0 | 0 | 111.2 | Y377 K378 M384 S385 M457 T460 L461 | Y377-I381 HydrophobicContact CD1-CG1 4.37Å; Y377-I381 HydrophobicContact CE1-CG1 3.9Å; Y377-I381 HydrophobicContact CE2-CG1 4.22Å; Y377-I381 WeakPolarHBondContact O-CG1 3.29Å; Y377-I381 PolarHBondContact O-N 3.43Å; K378-I381 PolarHBondContact O-N 3.28Å; I381-M384 PolarHBondContact O-N 2.82Å; I381-S385 PolarHBondContact O-N 2.85Å; I381-M457 HydrophobicContact CD1-SD 4.41Å; I381-M457 HydrophobicContact CG2-CE 4.28Å; I381-M457 HydrophobicContact CG2-SD 3.86Å; I381-T460 HydrophobicContact CD1-CG2 3.74Å; I381-L461 HydrophobicContact CD1-CD2 3.94Å; I381-L461 HydrophobicContact CD1-CG 4.23Å |
| 382 | E | 90.7 | Very high | 88.9 | Confident | 126 Ų | 126 | 64.7 Ų | 64.7 | 59% | 0.589 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -60.2 | -44.8 | 173.7 | -73 | 165.2 | -154.5 | 0 | 0 | 111.4 | K378 P379 M384 S385 | K378-E382 WeakPolarHBondContact O-CB 3.24Å; K378-E382 WeakPolarHBondContact O-CG 3.32Å; K378-E382 PolarHBondContact O-N 2.98Å; P379-E382 PolarHBondContact O-N 3.27Å; E382-M384 VanDerWaalsContact C-N 3.33Å; E382-M384 PolarHBondContact O-N 2.91Å; E382-S385 WeakPolarHBondContact O-CB 3.4Å; E382-S385 PolarHBondContact O-N 3.26Å; E382-S385 PolarHBondContact O-OG 3.08Å |
| 383 | A | 92.5 | Very high | 89.3 | Confident | 5 Ų | 5 | 65.4 Ų | 65.4 | 4% | 0.041 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.4 | -36.5 | 175 | 0 | 0 | 0 | 0 | 0 | 112.7 | P379 L380 S385 I386 R392 L395 L396 I399 | P379-A383 WeakPolarHBondContact O-CB 3.44Å; P379-A383 PolarHBondContact O-N 3Å; L380-A383 PolarHBondContact O-N 2.98Å; A383-S385 PolarHBondContact O-N 3.02Å; A383-I386 WeakPolarHBondContact O-CB 3.39Å; A383-I386 PolarHBondContact O-N 3.34Å; A383-R392 WeakPolarHBondContact O-CG 3.22Å; A383-L395 HydrophobicContact CB-CB 4.19Å; A383-L396 HydrophobicContact CB-CD2 3.9Å; A383-L396 HydrophobicContact CB-CG 4.26Å; A383-I399 HydrophobicContact CB-CD1 3.8Å |
| 384 | M | 92.1 | Very high | 89.8 | Confident | 20 Ų | 20 | 72.9 Ų | 72.9 | 10% | 0.099 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -67.2 | -20.1 | 176 | -75.1 | -62.4 | -62.7 | 0 | 0 | 114 | L380 I381 E382 I386 R392 L396 T460 D463 L464 V467 | L380-M384 WeakPolarHBondContact O-CG 3.5Å; L380-M384 PolarHBondContact O-N 3.16Å; I381-M384 PolarHBondContact O-N 2.82Å; E382-M384 VanDerWaalsContact C-N 3.33Å; E382-M384 PolarHBondContact O-N 2.91Å; M384-I386 PolarHBondContact O-N 3.2Å; M384-R392 HydrophobicContact SD-CG 4.35Å; M384-L396 HydrophobicContact SD-CD1 4.17Å; M384-T460 HydrophobicContact CB-CG2 3.78Å; M384-T460 HydrophobicContact CG-CG2 4.45Å; M384-D463 HydrophobicContact CE-CB 3.98Å; M384-L464 HydrophobicContact CE-CB 4.38Å; M384-L464 HydrophobicContact CG-CB 4.02Å; M384-L464 HydrophobicContact CG-CD1 3.76Å; M384-L464 HydrophobicContact CG-CG 4.42Å; M384-L464 HydrophobicContact SD-CB 4.19Å; M384-L464 HydrophobicContact SD-CD1 3.9Å; M384-V467 HydrophobicContact CE-CG2 4.19Å; M384-V467 HydrophobicContact SD-CG2 4.43Å |
| 385 | S | 91 | Very high | 90.4 | Very high | 94 Ų | 94 | 72.5 Ų | 72.5 | 66% | 0.657 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.2 | -6.5 | 175.8 | 77 | 0 | 0 | 0 | 0 | 114.5 | I381 E382 A383 | I381-S385 PolarHBondContact O-N 2.85Å; E382-S385 WeakPolarHBondContact O-CB 3.4Å; E382-S385 PolarHBondContact O-N 3.26Å; E382-S385 PolarHBondContact O-OG 3.08Å; A383-S385 PolarHBondContact O-N 3.02Å |
| 386 | I | 92.8 | Very high | 90.8 | Very high | 41 Ų | 41 | 68.8 Ų | 68.8 | 21% | 0.21 | 34% | 0.336 | C | S | . | . | trans | -85.3 | 120.4 | -173.1 | -62.4 | 174.3 | 0 | 0 | 0 | 110.9 | A383 M384 K388 E391 R392 L395 | A383-I386 WeakPolarHBondContact O-CB 3.39Å; A383-I386 PolarHBondContact O-N 3.34Å; M384-I386 PolarHBondContact O-N 3.2Å; I386-K388 VanDerWaalsContact C-N 3.28Å; I386-K388 PolarHBondContact O-N 3.38Å; I386-E391 HydrophobicContact CG2-CB 4.14Å; I386-E391 HydrophobicContact CG2-CG 4.36Å; I386-R392 HydrophobicContact CB-CB 4.31Å; I386-L395 HydrophobicContact CD1-CD1 3.25Å | ||
| 387 | E | 90 | Very high | 91.1 | Very high | 172 Ų | 172 | 72.1 Ų | 72.1 | 80% | 0.804 | 35% | 0.347 | S | S | * | . | S | Bend | trans | -60.2 | -31.5 | -177.7 | -61.3 | -177 | 164.4 | 0 | 0 | 113.9 | ||
| 388 | K | 93.1 | Very high | 91.4 | Very high | 118 Ų | 118 | 74.7 Ų | 74.7 | 51% | 0.513 | 36% | 0.36 | S | S | . | . | trans | -85.9 | 121.6 | -177.3 | -53.1 | -162 | -151.3 | 96.5 | 0 | 111 | I386 D390 E391 R392 | I386-K388 VanDerWaalsContact C-N 3.28Å; I386-K388 PolarHBondContact O-N 3.38Å; K388-D390 PolarHBondContact O-N 3.47Å; K388-E391 HydrophobicContact CB-CB 3.94Å; K388-E391 IonicContact NZ-OE1 3.47Å; K388-E391 PolarHBondContact NZ-OE1 3.41Å; K388-E391 IonicContact NZ-OE2 2.6Å; K388-E391 PolarHBondContact NZ-OE2 3.41Å; K388-E391 PolarHBondContact O-N 3.03Å; K388-R392 WeakPolarHBondContact O-CB 3.25Å; K388-R392 PolarHBondContact O-N 2.96Å | ||
| 389 | P | 90 | Very high | 91.7 | Very high | 69 Ų | 69 | 68 Ų | 68 | 45% | 0.448 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.9 | -42.1 | -176.7 | 24.7 | -33.5 | 0 | 0 | 0 | 112.6 | E391 R392 T393 | P389-E391 VanDerWaalsContact C-N 3.34Å; P389-E391 PolarHBondContact O-N 3.07Å; P389-R392 PolarHBondContact O-N 3.13Å; P389-T393 VanDerWaalsContact O-CB 3.28Å; P389-T393 WeakPolarHBondContact O-CB 3.43Å; P389-T393 PolarHBondContact O-N 3.1Å; P389-T393 PolarHBondContact O-OG1 3.08Å |
| 390 | D | 91 | Very high | 91.7 | Very high | 132 Ų | 132 | 66.3 Ų | 66.3 | 71% | 0.706 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -65.6 | -38.1 | -177.6 | -46.8 | -51.4 | 0 | 0 | 0 | 112.5 | K388 R394 | K388-D390 PolarHBondContact O-N 3.47Å; D390-R394 VanDerWaalsContact O-CB 3.3Å; D390-R394 WeakPolarHBondContact O-CB 3.4Å; D390-R394 PolarHBondContact O-N 3.4Å |
| 391 | E | 92.5 | Very high | 91.6 | Very high | 85 Ų | 85 | 70.1 Ų | 70.1 | 40% | 0.397 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -73.3 | -41.2 | -179.1 | -161.2 | 164.4 | -133.9 | 0 | 0 | 110.7 | I386 K388 P389 R394 L395 | I386-E391 HydrophobicContact CG2-CB 4.14Å; I386-E391 HydrophobicContact CG2-CG 4.36Å; K388-E391 HydrophobicContact CB-CB 3.94Å; K388-E391 IonicContact NZ-OE1 3.47Å; K388-E391 PolarHBondContact NZ-OE1 3.41Å; K388-E391 IonicContact NZ-OE2 2.6Å; K388-E391 PolarHBondContact NZ-OE2 3.41Å; K388-E391 PolarHBondContact O-N 3.03Å; P389-E391 VanDerWaalsContact C-N 3.34Å; P389-E391 PolarHBondContact O-N 3.07Å; E391-R394 PolarHBondContact O-N 2.87Å; E391-L395 HydrophobicContact CG-CD1 4.49Å; E391-L395 WeakPolarHBondContact O-CB 3.41Å; E391-L395 WeakPolarHBondContact O-CG 3.36Å; E391-L395 PolarHBondContact O-N 3.4Å |
| 392 | R | 93 | Very high | 91.6 | Very high | 56 Ų | 56 | 77.4 Ų | 77.4 | 21% | 0.211 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -57.7 | -54.2 | 168.5 | 176.4 | 176.4 | 74.3 | -177.7 | 5.5 | 111.6 | A383 M384 I386 K388 P389 R394 L395 L396 | A383-R392 WeakPolarHBondContact O-CG 3.22Å; M384-R392 HydrophobicContact SD-CG 4.35Å; I386-R392 HydrophobicContact CB-CB 4.31Å; K388-R392 WeakPolarHBondContact O-CB 3.25Å; K388-R392 PolarHBondContact O-N 2.96Å; P389-R392 PolarHBondContact O-N 3.13Å; R392-R394 VanDerWaalsContact C-N 3.31Å; R392-R394 PolarHBondContact O-N 2.98Å; R392-L395 PolarHBondContact O-N 2.79Å; R392-L395 VanDerWaalsContact O-N 3.13Å; R392-L396 HydrophobicContact CG-CD1 3.95Å; R392-L396 HydrophobicContact CG-CG 4.38Å; R392-L396 WeakPolarHBondContact O-CB 3.46Å; R392-L396 VanDerWaalsContact O-CG 3.31Å; R392-L396 WeakPolarHBondContact O-CG 3.46Å; R392-L396 PolarHBondContact O-N 3Å |
| 393 | T | 91.6 | Very high | 91.4 | Very high | 21 Ų | 21 | 71.8 Ų | 71.8 | 13% | 0.129 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -56.2 | -42.6 | 178.3 | -70.1 | 0 | 0 | 0 | 0 | 111.8 | P389 R397 I474 | P389-T393 VanDerWaalsContact O-CB 3.28Å; P389-T393 WeakPolarHBondContact O-CB 3.43Å; P389-T393 PolarHBondContact O-N 3.1Å; P389-T393 PolarHBondContact O-OG1 3.08Å; T393-R397 PolarHBondContact O-N 2.95Å; T393-R397 VanDerWaalsContact O-N 3.08Å; T393-I474 HydrophobicContact CG2-CD1 4.08Å; T393-I474 HydrophobicContact CG2-CG1 3.7Å |
| 394 | R | 92 | Very high | 91.3 | Very high | 173 Ų | 173 | 74 Ų | 74 | 65% | 0.653 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -63.4 | -43.4 | 175.3 | -178.5 | 178.4 | -179.2 | 169 | 2.6 | 112.8 | D390 E391 R392 R397 Q398 | D390-R394 VanDerWaalsContact O-CB 3.3Å; D390-R394 WeakPolarHBondContact O-CB 3.4Å; D390-R394 PolarHBondContact O-N 3.4Å; E391-R394 PolarHBondContact O-N 2.87Å; R392-R394 VanDerWaalsContact C-N 3.31Å; R392-R394 PolarHBondContact O-N 2.98Å; R394-R397 PolarHBondContact O-N 3Å; R394-Q398 WeakPolarHBondContact O-CG 3.38Å; R394-Q398 PolarHBondContact O-N 2.95Å; R394-Q398 VanDerWaalsContact O-N 3.12Å |
| 395 | L | 92.5 | Very high | 91.1 | Very high | 59 Ų | 59 | 76.1 Ų | 76.1 | 31% | 0.309 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -72.4 | -38.5 | -180 | -76 | 162.4 | 0 | 0 | 0 | 111.9 | A383 I386 E391 R392 R397 Q398 I399 | A383-L395 HydrophobicContact CB-CB 4.19Å; I386-L395 HydrophobicContact CD1-CD1 3.25Å; E391-L395 HydrophobicContact CG-CD1 4.49Å; E391-L395 WeakPolarHBondContact O-CB 3.41Å; E391-L395 WeakPolarHBondContact O-CG 3.36Å; E391-L395 PolarHBondContact O-N 3.4Å; R392-L395 PolarHBondContact O-N 2.79Å; R392-L395 VanDerWaalsContact O-N 3.13Å; L395-R397 VanDerWaalsContact C-N 3.34Å; L395-R397 PolarHBondContact O-N 3.15Å; L395-Q398 PolarHBondContact O-N 2.8Å; L395-I399 WeakPolarHBondContact O-CD1 3.42Å; L395-I399 VanDerWaalsContact O-CG1 3.28Å; L395-I399 WeakPolarHBondContact O-CG1 3.47Å; L395-I399 PolarHBondContact O-N 3.49Å |
| 396 | L | 92.8 | Very high | 91 | Very high | 0 Ų | 0 | 74.7 Ų | 74.7 | 0% | 0 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -57.4 | -45 | 171.2 | -70 | 173.9 | 0 | 0 | 0 | 111.4 | L380 A383 M384 R392 Q398 I399 L400 L464 V467 I474 | L380-L396 HydrophobicContact CD2-CD2 3.62Å; A383-L396 HydrophobicContact CB-CD2 3.9Å; A383-L396 HydrophobicContact CB-CG 4.26Å; M384-L396 HydrophobicContact SD-CD1 4.17Å; R392-L396 HydrophobicContact CG-CD1 3.95Å; R392-L396 HydrophobicContact CG-CG 4.38Å; R392-L396 WeakPolarHBondContact O-CB 3.46Å; R392-L396 VanDerWaalsContact O-CG 3.31Å; R392-L396 WeakPolarHBondContact O-CG 3.46Å; R392-L396 PolarHBondContact O-N 3Å; L396-Q398 PolarHBondContact O-N 3.02Å; L396-I399 PolarHBondContact O-N 3.25Å; L396-L400 WeakPolarHBondContact O-CB 3.32Å; L396-L400 WeakPolarHBondContact O-CG 3.38Å; L396-L400 PolarHBondContact O-N 3.31Å; L396-L464 HydrophobicContact CD1-CD1 4.45Å; L396-L464 HydrophobicContact CD2-CD1 3.71Å; L396-V467 HydrophobicContact CD1-CG1 3.7Å; L396-I474 HydrophobicContact CB-CD1 4.43Å; L396-I474 HydrophobicContact CB-CG2 4.06Å; L396-I474 HydrophobicContact CD1-CD1 4.17Å |
| 397 | R | 92.1 | Very high | 90.8 | Very high | 91 Ų | 91 | 74 Ų | 74 | 34% | 0.343 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -57.8 | -48.6 | 173 | -174.8 | -173.3 | -65.6 | 165.1 | -0.7 | 111.5 | T393 R394 L395 I399 L400 Q401 S473 I474 | T393-R397 PolarHBondContact O-N 2.95Å; T393-R397 VanDerWaalsContact O-N 3.08Å; R394-R397 PolarHBondContact O-N 3Å; L395-R397 VanDerWaalsContact C-N 3.34Å; L395-R397 PolarHBondContact O-N 3.15Å; R397-I399 VanDerWaalsContact C-N 3.25Å; R397-I399 PolarHBondContact O-N 2.88Å; R397-L400 PolarHBondContact O-N 3.35Å; R397-Q401 HydrophobicContact CG-CG 4.42Å; R397-Q401 WeakPolarHBondContact O-CB 3.45Å; R397-Q401 WeakPolarHBondContact O-CG 3.44Å; R397-Q401 PolarHBondContact O-N 3.11Å; R397-S473 PolarHBondContact NE-O 3.22Å; R397-S473 PolarHBondContact NH2-O 3.1Å; R397-I474 WeakPolarHBondContact CG-O 3.18Å |
| 398 | Q | 91.9 | Very high | 90.8 | Very high | 90 Ų | 90 | 68.4 Ų | 68.4 | 42% | 0.421 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -63.6 | -26.4 | 179.4 | -74 | -176 | -23.7 | 0 | 0 | 114.2 | R394 L395 L396 | R394-Q398 WeakPolarHBondContact O-CG 3.38Å; R394-Q398 PolarHBondContact O-N 2.95Å; R394-Q398 VanDerWaalsContact O-N 3.12Å; L395-Q398 PolarHBondContact O-N 2.8Å; L396-Q398 PolarHBondContact O-N 3.02Å |
| 399 | I | 92.2 | Very high | 90.7 | Very high | 13 Ų | 13 | 63.7 Ų | 63.7 | 7% | 0.067 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -80.4 | -44.6 | 174.5 | -64.9 | 157.7 | 0 | 0 | 0 | 110.2 | L376 P379 L380 A383 L395 L396 R397 Q401 R402 | L376-I399 HydrophobicContact CB-CG2 4.13Å; L376-I399 HydrophobicContact CD1-CG2 4.43Å; L376-I399 HydrophobicContact CD2-CG2 4.28Å; P379-I399 HydrophobicContact CB-CD1 3.79Å; P379-I399 HydrophobicContact CB-CG1 4.01Å; P379-I399 HydrophobicContact CB-CG2 4.1Å; P379-I399 VanDerWaalsContact O-CD1 3.26Å; P379-I399 WeakPolarHBondContact O-CD1 3.4Å; L380-I399 HydrophobicContact CD2-CB 4.09Å; L380-I399 HydrophobicContact CD2-CD1 4.36Å; L380-I399 HydrophobicContact CD2-CG2 3.64Å; L380-I399 HydrophobicContact CG-CG2 3.86Å; A383-I399 HydrophobicContact CB-CD1 3.8Å; L395-I399 WeakPolarHBondContact O-CD1 3.42Å; L395-I399 VanDerWaalsContact O-CG1 3.28Å; L395-I399 WeakPolarHBondContact O-CG1 3.47Å; L395-I399 PolarHBondContact O-N 3.49Å; L396-I399 PolarHBondContact O-N 3.25Å; R397-I399 VanDerWaalsContact C-N 3.25Å; R397-I399 PolarHBondContact O-N 2.88Å; I399-Q401 VanDerWaalsContact C-N 3.33Å; I399-Q401 PolarHBondContact O-N 2.94Å; I399-R402 VanDerWaalsContact O-CB 3.22Å; I399-R402 WeakPolarHBondContact O-CB 3.35Å; I399-R402 WeakPolarHBondContact O-CG 3.23Å; I399-R402 PolarHBondContact O-N 3.15Å |
| 400 | L | 90.1 | Very high | 90.7 | Very high | 1 Ų | 1 | 60.6 Ų | 60.6 | 1% | 0.005 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -73 | -23.2 | -178.5 | -66.9 | 167.4 | 0 | 0 | 0 | 113.3 | L380 L396 R397 R402 L403 R408 L411 L468 I474 I475 | L380-L400 HydrophobicContact CD2-CD2 4.39Å; L380-L400 HydrophobicContact CD2-CG 4.36Å; L396-L400 WeakPolarHBondContact O-CB 3.32Å; L396-L400 WeakPolarHBondContact O-CG 3.38Å; L396-L400 PolarHBondContact O-N 3.31Å; R397-L400 PolarHBondContact O-N 3.35Å; L400-R402 PolarHBondContact O-N 3.33Å; L400-L403 HydrophobicContact CD2-CD1 3.55Å; L400-L403 HydrophobicContact CD2-CG 4.39Å; L400-L403 WeakPolarHBondContact O-CB 3.35Å; L400-L403 PolarHBondContact O-N 2.83Å; L400-L403 VanDerWaalsContact O-N 3.1Å; L400-R408 PolarHBondContact O-NH1 3.29Å; L400-L411 HydrophobicContact CD2-CD2 4.3Å; L400-L468 HydrophobicContact CD1-CD2 3.6Å; L400-I474 HydrophobicContact CD1-CG2 3.6Å; L400-I475 HydrophobicContact CD1-CG1 4.42Å |
| 401 | Q | 89.4 | Confident | 90.7 | Very high | 82 Ų | 82 | 54.4 Ų | 54.4 | 38% | 0.383 | 25% | 0.249 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -17.1 | 165.4 | -79.5 | 175.6 | -30.7 | 0 | 0 | 113 | R397 I399 R408 P477 | R397-Q401 HydrophobicContact CG-CG 4.42Å; R397-Q401 WeakPolarHBondContact O-CB 3.45Å; R397-Q401 WeakPolarHBondContact O-CG 3.44Å; R397-Q401 PolarHBondContact O-N 3.11Å; I399-Q401 VanDerWaalsContact C-N 3.33Å; I399-Q401 PolarHBondContact O-N 2.94Å; Q401-R408 PolarHBondContact O-NH1 2.94Å; Q401-P477 PolarHBondContact NE2-OXT 3.39Å |
| 402 | R | 89.7 | Confident | 90.7 | Very high | 178 Ų | 178 | 54.5 Ų | 54.5 | 67% | 0.672 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -9.2 | 173.5 | -51.8 | 179.8 | -177.2 | -172.1 | -1.1 | 114.2 | L376 I399 L400 | L376-R402 HydrophobicContact CD1-CB 4.48Å; L376-R402 HydrophobicContact CD2-CB 4.24Å; I399-R402 VanDerWaalsContact O-CB 3.22Å; I399-R402 WeakPolarHBondContact O-CB 3.35Å; I399-R402 WeakPolarHBondContact O-CG 3.23Å; I399-R402 PolarHBondContact O-N 3.15Å; L400-R402 PolarHBondContact O-N 3.33Å |
| 403 | L | 87.9 | Confident | 90.6 | Very high | 7 Ų | 7 | 54.2 Ų | 54.2 | 4% | 0.037 | 25% | 0.245 | C | C | . | . | S | Bend | trans | -65.6 | 151.5 | 171.5 | -74.9 | 170.2 | 0 | 0 | 0 | 110.4 | L376 L400 R408 L411 | L376-L403 HydrophobicContact CD1-CD2 3.59Å; L376-L403 HydrophobicContact CD1-CG 3.74Å; L400-L403 HydrophobicContact CD2-CD1 3.55Å; L400-L403 HydrophobicContact CD2-CG 4.39Å; L400-L403 WeakPolarHBondContact O-CB 3.35Å; L400-L403 PolarHBondContact O-N 2.83Å; L400-L403 VanDerWaalsContact O-N 3.1Å; L403-R408 HydrophobicContact CB-CB 4.34Å; L403-R408 PolarHBondContact O-NH1 2.89Å; L403-L411 HydrophobicContact CD1-CD2 3.92Å |
| 404 | P | 89.4 | Confident | 90.6 | Very high | 52 Ų | 52 | 53.2 Ų | 53.2 | 34% | 0.338 | 24% | 0.239 | S | C | . | . | trans | -50.9 | 141.1 | 164.7 | -24 | 33.5 | 0 | 0 | 0 | 110.8 | E406 N407 R408 | P404-E406 WeakPolarHBondContact CB-OE2 3.37Å; P404-E406 PolarHBondContact O-N 2.93Å; P404-N407 HydrophobicContact CB-CB 4.35Å; P404-N407 PolarHBondContact O-N 3.26Å; P404-R408 PolarHBondContact O-N 3.3Å | ||
| 405 | P | 88.1 | Confident | 90.6 | Very high | 64 Ų | 64 | 45 Ų | 45 | 42% | 0.416 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -59.1 | -30.7 | -179 | 23.7 | -32.4 | 0 | 0 | 0 | 112.7 | R408 A409 | P405-R408 PolarHBondContact O-N 2.94Å; P405-A409 VanDerWaalsContact O-CB 3.3Å; P405-A409 WeakPolarHBondContact O-CB 2.96Å; P405-A409 PolarHBondContact O-N 3.29Å |
| 406 | E | 88.9 | Confident | 90.6 | Very high | 64 Ų | 64 | 45.3 Ų | 45.3 | 30% | 0.299 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -65.6 | -49.8 | 177.3 | -51.7 | 75.9 | -169.3 | 0 | 0 | 111.5 | F279 P404 R408 A409 T410 | F279-E406 HydrophobicContact CB-CB 4.5Å; F279-E406 HydrophobicContact CD1-CG 3.85Å; F279-E406 HydrophobicContact CE1-CG 4.47Å; P404-E406 WeakPolarHBondContact CB-OE2 3.37Å; P404-E406 PolarHBondContact O-N 2.93Å; E406-R408 VanDerWaalsContact C-N 3.35Å; E406-A409 PolarHBondContact O-N 2.91Å; E406-T410 WeakPolarHBondContact O-CB 3.16Å; E406-T410 PolarHBondContact O-N 2.67Å; E406-T410 PolarHBondContact O-OG1 3.23Å |
| 407 | N | 89.2 | Confident | 90.5 | Very high | 28 Ų | 28 | 45.5 Ų | 45.5 | 15% | 0.15 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -65 | -40 | 176.3 | -68.2 | 22.3 | 0 | 0 | 0 | 110.5 | L371 P404 T410 L411 | L371-N407 HydrophobicContact CD1-CB 4.21Å; P404-N407 HydrophobicContact CB-CB 4.35Å; P404-N407 PolarHBondContact O-N 3.26Å; N407-T410 PolarHBondContact O-N 2.88Å; N407-L411 WeakPolarHBondContact O-CB 3.45Å; N407-L411 PolarHBondContact O-N 3.19Å |
| 408 | R | 89.2 | Confident | 90.4 | Very high | 53 Ų | 53 | 41.1 Ų | 41.1 | 20% | 0.2 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66.4 | -41.6 | 177.6 | -177.1 | 168 | 57.8 | -99.5 | -2.8 | 112.3 | L400 Q401 L403 P404 P405 E406 R412 I475 | L400-R408 PolarHBondContact O-NH1 3.29Å; Q401-R408 PolarHBondContact O-NH1 2.94Å; L403-R408 HydrophobicContact CB-CB 4.34Å; L403-R408 PolarHBondContact O-NH1 2.89Å; P404-R408 PolarHBondContact O-N 3.3Å; P405-R408 PolarHBondContact O-N 2.94Å; E406-R408 VanDerWaalsContact C-N 3.35Å; R408-R412 WeakPolarHBondContact O-CB 3.48Å; R408-R412 PolarHBondContact O-N 3.17Å; R408-I475 HydrophobicContact CG-CG2 3.81Å |
| 409 | A | 90.3 | Very high | 90.4 | Very high | 20 Ų | 20 | 37.4 Ų | 37.4 | 17% | 0.165 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.5 | -47.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | F279 V280 P405 E406 L411 R412 Y413 | F279-A409 HydrophobicContact CB-CB 3.98Å; V280-A409 HydrophobicContact CG2-CB 4.5Å; P405-A409 VanDerWaalsContact O-CB 3.3Å; P405-A409 WeakPolarHBondContact O-CB 2.96Å; P405-A409 PolarHBondContact O-N 3.29Å; E406-A409 PolarHBondContact O-N 2.91Å; A409-L411 PolarHBondContact O-N 3.46Å; A409-R412 PolarHBondContact O-N 3.4Å; A409-Y413 WeakPolarHBondContact O-CB 3.21Å; A409-Y413 PolarHBondContact O-N 2.68Å |
| 410 | T | 91.3 | Very high | 90.2 | Very high | 4 Ų | 4 | 38.8 Ų | 38.8 | 3% | 0.025 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63 | -41.9 | 177.5 | -56.8 | 0 | 0 | 0 | 0 | 112.2 | P281 F364 L371 E406 N407 F414 | P281-T410 WeakPolarHBondContact CD-OG1 3.49Å; F364-T410 HydrophobicContact CE1-CG2 3.91Å; F364-T410 HydrophobicContact CZ-CG2 4.32Å; L371-T410 HydrophobicContact CD1-CG2 4.11Å; E406-T410 WeakPolarHBondContact O-CB 3.16Å; E406-T410 PolarHBondContact O-N 2.67Å; E406-T410 PolarHBondContact O-OG1 3.23Å; N407-T410 PolarHBondContact O-N 2.88Å; T410-F414 WeakPolarHBondContact O-CB 3.43Å; T410-F414 PolarHBondContact O-N 2.83Å |
| 411 | L | 91 | Very high | 90.1 | Very high | 2 Ų | 2 | 38.7 Ų | 38.7 | 1% | 0.01 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -64.6 | -41 | 175.5 | -179.9 | 62.8 | 0 | 0 | 0 | 112.1 | L371 V372 L400 L403 N407 A409 L415 L443 I475 | L371-L411 HydrophobicContact CD1-CB 4.49Å; L371-L411 HydrophobicContact CD2-CB 4.01Å; L371-L411 HydrophobicContact CD2-CD1 3.82Å; L371-L411 HydrophobicContact CG-CB 4.1Å; L371-L411 HydrophobicContact CG-CD1 4.25Å; V372-L411 HydrophobicContact CG2-CD2 4.16Å; L400-L411 HydrophobicContact CD2-CD2 4.3Å; L403-L411 HydrophobicContact CD1-CD2 3.92Å; N407-L411 WeakPolarHBondContact O-CB 3.45Å; N407-L411 PolarHBondContact O-N 3.19Å; A409-L411 PolarHBondContact O-N 3.46Å; L411-L415 HydrophobicContact CD1-CD1 3.75Å; L411-L415 HydrophobicContact CD1-CG 4.22Å; L411-L415 HydrophobicContact CG-CD1 3.88Å; L411-L415 WeakPolarHBondContact O-CB 3.33Å; L411-L415 VanDerWaalsContact O-CG 3.32Å; L411-L415 WeakPolarHBondContact O-CG 3.46Å; L411-L415 PolarHBondContact O-N 3.26Å; L411-L443 HydrophobicContact CD1-CD2 4.4Å; L411-I475 HydrophobicContact CD2-CD1 4.43Å; L411-I475 HydrophobicContact CG-CD1 4.33Å |
| 412 | R | 91.3 | Very high | 90 | Very high | 86 Ų | 86 | 35.1 Ų | 35.1 | 33% | 0.325 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -60.7 | -56.2 | 174.4 | 179.1 | 179 | 169.1 | -161.7 | -1.8 | 110.9 | R408 A409 F414 L415 D416 I475 | R408-R412 WeakPolarHBondContact O-CB 3.48Å; R408-R412 PolarHBondContact O-N 3.17Å; A409-R412 PolarHBondContact O-N 3.4Å; R412-F414 VanDerWaalsContact C-N 3.3Å; R412-F414 PolarHBondContact O-N 3.37Å; R412-L415 PolarHBondContact O-N 2.87Å; R412-L415 VanDerWaalsContact O-N 3.08Å; R412-D416 VanDerWaalsContact CG-OD2 3.32Å; R412-D416 WeakPolarHBondContact CG-OD2 3.48Å; R412-D416 IonicContact NE-OD2 3.69Å; R412-D416 PolarHBondContact O-N 3.25Å; R412-I475 HydrophobicContact CB-CG2 3.84Å; R412-I475 HydrophobicContact CG-CG2 4.48Å |
| 413 | Y | 91.6 | Very high | 89.9 | Confident | 50 Ų | 50 | 35.8 Ų | 35.8 | 20% | 0.196 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -55 | -45.1 | -178.7 | -177.5 | -93 | 0 | 0 | 0 | 111.7 | V280 V284 R285 V288 A409 D416 H417 | V280-Y413 HydrophobicContact CG1-CD1 3.75Å; V280-Y413 HydrophobicContact CG1-CE1 4.21Å; V280-Y413 HydrophobicContact CG1-CG 4Å; V280-Y413 HydrophobicContact CG2-CD2 4.48Å; V280-Y413 HydrophobicContact CG2-CG 4.14Å; V284-Y413 HydrophobicContact CG1-CD1 3.95Å; V284-Y413 HydrophobicContact CG1-CE1 4.11Å; R285-Y413 HydrophobicContact CG-CE1 4.24Å; V288-Y413 HydrophobicContact CB-CE1 3.75Å; V288-Y413 HydrophobicContact CG1-CE1 3.81Å; V288-Y413 HydrophobicContact CG2-CD1 4.45Å; V288-Y413 HydrophobicContact CG2-CE1 3.81Å; A409-Y413 WeakPolarHBondContact O-CB 3.21Å; A409-Y413 PolarHBondContact O-N 2.68Å; Y413-D416 PolarHBondContact O-N 3.01Å; Y413-H417 PolarHBondContact O-N 3.36Å |
| 414 | F | 92.1 | Very high | 89.7 | Confident | 1 Ų | 1 | 36.5 Ų | 36.5 | 0% | 0.004 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -66.8 | -40.1 | 176.8 | -173.1 | -125.4 | 0 | 0 | 0 | 112.9 | Y321 L360 F364 T410 R412 H417 L418 L439 L443 | Y321-F414 HydrophobicContact CE1-CE2 4.13Å; Y321-F414 HydrophobicContact CE1-CZ 4.16Å; L360-F414 HydrophobicContact CD2-CD2 4.3Å; L360-F414 HydrophobicContact CD2-CE2 3.84Å; L360-F414 HydrophobicContact CG-CE2 4.17Å; F364-F414 HydrophobicContact CD2-CD1 4.42Å; F364-F414 HydrophobicContact CD2-CE1 4.13Å; F364-F414 HydrophobicContact CD2-CZ 4.2Å; F364-F414 HydrophobicContact CE2-CB 4.49Å; F364-F414 AromaticContact CE2-CD1 3.83Å; F364-F414 HydrophobicContact CE2-CD1 3.83Å; F364-F414 AromaticContact CE2-CD2 3.75Å; F364-F414 HydrophobicContact CE2-CD2 3.75Å; F364-F414 AromaticContact CE2-CE1 3.88Å; F364-F414 HydrophobicContact CE2-CE1 3.88Å; F364-F414 AromaticContact CE2-CE2 3.83Å; F364-F414 HydrophobicContact CE2-CE2 3.83Å; F364-F414 AromaticContact CE2-CG 3.76Å; F364-F414 HydrophobicContact CE2-CG 3.76Å; F364-F414 AromaticContact CE2-CZ 3.89Å; F364-F414 HydrophobicContact CE2-CZ 3.89Å; F364-F414 HydrophobicContact CZ-CB 4.2Å; F364-F414 HydrophobicContact CZ-CD1 4.2Å; F364-F414 HydrophobicContact CZ-CD2 4.23Å; F364-F414 AromaticContact CZ-CG 3.96Å; F364-F414 HydrophobicContact CZ-CG 3.96Å; T410-F414 WeakPolarHBondContact O-CB 3.43Å; T410-F414 PolarHBondContact O-N 2.83Å; R412-F414 VanDerWaalsContact C-N 3.3Å; R412-F414 PolarHBondContact O-N 3.37Å; F414-H417 PolarHBondContact O-N 3.3Å; F414-L418 HydrophobicContact CD1-CD1 3.93Å; F414-L418 HydrophobicContact CE1-CD1 3.68Å; F414-L418 HydrophobicContact CE1-CG 4.49Å; F414-L418 HydrophobicContact CE2-CD1 4.34Å; F414-L418 HydrophobicContact CE2-CD2 4.32Å; F414-L418 HydrophobicContact CE2-CG 4.31Å; F414-L418 HydrophobicContact CG-CD1 4.39Å; F414-L418 HydrophobicContact CZ-CD1 3.9Å; F414-L418 HydrophobicContact CZ-CD2 4.24Å; F414-L418 HydrophobicContact CZ-CG 4.29Å; F414-L418 WeakPolarHBondContact O-CG 3.43Å; F414-L418 PolarHBondContact O-N 3.22Å; F414-L439 HydrophobicContact CE1-CD1 4.23Å; F414-L439 HydrophobicContact CZ-CD1 4.05Å; F414-L439 HydrophobicContact CZ-CD2 4.47Å; F414-L443 HydrophobicContact CD1-CD2 3.97Å; F414-L443 HydrophobicContact CE1-CD2 3.94Å |
| 415 | L | 92.3 | Very high | 89.5 | Confident | 1 Ų | 1 | 37.1 Ų | 37.1 | 1% | 0.005 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -70.6 | -32.7 | 176.6 | -73.8 | 167.1 | 0 | 0 | 0 | 113.1 | L411 R412 L418 R419 L468 L469 I475 | L411-L415 HydrophobicContact CD1-CD1 3.75Å; L411-L415 HydrophobicContact CD1-CG 4.22Å; L411-L415 HydrophobicContact CG-CD1 3.88Å; L411-L415 WeakPolarHBondContact O-CB 3.33Å; L411-L415 VanDerWaalsContact O-CG 3.32Å; L411-L415 WeakPolarHBondContact O-CG 3.46Å; L411-L415 PolarHBondContact O-N 3.26Å; R412-L415 PolarHBondContact O-N 2.87Å; R412-L415 VanDerWaalsContact O-N 3.08Å; L415-L418 HydrophobicContact CD2-CD1 4.24Å; L415-L418 PolarHBondContact O-N 3.24Å; L415-R419 VanDerWaalsContact O-CG 3.29Å; L415-R419 WeakPolarHBondContact O-CG 3.32Å; L415-R419 PolarHBondContact O-N 3.07Å; L415-L468 HydrophobicContact CD1-CB 4.26Å; L415-L469 HydrophobicContact CD2-CD2 3.56Å; L415-L469 HydrophobicContact CD2-CG 3.94Å; L415-I475 HydrophobicContact CD1-CD1 3.26Å |
| 416 | D | 91.1 | Very high | 89.3 | Confident | 64 Ų | 64 | 39.3 Ų | 39.3 | 34% | 0.342 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -66.7 | -41.7 | 173.2 | -79.9 | -43.5 | 0 | 0 | 0 | 111.6 | R412 Y413 L418 R419 C420 | R412-D416 VanDerWaalsContact CG-OD2 3.32Å; R412-D416 WeakPolarHBondContact CG-OD2 3.48Å; R412-D416 IonicContact NE-OD2 3.69Å; R412-D416 PolarHBondContact O-N 3.25Å; Y413-D416 PolarHBondContact O-N 3.01Å; D416-L418 PolarHBondContact O-N 2.76Å; D416-R419 VanDerWaalsContact CG-NH1 3.3Å; D416-R419 WeakPolarHBondContact O-CB 3.3Å; D416-R419 PolarHBondContact O-N 3.2Å; D416-R419 IonicContact OD1-CZ 3.76Å; D416-R419 IonicContact OD1-NH1 3.77Å; D416-R419 PolarHBondContact OD1-NH1 2.83Å; D416-R419 IonicContact OD2-NH1 2.68Å; D416-C420 PolarHBondContact O-N 2.95Å; D416-C420 VanDerWaalsContact O-N 3.09Å |
| 417 | H | 90.5 | Very high | 88.9 | Confident | 4 Ų | 4 | 37.9 Ų | 37.9 | 2% | 0.019 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -56.5 | -48 | 168.5 | 173.2 | 56.9 | 0 | 0 | 0 | 112.1 | V288 E292 Y321 Y413 F414 R419 C420 V421 | V288-H417 HydrophobicContact CG1-CB 3.86Å; V288-H417 HydrophobicContact CG2-CB 4.11Å; E292-H417 VanDerWaalsContact CD-ND1 3.34Å; E292-H417 WeakPolarHBondContact CG-ND1 3.48Å; E292-H417 IonicContact OE1-CE1 2.67Å; E292-H417 IonicContact OE1-CG 3.22Å; E292-H417 IonicContact OE1-ND1 2.7Å; E292-H417 PolarHBondContact OE1-ND1 3.02Å; Y321-H417 AromaticContact CE2-NE2 3.95Å; Y321-H417 AromaticContact CZ-NE2 3.93Å; Y321-H417 PolarHBondContact OH-CD2 3.15Å; Y321-H417 PolarHBondContact OH-NE2 3.36Å; Y413-H417 PolarHBondContact O-N 3.36Å; F414-H417 PolarHBondContact O-N 3.3Å; H417-R419 VanDerWaalsContact C-N 3.28Å; H417-R419 PolarHBondContact O-N 3.29Å; H417-C420 WeakPolarHBondContact O-CA 3.39Å; H417-C420 WeakPolarHBondContact O-CB 3.48Å; H417-C420 PolarHBondContact O-N 3.38Å; H417-V421 WeakPolarHBondContact O-CG2 3.46Å; H417-V421 PolarHBondContact O-N 2.7Å |
| 418 | L | 91.7 | Very high | 88.6 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -64.5 | -30.1 | -179.8 | -67.6 | 170.6 | 0 | 0 | 0 | 113.2 | Y321 F414 L415 D416 C420 V421 A422 I435 L439 L469 | Y321-L418 HydrophobicContact CD2-CD2 3.75Å; Y321-L418 HydrophobicContact CE2-CD2 3.4Å; Y321-L418 VanDerWaalsContact CE2-CD2 3.4Å; Y321-L418 HydrophobicContact CG-CD2 4.47Å; F414-L418 HydrophobicContact CD1-CD1 3.93Å; F414-L418 HydrophobicContact CE1-CD1 3.68Å; F414-L418 HydrophobicContact CE1-CG 4.49Å; F414-L418 HydrophobicContact CE2-CD1 4.34Å; F414-L418 HydrophobicContact CE2-CD2 4.32Å; F414-L418 HydrophobicContact CE2-CG 4.31Å; F414-L418 HydrophobicContact CG-CD1 4.39Å; F414-L418 HydrophobicContact CZ-CD1 3.9Å; F414-L418 HydrophobicContact CZ-CD2 4.24Å; F414-L418 HydrophobicContact CZ-CG 4.29Å; F414-L418 WeakPolarHBondContact O-CG 3.43Å; F414-L418 PolarHBondContact O-N 3.22Å; L415-L418 HydrophobicContact CD2-CD1 4.24Å; L415-L418 PolarHBondContact O-N 3.24Å; D416-L418 PolarHBondContact O-N 2.76Å; L418-C420 VanDerWaalsContact C-N 3.34Å; L418-V421 PolarHBondContact O-N 3.47Å; L418-A422 WeakPolarHBondContact O-CB 3.29Å; L418-A422 PolarHBondContact O-N 2.98Å; L418-I435 HydrophobicContact CB-CG2 4.22Å; L418-I435 HydrophobicContact CD1-CG2 4.24Å; L418-I435 HydrophobicContact CD2-CG2 3.82Å; L418-I435 HydrophobicContact CG-CG2 4.31Å; L418-L439 HydrophobicContact CD1-CD1 3.44Å; L418-L439 VanDerWaalsContact CD1-CD1 3.44Å; L418-L439 HydrophobicContact CD2-CD1 3.5Å; L418-L439 HydrophobicContact CG-CD1 4.11Å; L418-L469 HydrophobicContact CB-CD2 3.53Å; L418-L469 HydrophobicContact CD1-CD2 4.22Å |
| 419 | R | 90.7 | Very high | 88.5 | Confident | 12 Ų | 12 | 36 Ų | 36 | 5% | 0.045 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -67 | -34.1 | 168.8 | -68.5 | 164.3 | -168.2 | 128.6 | 10.4 | 111.7 | L415 D416 H417 A422 R423 L468 L469 | L415-R419 VanDerWaalsContact O-CG 3.29Å; L415-R419 WeakPolarHBondContact O-CG 3.32Å; L415-R419 PolarHBondContact O-N 3.07Å; D416-R419 VanDerWaalsContact CG-NH1 3.3Å; D416-R419 WeakPolarHBondContact O-CB 3.3Å; D416-R419 PolarHBondContact O-N 3.2Å; D416-R419 IonicContact OD1-CZ 3.76Å; D416-R419 IonicContact OD1-NH1 3.77Å; D416-R419 PolarHBondContact OD1-NH1 2.83Å; D416-R419 IonicContact OD2-NH1 2.68Å; H417-R419 VanDerWaalsContact C-N 3.28Å; H417-R419 PolarHBondContact O-N 3.29Å; R419-A422 PolarHBondContact O-N 3.18Å; R419-R423 VanDerWaalsContact O-CG 3.28Å; R419-R423 WeakPolarHBondContact O-CG 3.38Å; R419-R423 PolarHBondContact O-N 3.29Å; R419-L468 PolarHBondContact NH2-O 3.23Å; R419-L469 WeakPolarHBondContact CG-O 3.42Å; R419-L469 PolarHBondContact NE-O 3.29Å |
| 420 | C | 88.1 | Confident | 88.4 | Confident | 41 Ų | 41 | 35 Ų | 35 | 28% | 0.277 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -62.5 | -48.9 | 171.7 | -159.4 | 0 | 0 | 0 | 0 | 111.1 | E292 D416 H417 L418 A422 R423 N424 | E292-C420 WeakPolarHBondContact OE1-CB 3.46Å; D416-C420 PolarHBondContact O-N 2.95Å; D416-C420 VanDerWaalsContact O-N 3.09Å; H417-C420 WeakPolarHBondContact O-CA 3.39Å; H417-C420 WeakPolarHBondContact O-CB 3.48Å; H417-C420 PolarHBondContact O-N 3.38Å; L418-C420 VanDerWaalsContact C-N 3.34Å; C420-A422 VanDerWaalsContact C-N 3.3Å; C420-A422 PolarHBondContact O-N 2.82Å; C420-R423 PolarHBondContact O-N 3.43Å; C420-N424 PolarHBondContact O-N 3.46Å |
| 421 | V | 88 | Confident | 88.4 | Confident | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -58.1 | -40.2 | 175.3 | -175.3 | 0 | 0 | 0 | 0 | 112.3 | M315 L320 Y321 H417 L418 N424 T428 I435 | M315-V421 HydrophobicContact CE-CG2 3.85Å; M315-V421 HydrophobicContact SD-CB 4.09Å; M315-V421 HydrophobicContact SD-CG1 3.94Å; M315-V421 HydrophobicContact SD-CG2 3.88Å; L320-V421 HydrophobicContact CB-CG1 4.25Å; L320-V421 HydrophobicContact CD1-CG1 4.1Å; Y321-V421 HydrophobicContact CE2-CG2 4.33Å; H417-V421 WeakPolarHBondContact O-CG2 3.46Å; H417-V421 PolarHBondContact O-N 2.7Å; L418-V421 PolarHBondContact O-N 3.47Å; V421-N424 PolarHBondContact O-N 2.77Å; V421-T428 HydrophobicContact CG1-CG2 4.15Å; V421-T428 PolarHBondContact O-OG1 3.2Å; V421-I435 HydrophobicContact CB-CD1 4.12Å; V421-I435 HydrophobicContact CG1-CD1 4.05Å |
| 422 | A | 88.7 | Confident | 88.6 | Confident | 6 Ų | 6 | 40.3 Ų | 40.3 | 5% | 0.05 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -69.3 | -35.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | L418 R419 C420 N424 V425 M430 H432 I435 | L418-A422 WeakPolarHBondContact O-CB 3.29Å; L418-A422 PolarHBondContact O-N 2.98Å; R419-A422 PolarHBondContact O-N 3.18Å; C420-A422 VanDerWaalsContact C-N 3.3Å; C420-A422 PolarHBondContact O-N 2.82Å; A422-N424 PolarHBondContact O-N 3.03Å; A422-V425 WeakPolarHBondContact O-CB 3.32Å; A422-V425 PolarHBondContact O-N 3.36Å; A422-M430 WeakPolarHBondContact CA-O 3.39Å; A422-H432 WeakPolarHBondContact CB-CD2 2.88Å; A422-H432 WeakPolarHBondContact CB-NE2 3.24Å; A422-I435 HydrophobicContact CB-CD1 3.96Å |
| 423 | R | 87.2 | Confident | 88.7 | Confident | 192 Ų | 192 | 40.6 Ų | 40.6 | 73% | 0.725 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -60.4 | -32.8 | 174 | -74.2 | 164.7 | -178.2 | 169.6 | 1.7 | 111.8 | R419 C420 V425 | R419-R423 VanDerWaalsContact O-CG 3.28Å; R419-R423 WeakPolarHBondContact O-CG 3.38Å; R419-R423 PolarHBondContact O-N 3.29Å; C420-R423 PolarHBondContact O-N 3.43Å; R423-V425 VanDerWaalsContact C-N 3.27Å; R423-V425 PolarHBondContact O-N 2.96Å |
| 424 | N | 83.8 | Confident | 88.8 | Confident | 23 Ų | 23 | 41.5 Ų | 41.5 | 12% | 0.123 | 22% | 0.219 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.1 | 24.7 | -179.1 | -65.4 | 0.3 | 0 | 0 | 0 | 113.2 | G314 M315 C420 V421 A422 S426 T427 T428 | G314-N424 PolarHBondContact O-ND2 2.92Å; M315-N424 HydrophobicContact CG-CB 4.37Å; C420-N424 PolarHBondContact O-N 3.46Å; V421-N424 PolarHBondContact O-N 2.77Å; A422-N424 PolarHBondContact O-N 3.03Å; N424-S426 PolarHBondContact O-N 3.35Å; N424-T427 PolarHBondContact O-N 3Å; N424-T428 HydrophobicContact CB-CG2 4.12Å; N424-T428 PolarHBondContact O-N 3.12Å; N424-T428 PolarHBondContact O-OG1 3.06Å |
| 425 | V | 85.3 | Confident | 88.8 | Confident | 65 Ų | 65 | 41.4 Ų | 41.4 | 39% | 0.394 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -50.9 | -28.1 | -179.8 | 62.8 | 0 | 0 | 0 | 0 | 114.6 | A422 R423 T427 T428 A429 D431 | A422-V425 WeakPolarHBondContact O-CB 3.32Å; A422-V425 PolarHBondContact O-N 3.36Å; R423-V425 VanDerWaalsContact C-N 3.27Å; R423-V425 PolarHBondContact O-N 2.96Å; V425-T427 PolarHBondContact O-N 2.91Å; V425-T428 WeakPolarHBondContact CA-OG1 3.49Å; V425-A429 VanDerWaalsContact O-CA 3.3Å; V425-A429 WeakPolarHBondContact O-CA 3.34Å; V425-A429 PolarHBondContact O-N 3.39Å; V425-D431 HydrophobicContact CG2-CB 4.11Å |
| 426 | S | 82.7 | Confident | 88.9 | Confident | 109 Ų | 109 | 41.4 Ų | 41.4 | 76% | 0.762 | 22% | 0.219 | S | C | * | . | H | α-helix | trans | -64.4 | -19.6 | 175.8 | 51.4 | 0 | 0 | 0 | 0 | 114.5 | N424 | N424-S426 PolarHBondContact O-N 3.35Å |
| 427 | T | 80.6 | Confident | 89 | Confident | 34 Ų | 34 | 40.6 Ų | 40.6 | 21% | 0.209 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -120.1 | -34.9 | 176 | -41.5 | 0 | 0 | 0 | 0 | 111.8 | I313 M315 N424 V425 | I313-T427 HydrophobicContact CG2-CG2 3.97Å; M315-T427 WeakPolarHBondContact O-CB 3.34Å; M315-T427 WeakPolarHBondContact O-CG2 3.32Å; N424-T427 PolarHBondContact O-N 3Å; V425-T427 PolarHBondContact O-N 2.91Å |
| 428 | T | 83.5 | Confident | 89.1 | Confident | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -77.9 | -22.3 | 178.4 | 66.2 | 0 | 0 | 0 | 0 | 113.5 | M315 G319 L320 V421 N424 V425 M430 | M315-T428 HydrophobicContact CB-CG2 3.53Å; M315-T428 HydrophobicContact CG-CG2 4.02Å; M315-T428 HydrophobicContact SD-CG2 3.56Å; M315-T428 VanDerWaalsContact SD-CG2 3.56Å; G319-T428 PolarHBondContact N-O 2.99Å; L320-T428 HydrophobicContact CD1-CG2 4.07Å; V421-T428 HydrophobicContact CG1-CG2 4.15Å; V421-T428 PolarHBondContact O-OG1 3.2Å; N424-T428 HydrophobicContact CB-CG2 4.12Å; N424-T428 PolarHBondContact O-N 3.12Å; N424-T428 PolarHBondContact O-OG1 3.06Å; V425-T428 WeakPolarHBondContact CA-OG1 3.49Å; T428-M430 WeakPolarHBondContact O-CG 3.33Å; T428-M430 PolarHBondContact O-N 3.28Å; T428-M430 PolarHBondContact OG1-N 2.97Å |
| 429 | A | 87.5 | Confident | 89.1 | Confident | 41 Ų | 41 | 40.8 Ų | 40.8 | 34% | 0.339 | 21% | 0.214 | S | C | . | . | trans | 54.2 | 22.7 | -167.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | V425 N434 | V425-A429 VanDerWaalsContact O-CA 3.3Å; V425-A429 WeakPolarHBondContact O-CA 3.34Å; V425-A429 PolarHBondContact O-N 3.39Å; A429-N434 PolarHBondContact O-ND2 2.68Å | ||
| 430 | M | 87.9 | Confident | 89.1 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 22% | 0.217 | C | C | . | . | trans | -119.3 | 86.9 | -175.9 | -70.1 | -60.8 | -64.5 | 0 | 0 | 111.4 | L320 R322 A422 T428 N434 I435 | L320-M430 WeakPolarHBondContact O-CE 3.35Å; R322-M430 HydrophobicContact CB-CE 3.94Å; R322-M430 HydrophobicContact CB-SD 3.76Å; R322-M430 HydrophobicContact CG-SD 4.49Å; A422-M430 WeakPolarHBondContact CA-O 3.39Å; T428-M430 WeakPolarHBondContact O-CG 3.33Å; T428-M430 PolarHBondContact O-N 3.28Å; T428-M430 PolarHBondContact OG1-N 2.97Å; M430-N434 HydrophobicContact CE-CB 3.7Å; M430-N434 WeakPolarHBondContact CE-O 3.29Å; M430-N434 HydrophobicContact SD-CB 3.89Å; M430-I435 HydrophobicContact CB-CD1 4.3Å; M430-I435 HydrophobicContact CB-CG1 3.98Å; M430-I435 HydrophobicContact CE-CG1 3.88Å | ||
| 431 | D | 92 | Very high | 89.1 | Confident | 69 Ų | 69 | 40.7 Ų | 40.7 | 37% | 0.369 | 21% | 0.21 | S | C | . | . | trans | -66.6 | 161.5 | 166.6 | 170.7 | 53.7 | 0 | 0 | 0 | 111.9 | V425 R433 N434 I435 | V425-D431 HydrophobicContact CG2-CB 4.11Å; D431-R433 PolarHBondContact O-N 2.85Å; D431-R433 VanDerWaalsContact O-N 3.11Å; D431-R433 WeakPolarHBondContact OD2-CB 3.31Å; D431-R433 PolarHBondContact OD2-N 3.38Å; D431-R433 VanDerWaalsContact OD2-N 3.11Å; D431-N434 WeakPolarHBondContact O-CA 3.47Å; D431-N434 WeakPolarHBondContact O-CB 3.26Å; D431-N434 PolarHBondContact O-N 3.29Å; D431-I435 WeakPolarHBondContact O-CG1 3.24Å; D431-I435 PolarHBondContact O-N 2.81Å | ||
| 432 | H | 93.4 | Very high | 89.2 | Confident | 49 Ų | 49 | 41.7 Ų | 41.7 | 23% | 0.227 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -47.7 | -40.5 | 175.9 | -60.5 | 120.4 | 0 | 0 | 0 | 112.7 | A422 I435 S436 L466 L469 | A422-H432 WeakPolarHBondContact CB-CD2 2.88Å; A422-H432 WeakPolarHBondContact CB-NE2 3.24Å; H432-I435 PolarHBondContact O-N 3Å; H432-S436 PolarHBondContact O-N 3.33Å; H432-L466 HydrophobicContact CB-CD1 3.59Å; H432-L469 HydrophobicContact CB-CB 4.42Å |
| 433 | R | 93.8 | Very high | 89.1 | Confident | 92 Ų | 92 | 41.6 Ų | 41.6 | 35% | 0.347 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -76 | -20.9 | 179.8 | -165.9 | 165.3 | -157.5 | -106.3 | -8.5 | 114 | D431 K437 D463 L466 | D431-R433 PolarHBondContact O-N 2.85Å; D431-R433 VanDerWaalsContact O-N 3.11Å; D431-R433 WeakPolarHBondContact OD2-CB 3.31Å; D431-R433 PolarHBondContact OD2-N 3.38Å; D431-R433 VanDerWaalsContact OD2-N 3.11Å; R433-K437 WeakPolarHBondContact O-CD 3.29Å; R433-K437 VanDerWaalsContact O-CG 3.29Å; R433-K437 WeakPolarHBondContact O-CG 3.42Å; R433-D463 IonicContact NE-OD1 3.71Å; R433-D463 IonicContact NH2-OD1 2.71Å; R433-D463 PolarHBondContact NH2-OD1 3.29Å; R433-L466 HydrophobicContact CB-CD1 4.16Å; R433-L466 HydrophobicContact CB-CD2 4.26Å; R433-L466 HydrophobicContact CG-CD2 4.1Å |
| 434 | N | 93.7 | Very high | 89 | Confident | 68 Ų | 68 | 32.7 Ų | 32.7 | 36% | 0.364 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -78.9 | -37.2 | 168.7 | -71.7 | -14.1 | 0 | 0 | 0 | 110.7 | A429 M430 D431 C438 | A429-N434 PolarHBondContact O-ND2 2.68Å; M430-N434 HydrophobicContact CE-CB 3.7Å; M430-N434 WeakPolarHBondContact CE-O 3.29Å; M430-N434 HydrophobicContact SD-CB 3.89Å; D431-N434 WeakPolarHBondContact O-CA 3.47Å; D431-N434 WeakPolarHBondContact O-CB 3.26Å; D431-N434 PolarHBondContact O-N 3.29Å; N434-C438 PolarHBondContact O-N 2.83Å; N434-C438 PolarHBondContact O-SG 3.17Å |
| 435 | I | 93.2 | Very high | 89.1 | Confident | 0 Ų | 0 | 34.1 Ų | 34.1 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -67.8 | -46.9 | 178.3 | -66.9 | 175.8 | 0 | 0 | 0 | 111 | L418 V421 A422 M430 D431 H432 K437 C438 L439 L469 | L418-I435 HydrophobicContact CB-CG2 4.22Å; L418-I435 HydrophobicContact CD1-CG2 4.24Å; L418-I435 HydrophobicContact CD2-CG2 3.82Å; L418-I435 HydrophobicContact CG-CG2 4.31Å; V421-I435 HydrophobicContact CB-CD1 4.12Å; V421-I435 HydrophobicContact CG1-CD1 4.05Å; A422-I435 HydrophobicContact CB-CD1 3.96Å; M430-I435 HydrophobicContact CB-CD1 4.3Å; M430-I435 HydrophobicContact CB-CG1 3.98Å; M430-I435 HydrophobicContact CE-CG1 3.88Å; D431-I435 WeakPolarHBondContact O-CG1 3.24Å; D431-I435 PolarHBondContact O-N 2.81Å; H432-I435 PolarHBondContact O-N 3Å; I435-K437 VanDerWaalsContact C-N 3.29Å; I435-K437 PolarHBondContact O-N 2.96Å; I435-C438 PolarHBondContact O-N 3.3Å; I435-L439 HydrophobicContact CG2-CD1 3.7Å; I435-L439 PolarHBondContact O-N 3.07Å; I435-L469 HydrophobicContact CB-CD1 4.22Å; I435-L469 HydrophobicContact CG2-CD1 3.88Å |
| 436 | S | 93.7 | Very high | 88.8 | Confident | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58 | -42.6 | -179.5 | 75.1 | 0 | 0 | 0 | 0 | 111.9 | H432 C438 L439 W440 E462 | H432-S436 PolarHBondContact O-N 3.33Å; S436-C438 VanDerWaalsContact C-N 3.32Å; S436-C438 PolarHBondContact O-N 3.32Å; S436-L439 PolarHBondContact O-N 2.97Å; S436-W440 PolarHBondContact O-N 3.29Å; S436-E462 VanDerWaalsContact CB-O 3.29Å; S436-E462 WeakPolarHBondContact CB-O 3.44Å; S436-E462 PolarHBondContact OG-O 3.24Å |
| 437 | K | 92.6 | Very high | 88.7 | Confident | 48 Ų | 48 | 35.3 Ų | 35.3 | 21% | 0.209 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -56.1 | -37.9 | 173.4 | -79.3 | 179.9 | 169.8 | -177.7 | 0 | 114.8 | F69 R433 I435 E462 | F69-K437 HydrophobicContact CE1-CB 4.49Å; F69-K437 HydrophobicContact CZ-CB 4.39Å; F69-K437 HydrophobicContact CZ-CD 4.34Å; R433-K437 WeakPolarHBondContact O-CD 3.29Å; R433-K437 VanDerWaalsContact O-CG 3.29Å; R433-K437 WeakPolarHBondContact O-CG 3.42Å; I435-K437 VanDerWaalsContact C-N 3.29Å; I435-K437 PolarHBondContact O-N 2.96Å; K437-E462 WeakPolarHBondContact CE-OE2 3.29Å; K437-E462 HydrophobicContact CG-CG 3.84Å; K437-E462 IonicContact NZ-OE2 3.35Å |
| 438 | C | 92.1 | Very high | 88.7 | Confident | 6 Ų | 6 | 35.4 Ų | 35.4 | 4% | 0.041 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -84 | -12.6 | -178.5 | -68.4 | 0 | 0 | 0 | 0 | 113.7 | F73 N434 I435 S436 | F73-C438 HydrophobicContact CE1-CB 4.31Å; N434-C438 PolarHBondContact O-N 2.83Å; N434-C438 PolarHBondContact O-SG 3.17Å; I435-C438 PolarHBondContact O-N 3.3Å; S436-C438 VanDerWaalsContact C-N 3.32Å; S436-C438 PolarHBondContact O-N 3.32Å |
| 439 | L | 92.1 | Very high | 88.7 | Confident | 1 Ų | 1 | 43.7 Ų | 43.7 | 1% | 0.005 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -126.3 | -20 | -168.3 | -64.3 | 179.2 | 0 | 0 | 0 | 115.8 | Y321 K361 F414 L418 I435 S436 P441 T442 L443 | Y321-L439 HydrophobicContact CD1-CD1 4.42Å; Y321-L439 HydrophobicContact CD1-CD2 3.91Å; Y321-L439 HydrophobicContact CG-CD1 4.29Å; Y321-L439 HydrophobicContact CG-CD2 4.27Å; K361-L439 HydrophobicContact CD-CD2 3.8Å; K361-L439 HydrophobicContact CG-CD2 3.73Å; F414-L439 HydrophobicContact CE1-CD1 4.23Å; F414-L439 HydrophobicContact CZ-CD1 4.05Å; F414-L439 HydrophobicContact CZ-CD2 4.47Å; L418-L439 HydrophobicContact CD1-CD1 3.44Å; L418-L439 VanDerWaalsContact CD1-CD1 3.44Å; L418-L439 HydrophobicContact CD2-CD1 3.5Å; L418-L439 HydrophobicContact CG-CD1 4.11Å; I435-L439 HydrophobicContact CG2-CD1 3.7Å; I435-L439 PolarHBondContact O-N 3.07Å; S436-L439 PolarHBondContact O-N 2.97Å; L439-P441 VanDerWaalsContact C-N 3.3Å; L439-T442 PolarHBondContact O-N 3.44Å; L439-T442 VanDerWaalsContact O-N 3.12Å; L439-L443 HydrophobicContact CB-CD1 4.14Å; L439-L443 WeakPolarHBondContact O-CG 3.3Å; L439-L443 PolarHBondContact O-N 3.26Å |
| 440 | W | 91.1 | Very high | 88.5 | Confident | 30 Ų | 30 | 44.1 Ų | 44.1 | 11% | 0.114 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -54.7 | -36.6 | 173.9 | 78.9 | -102.4 | 0 | 0 | 0 | 114.3 | S436 T442 V444 P446 T458 L461 E462 V465 | S436-W440 PolarHBondContact O-N 3.29Å; W440-T442 VanDerWaalsContact C-N 3.3Å; W440-T442 PolarHBondContact O-N 2.95Å; W440-V444 PolarHBondContact O-N 3.14Å; W440-P446 HydrophobicContact CZ3-CG 3.88Å; W440-T458 HydrophobicContact CH2-CG2 3.47Å; W440-T458 VanDerWaalsContact CH2-CG2 3.47Å; W440-T458 HydrophobicContact CZ2-CG2 3.53Å; W440-L461 HydrophobicContact CB-CB 4.37Å; W440-L461 HydrophobicContact CD2-CB 3.87Å; W440-L461 HydrophobicContact CE3-CB 3.75Å; W440-L461 HydrophobicContact CE3-CD1 3.78Å; W440-L461 HydrophobicContact CE3-CG 4.34Å; W440-L461 HydrophobicContact CG-CB 4.15Å; W440-L461 HydrophobicContact CZ3-CB 4.43Å; W440-L461 HydrophobicContact CZ3-CD1 3.75Å; W440-E462 VanDerWaalsContact CD1-CG 3.43Å; W440-E462 HydrophobicContact CG-CG 4.46Å; W440-V465 HydrophobicContact CB-CB 4.36Å; W440-V465 HydrophobicContact CB-CG2 3.74Å |
| 441 | P | 89.1 | Confident | 88.4 | Confident | 22 Ų | 22 | 49.9 Ų | 49.9 | 14% | 0.143 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -65.8 | -35.8 | 178.8 | -19 | 32.7 | 0 | 0 | 0 | 111.8 | L439 R445 | L439-P441 VanDerWaalsContact C-N 3.3Å; P441-R445 WeakPolarHBondContact O-CA 3.35Å; P441-R445 WeakPolarHBondContact O-CG 3.48Å; P441-R445 PolarHBondContact O-N 3.39Å |
| 442 | T | 88.9 | Confident | 88 | Confident | 20 Ų | 20 | 53.5 Ų | 53.5 | 12% | 0.123 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -77 | -40.5 | -179.4 | -58.1 | 0 | 0 | 0 | 0 | 112.4 | K361 F364 A365 L439 W440 R445 | K361-T442 WeakPolarHBondContact O-CG2 3.39Å; F364-T442 HydrophobicContact CB-CG2 3.6Å; A365-T442 HydrophobicContact CB-CG2 4.37Å; L439-T442 PolarHBondContact O-N 3.44Å; L439-T442 VanDerWaalsContact O-N 3.12Å; W440-T442 VanDerWaalsContact C-N 3.3Å; W440-T442 PolarHBondContact O-N 2.95Å; T442-R445 VanDerWaalsContact O-CG 3.28Å; T442-R445 WeakPolarHBondContact O-CG 3.05Å |
| 443 | L | 87.8 | Confident | 87.5 | Confident | 5 Ų | 5 | 54 Ų | 54 | 3% | 0.026 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -77.6 | -36.8 | -174 | -73 | 172 | 0 | 0 | 0 | 113.9 | L371 V372 L411 F414 L439 V465 | L371-L443 HydrophobicContact CD2-CD2 3.94Å; V372-L443 PolarHBondContact N-O 3.39Å; L411-L443 HydrophobicContact CD1-CD2 4.4Å; F414-L443 HydrophobicContact CD1-CD2 3.97Å; F414-L443 HydrophobicContact CE1-CD2 3.94Å; L439-L443 HydrophobicContact CB-CD1 4.14Å; L439-L443 WeakPolarHBondContact O-CG 3.3Å; L439-L443 PolarHBondContact O-N 3.26Å; L443-V465 HydrophobicContact CD1-CG1 4.14Å; L443-V465 HydrophobicContact CD1-CG2 4.42Å |
| 444 | V | 84.7 | Confident | 87 | Confident | 5 Ų | 5 | 50.5 Ų | 50.5 | 3% | 0.03 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -107.8 | -27.8 | -170.4 | -172.1 | 0 | 0 | 0 | 0 | 112.7 | Y377 W440 L461 V465 | Y377-V444 HydrophobicContact CD2-CG1 3.52Å; Y377-V444 HydrophobicContact CE2-CG1 3.74Å; W440-V444 PolarHBondContact O-N 3.14Å; V444-L461 HydrophobicContact CB-CD2 4.37Å; V444-L461 HydrophobicContact CG1-CD2 3.88Å; V444-L461 HydrophobicContact CG2-CD2 4.44Å; V444-V465 HydrophobicContact CG2-CG2 4.49Å |
| 445 | R | 84.3 | Confident | 86.6 | Confident | 53 Ų | 53 | 49 Ų | 49 | 20% | 0.2 | 25% | 0.251 | C | S | . | . | trans | 41.3 | 53.8 | 178 | -46.7 | -163.7 | -47 | -150.7 | 16.3 | 114.5 | F364 A365 L367 S368 P370 P441 T442 | F364-R445 PolarHBondContact O-NH1 3.12Å; A365-R445 PolarHBondContact O-NH1 2.85Å; L367-R445 VanDerWaalsContact O-CZ 3.22Å; L367-R445 PolarHBondContact O-NH1 3.28Å; L367-R445 PolarHBondContact O-NH2 3.4Å; S368-R445 PolarHBondContact O-NH2 3.46Å; S368-R445 VanDerWaalsContact O-NH2 3.1Å; P370-R445 HydrophobicContact CB-CB 4.12Å; P370-R445 HydrophobicContact CB-CG 3.99Å; P441-R445 WeakPolarHBondContact O-CA 3.35Å; P441-R445 WeakPolarHBondContact O-CG 3.48Å; P441-R445 PolarHBondContact O-N 3.39Å; T442-R445 VanDerWaalsContact O-CG 3.28Å; T442-R445 WeakPolarHBondContact O-CG 3.05Å | ||
| 446 | P | 80.9 | Confident | 86.2 | Confident | 26 Ų | 26 | 55.1 Ų | 55.1 | 17% | 0.169 | 28% | 0.281 | C | S | . | . | trans | -65.1 | 146.3 | -175.5 | 28.9 | -38.5 | 0 | 0 | 0 | 114 | Y377 W440 F448 L461 | Y377-P446 HydrophobicContact CD2-CB 4.36Å; Y377-P446 HydrophobicContact CE2-CB 3.6Å; W440-P446 HydrophobicContact CZ3-CG 3.88Å; P446-F448 HydrophobicContact CB-CD2 4.47Å; P446-F448 HydrophobicContact CB-CE1 3.96Å; P446-F448 HydrophobicContact CB-CE2 3.89Å; P446-F448 HydrophobicContact CB-CZ 3.61Å; P446-F448 HydrophobicContact CG-CD2 4.37Å; P446-F448 HydrophobicContact CG-CE1 4.19Å; P446-F448 HydrophobicContact CG-CE2 3.43Å; P446-F448 VanDerWaalsContact CG-CE2 3.43Å; P446-F448 HydrophobicContact CG-CZ 3.33Å; P446-L461 HydrophobicContact CB-CD1 4.32Å; P446-L461 HydrophobicContact CG-CD1 3.84Å | ||
| 447 | E | 79.9 | Confident | 85.8 | Confident | 173 Ų | 173 | 58.2 Ų | 58.2 | 81% | 0.808 | 30% | 0.296 | S | S | * | . | trans | -95 | 138.6 | 165.8 | -64.5 | 176 | -179.4 | 0 | 0 | 109.4 | ||||
| 448 | F | 80.7 | Confident | 85.7 | Confident | 36 Ų | 36 | 57.1 Ų | 57.1 | 16% | 0.158 | 29% | 0.293 | C | S | . | . | trans | -133.4 | 126.1 | -176.9 | -58.4 | -71.6 | 0 | 0 | 0 | 111.5 | P446 S450 M454 M457 L461 | P446-F448 HydrophobicContact CB-CD2 4.47Å; P446-F448 HydrophobicContact CB-CE1 3.96Å; P446-F448 HydrophobicContact CB-CE2 3.89Å; P446-F448 HydrophobicContact CB-CZ 3.61Å; P446-F448 HydrophobicContact CG-CD2 4.37Å; P446-F448 HydrophobicContact CG-CE1 4.19Å; P446-F448 HydrophobicContact CG-CE2 3.43Å; P446-F448 VanDerWaalsContact CG-CE2 3.43Å; P446-F448 HydrophobicContact CG-CZ 3.33Å; F448-S450 VanDerWaalsContact C-N 3.29Å; F448-S450 PolarHBondContact O-N 2.9Å; F448-M454 HydrophobicContact CB-CB 3.95Å; F448-M454 HydrophobicContact CB-CE 4.4Å; F448-M454 HydrophobicContact CD1-CB 4.13Å; F448-M454 HydrophobicContact CD2-CB 3.81Å; F448-M454 HydrophobicContact CD2-CE 3.4Å; F448-M454 HydrophobicContact CD2-CG 3.78Å; F448-M454 HydrophobicContact CD2-SD 4.45Å; F448-M454 HydrophobicContact CE2-CB 4.2Å; F448-M454 HydrophobicContact CE2-CE 3.96Å; F448-M454 HydrophobicContact CE2-CG 3.84Å; F448-M454 HydrophobicContact CG-CB 3.72Å; F448-M454 HydrophobicContact CG-CE 4.26Å; F448-M454 HydrophobicContact CG-CG 4.23Å; F448-M454 HydrophobicContact CZ-CG 4.41Å; F448-M457 HydrophobicContact CD1-CB 4.46Å; F448-M457 HydrophobicContact CE1-CB 3.61Å; F448-M457 HydrophobicContact CE1-CG 4.26Å; F448-M457 HydrophobicContact CZ-CB 4.33Å; F448-L461 HydrophobicContact CE1-CD1 4.4Å; F448-L461 HydrophobicContact CZ-CD1 3.9Å | ||
| 449 | D | 82.2 | Confident | 85.6 | Confident | 174 Ų | 174 | 60.5 Ų | 60.5 | 93% | 0.93 | 31% | 0.309 | S | S | * | . | S | Bend | trans | -71.1 | -21.8 | 179 | -51.8 | -66.3 | 0 | 0 | 0 | 113.8 | ||
| 450 | S | 84.4 | Confident | 85.6 | Confident | 49 Ų | 49 | 62.4 Ų | 62.4 | 34% | 0.343 | 32% | 0.321 | S | S | . | . | trans | -146.9 | 151.4 | -174.4 | 177 | 0 | 0 | 0 | 0 | 111.9 | F448 E452 T453 M454 | F448-S450 VanDerWaalsContact C-N 3.29Å; F448-S450 PolarHBondContact O-N 2.9Å; S450-E452 PolarHBondContact O-N 2.86Å; S450-E452 PolarHBondContact OG-N 3.24Å; S450-T453 PolarHBondContact N-OG1 2.71Å; S450-T453 PolarHBondContact O-N 2.78Å; S450-T453 PolarHBondContact O-OG1 2.87Å; S450-M454 WeakPolarHBondContact O-CB 3.34Å; S450-M454 PolarHBondContact O-N 3.23Å | ||
| 451 | F | 84.9 | Confident | 85.6 | Confident | 122 Ų | 122 | 61 Ų | 61 | 54% | 0.535 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -61.9 | -31.4 | 170.9 | -177.2 | -95.8 | 0 | 0 | 0 | 112.3 | F70 M454 A455 | F70-F451 AromaticContact CE1-CE2 3.74Å; F70-F451 HydrophobicContact CE1-CE2 3.74Å; F70-F451 HydrophobicContact CE1-CZ 4.17Å; F70-F451 AromaticContact CZ-CE2 3.77Å; F70-F451 HydrophobicContact CZ-CE2 3.77Å; F70-F451 AromaticContact CZ-CZ 3.94Å; F70-F451 HydrophobicContact CZ-CZ 3.94Å; F451-M454 HydrophobicContact CD2-SD 4.38Å; F451-A455 WeakPolarHBondContact O-CB 3.46Å; F451-A455 PolarHBondContact O-N 3.22Å |
| 452 | E | 83.6 | Confident | 85.8 | Confident | 144 Ų | 144 | 61 Ų | 61 | 67% | 0.673 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -71.2 | -45.2 | 177.9 | -175 | 175.7 | -166.6 | 0 | 0 | 111.7 | S450 M454 A455 M456 | S450-E452 PolarHBondContact O-N 2.86Å; S450-E452 PolarHBondContact OG-N 3.24Å; E452-M454 VanDerWaalsContact C-N 3.34Å; E452-M454 PolarHBondContact O-N 3.13Å; E452-A455 PolarHBondContact O-N 3.39Å; E452-M456 WeakPolarHBondContact O-CG 3.36Å; E452-M456 PolarHBondContact O-N 3.11Å; E452-M456 VanDerWaalsContact O-N 3.08Å |
| 453 | T | 83.5 | Confident | 85.9 | Confident | 61 Ų | 61 | 62.4 Ų | 62.4 | 37% | 0.374 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -66.1 | -38.9 | 176.5 | 54.9 | 0 | 0 | 0 | 0 | 111.2 | S450 M456 M457 | S450-T453 PolarHBondContact N-OG1 2.71Å; S450-T453 PolarHBondContact O-N 2.78Å; S450-T453 PolarHBondContact O-OG1 2.87Å; T453-M456 PolarHBondContact O-N 2.8Å; T453-M457 VanDerWaalsContact O-CB 3.25Å; T453-M457 WeakPolarHBondContact O-CB 3.43Å; T453-M457 WeakPolarHBondContact O-CG 3.48Å; T453-M457 PolarHBondContact O-N 3.18Å |
| 454 | M | 84.1 | Confident | 86.2 | Confident | 17 Ų | 17 | 62.3 Ų | 62.3 | 8% | 0.084 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -54 | -56 | 168.7 | 174 | -176.8 | -88.1 | 0 | 0 | 111.6 | M74 F77 F448 S450 F451 E452 M456 M457 T458 | M74-M454 HydrophobicContact CE-CE 4.09Å; M74-M454 HydrophobicContact CE-CG 4.3Å; M74-M454 HydrophobicContact CE-SD 3.31Å; M74-M454 WeakPolarHBondContact CE-SD 3.38Å; M74-M454 HydrophobicContact SD-SD 4.35Å; F77-M454 HydrophobicContact CD2-CE 4.35Å; F77-M454 HydrophobicContact CE1-CE 4.02Å; F77-M454 HydrophobicContact CE2-CE 3.49Å; F77-M454 VanDerWaalsContact CE2-CE 3.49Å; F77-M454 HydrophobicContact CE2-SD 3.79Å; F77-M454 HydrophobicContact CZ-CE 3.29Å; F77-M454 HydrophobicContact CZ-SD 3.73Å; F448-M454 HydrophobicContact CB-CB 3.95Å; F448-M454 HydrophobicContact CB-CE 4.4Å; F448-M454 HydrophobicContact CD1-CB 4.13Å; F448-M454 HydrophobicContact CD2-CB 3.81Å; F448-M454 HydrophobicContact CD2-CE 3.4Å; F448-M454 HydrophobicContact CD2-CG 3.78Å; F448-M454 HydrophobicContact CD2-SD 4.45Å; F448-M454 HydrophobicContact CE2-CB 4.2Å; F448-M454 HydrophobicContact CE2-CE 3.96Å; F448-M454 HydrophobicContact CE2-CG 3.84Å; F448-M454 HydrophobicContact CG-CB 3.72Å; F448-M454 HydrophobicContact CG-CE 4.26Å; F448-M454 HydrophobicContact CG-CG 4.23Å; F448-M454 HydrophobicContact CZ-CG 4.41Å; S450-M454 WeakPolarHBondContact O-CB 3.34Å; S450-M454 PolarHBondContact O-N 3.23Å; F451-M454 HydrophobicContact CD2-SD 4.38Å; E452-M454 VanDerWaalsContact C-N 3.34Å; E452-M454 PolarHBondContact O-N 3.13Å; M454-M456 VanDerWaalsContact C-N 3.28Å; M454-M456 PolarHBondContact O-N 3.19Å; M454-M457 PolarHBondContact O-N 3.43Å; M454-T458 HydrophobicContact CG-CG2 4.34Å; M454-T458 VanDerWaalsContact O-CG2 3.22Å; M454-T458 WeakPolarHBondContact O-CG2 3.45Å; M454-T458 PolarHBondContact O-N 2.99Å |
| 455 | A | 85.5 | Confident | 86.6 | Confident | 36 Ų | 36 | 62.1 Ų | 62.1 | 30% | 0.298 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -64 | -27.6 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | F451 E452 T458 | F451-A455 WeakPolarHBondContact O-CB 3.46Å; F451-A455 PolarHBondContact O-N 3.22Å; E452-A455 PolarHBondContact O-N 3.39Å; A455-T458 PolarHBondContact O-OG1 2.96Å |
| 456 | M | 84 | Confident | 87 | Confident | 129 Ų | 129 | 60.6 Ų | 60.6 | 64% | 0.635 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -78.8 | -44.8 | 172.1 | -64.9 | -62.5 | 97.3 | 0 | 0 | 111.8 | E452 T453 M454 T458 | E452-M456 WeakPolarHBondContact O-CG 3.36Å; E452-M456 PolarHBondContact O-N 3.11Å; E452-M456 VanDerWaalsContact O-N 3.08Å; T453-M456 PolarHBondContact O-N 2.8Å; M454-M456 VanDerWaalsContact C-N 3.28Å; M454-M456 PolarHBondContact O-N 3.19Å; M456-T458 PolarHBondContact O-N 3.49Å |
| 457 | M | 86.3 | Confident | 87.6 | Confident | 65 Ų | 65 | 59.6 Ų | 59.6 | 32% | 0.32 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -72.3 | -25.3 | -176 | -68.9 | -69.1 | 169.8 | 0 | 0 | 113.6 | I381 F448 T453 M454 Q459 T460 L461 | I381-M457 HydrophobicContact CD1-SD 4.41Å; I381-M457 HydrophobicContact CG2-CE 4.28Å; I381-M457 HydrophobicContact CG2-SD 3.86Å; F448-M457 HydrophobicContact CD1-CB 4.46Å; F448-M457 HydrophobicContact CE1-CB 3.61Å; F448-M457 HydrophobicContact CE1-CG 4.26Å; F448-M457 HydrophobicContact CZ-CB 4.33Å; T453-M457 VanDerWaalsContact O-CB 3.25Å; T453-M457 WeakPolarHBondContact O-CB 3.43Å; T453-M457 WeakPolarHBondContact O-CG 3.48Å; T453-M457 PolarHBondContact O-N 3.18Å; M454-M457 PolarHBondContact O-N 3.43Å; M457-Q459 VanDerWaalsContact C-N 3.26Å; M457-Q459 PolarHBondContact O-N 3.47Å; M457-T460 PolarHBondContact O-N 3.09Å; M457-T460 VanDerWaalsContact O-N 3.16Å; M457-L461 WeakPolarHBondContact O-CG 3.49Å; M457-L461 PolarHBondContact O-N 3.35Å |
| 458 | T | 89.1 | Confident | 88.2 | Confident | 25 Ų | 25 | 51.8 Ų | 51.8 | 15% | 0.153 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -56.4 | -38.2 | 178 | 50.2 | 0 | 0 | 0 | 0 | 112.6 | W440 M454 A455 M456 L461 E462 | W440-T458 HydrophobicContact CH2-CG2 3.47Å; W440-T458 VanDerWaalsContact CH2-CG2 3.47Å; W440-T458 HydrophobicContact CZ2-CG2 3.53Å; M454-T458 HydrophobicContact CG-CG2 4.34Å; M454-T458 VanDerWaalsContact O-CG2 3.22Å; M454-T458 WeakPolarHBondContact O-CG2 3.45Å; M454-T458 PolarHBondContact O-N 2.99Å; A455-T458 PolarHBondContact O-OG1 2.96Å; M456-T458 PolarHBondContact O-N 3.49Å; T458-L461 PolarHBondContact O-N 3.06Å; T458-E462 WeakPolarHBondContact O-CG 3.39Å; T458-E462 PolarHBondContact O-N 2.88Å |
| 459 | Q | 90.2 | Very high | 88.7 | Confident | 78 Ų | 78 | 50.1 Ų | 50.1 | 36% | 0.364 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -69.6 | -42.8 | 178.1 | -170.6 | 60.6 | 87.5 | 0 | 0 | 111.5 | M457 L461 E462 D463 | M457-Q459 VanDerWaalsContact C-N 3.26Å; M457-Q459 PolarHBondContact O-N 3.47Å; Q459-L461 PolarHBondContact O-N 2.88Å; Q459-E462 PolarHBondContact NE2-OE2 3.34Å; Q459-E462 PolarHBondContact O-N 3.21Å; Q459-D463 PolarHBondContact NE2-OD1 2.97Å; Q459-D463 PolarHBondContact NE2-OD2 3.45Å; Q459-D463 WeakPolarHBondContact O-CB 3.28Å; Q459-D463 PolarHBondContact O-N 3.1Å |
| 460 | T | 91.9 | Very high | 89.2 | Confident | 41 Ų | 41 | 46.7 Ų | 46.7 | 25% | 0.252 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -59.2 | -30.3 | 174.9 | -43.8 | 0 | 0 | 0 | 0 | 112.3 | I381 M384 M457 L464 | I381-T460 HydrophobicContact CD1-CG2 3.74Å; M384-T460 HydrophobicContact CB-CG2 3.78Å; M384-T460 HydrophobicContact CG-CG2 4.45Å; M457-T460 PolarHBondContact O-N 3.09Å; M457-T460 VanDerWaalsContact O-N 3.16Å; T460-L464 VanDerWaalsContact O-CB 3.26Å; T460-L464 WeakPolarHBondContact O-CB 3.33Å; T460-L464 PolarHBondContact O-N 3.41Å |
| 461 | L | 91.2 | Very high | 89.5 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -81.3 | -39.5 | 178.5 | -70.5 | 165.7 | 0 | 0 | 0 | 113.7 | Y377 I381 W440 V444 P446 F448 M457 T458 Q459 D463 L464 V465 | Y377-L461 HydrophobicContact CE2-CD1 4.31Å; Y377-L461 HydrophobicContact CE2-CD2 3.7Å; I381-L461 HydrophobicContact CD1-CD2 3.94Å; I381-L461 HydrophobicContact CD1-CG 4.23Å; W440-L461 HydrophobicContact CB-CB 4.37Å; W440-L461 HydrophobicContact CD2-CB 3.87Å; W440-L461 HydrophobicContact CE3-CB 3.75Å; W440-L461 HydrophobicContact CE3-CD1 3.78Å; W440-L461 HydrophobicContact CE3-CG 4.34Å; W440-L461 HydrophobicContact CG-CB 4.15Å; W440-L461 HydrophobicContact CZ3-CB 4.43Å; W440-L461 HydrophobicContact CZ3-CD1 3.75Å; V444-L461 HydrophobicContact CB-CD2 4.37Å; V444-L461 HydrophobicContact CG1-CD2 3.88Å; V444-L461 HydrophobicContact CG2-CD2 4.44Å; P446-L461 HydrophobicContact CB-CD1 4.32Å; P446-L461 HydrophobicContact CG-CD1 3.84Å; F448-L461 HydrophobicContact CE1-CD1 4.4Å; F448-L461 HydrophobicContact CZ-CD1 3.9Å; M457-L461 WeakPolarHBondContact O-CG 3.49Å; M457-L461 PolarHBondContact O-N 3.35Å; T458-L461 PolarHBondContact O-N 3.06Å; Q459-L461 PolarHBondContact O-N 2.88Å; L461-D463 PolarHBondContact O-N 2.95Å; L461-L464 HydrophobicContact CD2-CD2 4.28Å; L461-L464 PolarHBondContact O-N 3.06Å; L461-V465 PolarHBondContact O-N 3.5Å; L461-V465 VanDerWaalsContact O-N 3.13Å |
| 462 | E | 92.6 | Very high | 89.5 | Confident | 23 Ų | 23 | 43.7 Ų | 43.7 | 11% | 0.107 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -56.7 | -43.5 | 167.1 | -72.4 | 179.2 | -179.6 | 0 | 0 | 111.2 | S436 K437 W440 T458 Q459 L466 | S436-E462 VanDerWaalsContact CB-O 3.29Å; S436-E462 WeakPolarHBondContact CB-O 3.44Å; S436-E462 PolarHBondContact OG-O 3.24Å; K437-E462 WeakPolarHBondContact CE-OE2 3.29Å; K437-E462 HydrophobicContact CG-CG 3.84Å; K437-E462 IonicContact NZ-OE2 3.35Å; W440-E462 VanDerWaalsContact CD1-CG 3.43Å; W440-E462 HydrophobicContact CG-CG 4.46Å; T458-E462 WeakPolarHBondContact O-CG 3.39Å; T458-E462 PolarHBondContact O-N 2.88Å; Q459-E462 PolarHBondContact NE2-OE2 3.34Å; Q459-E462 PolarHBondContact O-N 3.21Å; E462-L466 WeakPolarHBondContact O-CB 3.49Å; E462-L466 PolarHBondContact O-N 2.93Å |
| 463 | D | 92.7 | Very high | 89.7 | Confident | 48 Ų | 48 | 38.7 Ų | 38.7 | 26% | 0.257 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -77.7 | -29.8 | -177 | -62.5 | -19.5 | 0 | 0 | 0 | 111.6 | M384 R433 Q459 L461 L466 V467 | M384-D463 HydrophobicContact CE-CB 3.98Å; R433-D463 IonicContact NE-OD1 3.71Å; R433-D463 IonicContact NH2-OD1 2.71Å; R433-D463 PolarHBondContact NH2-OD1 3.29Å; Q459-D463 PolarHBondContact NE2-OD1 2.97Å; Q459-D463 PolarHBondContact NE2-OD2 3.45Å; Q459-D463 WeakPolarHBondContact O-CB 3.28Å; Q459-D463 PolarHBondContact O-N 3.1Å; L461-D463 PolarHBondContact O-N 2.95Å; D463-L466 PolarHBondContact O-N 3.39Å; D463-V467 WeakPolarHBondContact O-CB 3.46Å; D463-V467 VanDerWaalsContact O-CG2 3.29Å; D463-V467 WeakPolarHBondContact O-CG2 3.47Å; D463-V467 PolarHBondContact O-N 2.62Å |
| 464 | L | 92.9 | Very high | 89.8 | Confident | 3 Ų | 3 | 35.9 Ų | 35.9 | 2% | 0.016 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.7 | -53.2 | 170.1 | 173.4 | 63 | 0 | 0 | 0 | 110.7 | L380 M384 L396 T460 L461 L466 V467 L468 | L380-L464 HydrophobicContact CB-CD1 4.48Å; L380-L464 HydrophobicContact CB-CD2 4.12Å; L380-L464 HydrophobicContact CD1-CD2 4.49Å; M384-L464 HydrophobicContact CE-CB 4.38Å; M384-L464 HydrophobicContact CG-CB 4.02Å; M384-L464 HydrophobicContact CG-CD1 3.76Å; M384-L464 HydrophobicContact CG-CG 4.42Å; M384-L464 HydrophobicContact SD-CB 4.19Å; M384-L464 HydrophobicContact SD-CD1 3.9Å; L396-L464 HydrophobicContact CD1-CD1 4.45Å; L396-L464 HydrophobicContact CD2-CD1 3.71Å; T460-L464 VanDerWaalsContact O-CB 3.26Å; T460-L464 WeakPolarHBondContact O-CB 3.33Å; T460-L464 PolarHBondContact O-N 3.41Å; L461-L464 HydrophobicContact CD2-CD2 4.28Å; L461-L464 PolarHBondContact O-N 3.06Å; L464-L466 VanDerWaalsContact C-N 3.28Å; L464-L466 PolarHBondContact O-N 3.01Å; L464-V467 PolarHBondContact O-N 2.92Å; L464-L468 HydrophobicContact CD1-CD1 4.46Å; L464-L468 HydrophobicContact CG-CD1 4.48Å; L464-L468 WeakPolarHBondContact O-CG 3.38Å; L464-L468 PolarHBondContact O-N 3.38Å |
| 465 | V | 92.8 | Very high | 89.6 | Confident | 2 Ų | 2 | 35.3 Ų | 35.3 | 1% | 0.012 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -67.5 | -31.4 | 180 | 176.8 | 0 | 0 | 0 | 0 | 111.2 | W440 L443 V444 L461 L468 L469 | W440-V465 HydrophobicContact CB-CB 4.36Å; W440-V465 HydrophobicContact CB-CG2 3.74Å; L443-V465 HydrophobicContact CD1-CG1 4.14Å; L443-V465 HydrophobicContact CD1-CG2 4.42Å; V444-V465 HydrophobicContact CG2-CG2 4.49Å; L461-V465 PolarHBondContact O-N 3.5Å; L461-V465 VanDerWaalsContact O-N 3.13Å; V465-L468 PolarHBondContact O-N 3.42Å; V465-L469 HydrophobicContact CG1-CD1 4.2Å; V465-L469 WeakPolarHBondContact O-CG 3.31Å; V465-L469 PolarHBondContact O-N 3.02Å |
| 466 | L | 93.9 | Very high | 89.1 | Confident | 20 Ų | 20 | 38.2 Ų | 38.2 | 11% | 0.105 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.9 | -50.2 | 171.1 | 179.8 | 58.9 | 0 | 0 | 0 | 111.9 | H432 R433 E462 D463 L464 L468 L469 E470 | H432-L466 HydrophobicContact CB-CD1 3.59Å; R433-L466 HydrophobicContact CB-CD1 4.16Å; R433-L466 HydrophobicContact CB-CD2 4.26Å; R433-L466 HydrophobicContact CG-CD2 4.1Å; E462-L466 WeakPolarHBondContact O-CB 3.49Å; E462-L466 PolarHBondContact O-N 2.93Å; D463-L466 PolarHBondContact O-N 3.39Å; L464-L466 VanDerWaalsContact C-N 3.28Å; L464-L466 PolarHBondContact O-N 3.01Å; L466-L468 VanDerWaalsContact C-N 3.27Å; L466-L468 PolarHBondContact O-N 2.75Å; L466-L469 PolarHBondContact O-N 3.19Å; L466-L469 VanDerWaalsContact O-N 3.07Å; L466-E470 HydrophobicContact CD1-CG 4.03Å; L466-E470 WeakPolarHBondContact CD1-OE1 3.49Å; L466-E470 HydrophobicContact CG-CG 4.42Å; L466-E470 WeakPolarHBondContact O-CG 3.44Å; L466-E470 PolarHBondContact O-N 2.96Å |
| 467 | V | 93 | Very high | 87.9 | Confident | 6 Ų | 6 | 37.9 Ų | 37.9 | 4% | 0.036 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -59.9 | -38.4 | 177.6 | 168.3 | 0 | 0 | 0 | 0 | 111.4 | M384 L396 D463 L464 N471 I474 | M384-V467 HydrophobicContact CE-CG2 4.19Å; M384-V467 HydrophobicContact SD-CG2 4.43Å; L396-V467 HydrophobicContact CD1-CG1 3.7Å; D463-V467 WeakPolarHBondContact O-CB 3.46Å; D463-V467 VanDerWaalsContact O-CG2 3.29Å; D463-V467 WeakPolarHBondContact O-CG2 3.47Å; D463-V467 PolarHBondContact O-N 2.62Å; L464-V467 PolarHBondContact O-N 2.92Å; V467-N471 WeakPolarHBondContact O-CB 3.38Å; V467-N471 PolarHBondContact O-N 3.24Å; V467-N471 VanDerWaalsContact O-N 3.15Å; V467-N471 PolarHBondContact O-ND2 2.68Å; V467-I474 HydrophobicContact CG1-CD1 3.92Å |
| 468 | L | 92.3 | Very high | 88 | Confident | 9 Ų | 9 | 36.6 Ų | 36.6 | 5% | 0.047 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -66.3 | -38.9 | 174.2 | -65.2 | 178.4 | 0 | 0 | 0 | 112.6 | L400 L415 R419 L464 V465 L466 I474 | L400-L468 HydrophobicContact CD1-CD2 3.6Å; L415-L468 HydrophobicContact CD1-CB 4.26Å; R419-L468 PolarHBondContact NH2-O 3.23Å; L464-L468 HydrophobicContact CD1-CD1 4.46Å; L464-L468 HydrophobicContact CG-CD1 4.48Å; L464-L468 WeakPolarHBondContact O-CG 3.38Å; L464-L468 PolarHBondContact O-N 3.38Å; V465-L468 PolarHBondContact O-N 3.42Å; L466-L468 VanDerWaalsContact C-N 3.27Å; L466-L468 PolarHBondContact O-N 2.75Å; L468-I474 HydrophobicContact CD2-CB 4.35Å; L468-I474 HydrophobicContact CD2-CD1 4.13Å; L468-I474 HydrophobicContact CD2-CG2 3.65Å |
| 469 | L | 92.4 | Very high | 88 | Confident | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.005 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -66.8 | -47.4 | 175.7 | -75.8 | 166.8 | 0 | 0 | 0 | 111.7 | L415 L418 R419 H432 I435 V465 L466 N471 | L415-L469 HydrophobicContact CD2-CD2 3.56Å; L415-L469 HydrophobicContact CD2-CG 3.94Å; L418-L469 HydrophobicContact CB-CD2 3.53Å; L418-L469 HydrophobicContact CD1-CD2 4.22Å; R419-L469 WeakPolarHBondContact CG-O 3.42Å; R419-L469 PolarHBondContact NE-O 3.29Å; H432-L469 HydrophobicContact CB-CB 4.42Å; I435-L469 HydrophobicContact CB-CD1 4.22Å; I435-L469 HydrophobicContact CG2-CD1 3.88Å; V465-L469 HydrophobicContact CG1-CD1 4.2Å; V465-L469 WeakPolarHBondContact O-CG 3.31Å; V465-L469 PolarHBondContact O-N 3.02Å; L466-L469 PolarHBondContact O-N 3.19Å; L466-L469 VanDerWaalsContact O-N 3.07Å; L469-N471 VanDerWaalsContact C-N 3.32Å; L469-N471 PolarHBondContact O-N 3.31Å |
| 470 | E | 91.8 | Very high | 87.8 | Confident | 101 Ų | 101 | 34.9 Ų | 34.9 | 47% | 0.472 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -65.3 | -30.3 | -177.9 | -71.3 | 175.4 | 167.4 | 0 | 0 | 113.7 | L466 P472 | L466-E470 HydrophobicContact CD1-CG 4.03Å; L466-E470 WeakPolarHBondContact CD1-OE1 3.49Å; L466-E470 HydrophobicContact CG-CG 4.42Å; L466-E470 WeakPolarHBondContact O-CG 3.44Å; L466-E470 PolarHBondContact O-N 2.96Å; E470-P472 VanDerWaalsContact O-CD 3.26Å; E470-P472 WeakPolarHBondContact O-CD 3.48Å |
| 471 | N | 90.6 | Very high | 87.6 | Confident | 47 Ų | 47 | 34.5 Ų | 34.5 | 25% | 0.251 | 19% | 0.192 | S | C | . | . | trans | -117 | 83 | -170.9 | -61.5 | -93.6 | 0 | 0 | 0 | 111.6 | V467 L469 S473 I474 | V467-N471 WeakPolarHBondContact O-CB 3.38Å; V467-N471 PolarHBondContact O-N 3.24Å; V467-N471 VanDerWaalsContact O-N 3.15Å; V467-N471 PolarHBondContact O-ND2 2.68Å; L469-N471 VanDerWaalsContact C-N 3.32Å; L469-N471 PolarHBondContact O-N 3.31Å; N471-S473 PolarHBondContact O-N 3.02Å; N471-I474 HydrophobicContact CB-CD1 3.62Å; N471-I474 HydrophobicContact CB-CG1 3.81Å; N471-I474 PolarHBondContact O-N 3.18Å; N471-I474 VanDerWaalsContact O-N 3.1Å | ||
| 472 | P | 85.6 | Confident | 87.4 | Confident | 61 Ų | 61 | 36.7 Ų | 36.7 | 40% | 0.396 | 20% | 0.204 | S | C | . | . | G | 310 helix | trans | -56.2 | -34.5 | -179.5 | 21.1 | -32.6 | 0 | 0 | 0 | 113.5 | E470 I474 I475 | E470-P472 VanDerWaalsContact O-CD 3.26Å; E470-P472 WeakPolarHBondContact O-CD 3.48Å; P472-I474 PolarHBondContact O-N 3.28Å; P472-I475 PolarHBondContact O-N 3.35Å |
| 473 | S | 86.3 | Confident | 87 | Confident | 40 Ų | 40 | 37.6 Ų | 37.6 | 28% | 0.28 | 21% | 0.211 | S | C | . | . | G | 310 helix | trans | -66.9 | -2.8 | 179.4 | 65.5 | 0 | 0 | 0 | 0 | 115.1 | R397 N471 I475 E476 | R397-S473 PolarHBondContact NE-O 3.22Å; R397-S473 PolarHBondContact NH2-O 3.1Å; N471-S473 PolarHBondContact O-N 3.02Å; S473-I475 VanDerWaalsContact C-N 3.27Å; S473-I475 PolarHBondContact O-N 2.97Å; S473-E476 VanDerWaalsContact CA-OE2 3.28Å; S473-E476 WeakPolarHBondContact CA-OE2 3.43Å; S473-E476 WeakPolarHBondContact CB-OE2 3.46Å |
| 474 | I | 85.9 | Confident | 86.6 | Confident | 2 Ų | 2 | 36.9 Ų | 36.9 | 1% | 0.01 | 21% | 0.207 | C | C | . | . | G | 310 helix | trans | -69.1 | -26.3 | 171.1 | -68.4 | 178.1 | 0 | 0 | 0 | 111.9 | T393 L396 R397 L400 V467 L468 N471 P472 | T393-I474 HydrophobicContact CG2-CD1 4.08Å; T393-I474 HydrophobicContact CG2-CG1 3.7Å; L396-I474 HydrophobicContact CB-CD1 4.43Å; L396-I474 HydrophobicContact CB-CG2 4.06Å; L396-I474 HydrophobicContact CD1-CD1 4.17Å; R397-I474 WeakPolarHBondContact CG-O 3.18Å; L400-I474 HydrophobicContact CD1-CG2 3.6Å; V467-I474 HydrophobicContact CG1-CD1 3.92Å; L468-I474 HydrophobicContact CD2-CB 4.35Å; L468-I474 HydrophobicContact CD2-CD1 4.13Å; L468-I474 HydrophobicContact CD2-CG2 3.65Å; N471-I474 HydrophobicContact CB-CD1 3.62Å; N471-I474 HydrophobicContact CB-CG1 3.81Å; N471-I474 PolarHBondContact O-N 3.18Å; N471-I474 VanDerWaalsContact O-N 3.1Å; P472-I474 PolarHBondContact O-N 3.28Å |
| 475 | I | 80.2 | Confident | 86.1 | Confident | 5 Ų | 5 | 39.5 Ų | 39.5 | 3% | 0.026 | 22% | 0.222 | C | C | . | . | S | Bend | trans | -116.7 | -0.2 | -168.7 | -44.6 | -177.3 | 0 | 0 | 0 | 112.2 | L400 R408 L411 R412 L415 P472 S473 | L400-I475 HydrophobicContact CD1-CG1 4.42Å; R408-I475 HydrophobicContact CG-CG2 3.81Å; L411-I475 HydrophobicContact CD2-CD1 4.43Å; L411-I475 HydrophobicContact CG-CD1 4.33Å; R412-I475 HydrophobicContact CB-CG2 3.84Å; R412-I475 HydrophobicContact CG-CG2 4.48Å; L415-I475 HydrophobicContact CD1-CD1 3.26Å; P472-I475 PolarHBondContact O-N 3.35Å; S473-I475 VanDerWaalsContact C-N 3.27Å; S473-I475 PolarHBondContact O-N 2.97Å |
| 476 | E | 75.4 | Confident | 85.6 | Confident | 97 Ų | 97 | 42.6 Ų | 42.6 | 45% | 0.453 | 24% | 0.239 | S | C | . | . | trans | -60.1 | 145.6 | 164.2 | -69.8 | 171.7 | 163.8 | 0 | 0 | 110.5 | S473 | S473-E476 VanDerWaalsContact CA-OE2 3.28Å; S473-E476 WeakPolarHBondContact CA-OE2 3.43Å; S473-E476 WeakPolarHBondContact CB-OE2 3.46Å | ||
| 477 | P | 59.6 | Low | 84.8 | Confident | 122 Ų | 122 | 44.6 Ų | 44.6 | 79% | 0.792 | 25% | 0.252 | S | S | * | . | trans | -62.9 | 0 | -169.5 | 25.1 | -34.9 | 0 | 0 | 0 | 114.5 | Q401 | Q401-P477 PolarHBondContact NE2-OXT 3.39Š|
Retrieved 477 of 477 residues in 129.3 ms
(Link to these results)