| 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 | 33.7 | Very low | 48.1 | Very low | 242 Ų | 242 | 136.4 Ų | 136.4 | 100% | 1.192 | 79% | 0.79 | S | S | * | * | 0 | 125.2 | 0 | -103.6 | 68.8 | 155.2 | 0 | 0 | 108.5 | |||||
| 2 | N | 58.5 | Low | 48.5 | Very low | 157 Ų | 157 | 130.3 Ų | 130.3 | 84% | 0.84 | 77% | 0.767 | S | S | * | * | trans | -53.9 | 168 | 161.2 | -67 | -8.3 | 0 | 0 | 0 | 110.4 | ||||
| 3 | P | 44.4 | Very low | 48.6 | Very low | 117 Ų | 117 | 123.2 Ų | 123.2 | 76% | 0.76 | 74% | 0.739 | S | S | * | * | cis | -136.1 | 147.5 | 25.7 | 27.8 | -3 | 0 | 0 | 0 | 114.6 | ||||
| 4 | A | 40.9 | Very low | 48.9 | Very low | 92 Ų | 92 | 123.9 Ų | 123.9 | 76% | 0.76 | 74% | 0.736 | S | S | * | * | 52.5 | 114.3 | 88.1 | 0 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 5 | L | 42 | Very low | 49 | Very low | 186 Ų | 186 | 125.7 Ų | 125.7 | 97% | 0.974 | 73% | 0.731 | S | S | * | * | trans | 89.2 | 112.8 | 138.8 | -141.7 | 90 | 0 | 0 | 0 | 119.4 | ||||
| 6 | G | 43.9 | Very low | 49.4 | Very low | 72 Ų | 72 | 125.1 Ų | 125.1 | 74% | 0.742 | 72% | 0.723 | S | S | * | * | trans | 156.3 | 123.6 | 155.4 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 7 | N | 52.7 | Low | 49.9 | Very low | 126 Ų | 126 | 120.7 Ų | 120.7 | 67% | 0.674 | 71% | 0.705 | S | S | * | * | cis | -168.7 | 141.3 | 7.7 | -169.8 | 17.9 | 0 | 0 | 0 | 105.1 | T9 | N7-T9 PolarHBondContact O-N 2.75Å; N7-T9 PolarHBondContact O-OG1 3.17Å | ||
| 8 | Q | 50.8 | Low | 50.3 | Low | 183 Ų | 183 | 119.6 Ų | 119.6 | 86% | 0.855 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | 39.8 | -170.8 | -64.5 | 178.6 | 21.6 | 0 | 0 | 114.7 | ||
| 9 | T | 53.8 | Low | 51 | Low | 98 Ų | 98 | 116.9 Ų | 116.9 | 60% | 0.601 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.5 | -6.3 | -179.5 | 27.7 | 0 | 0 | 0 | 0 | 114.2 | N7 | N7-T9 PolarHBondContact O-N 2.75Å; N7-T9 PolarHBondContact O-OG1 3.17Å |
| 10 | D | 52.8 | Low | 51.6 | Low | 125 Ų | 125 | 114.4 Ų | 114.4 | 67% | 0.668 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -84.4 | -21.3 | -171.5 | -59 | -35.8 | 0 | 0 | 0 | 114.2 | G13 L14 | D10-G13 PolarHBondContact O-N 3Å; D10-L14 WeakPolarHBondContact O-CB 3.21Å; D10-L14 PolarHBondContact O-N 3.2Å |
| 11 | V | 55.3 | Low | 52.1 | Low | 102 Ų | 102 | 113.6 Ų | 113.6 | 62% | 0.618 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -71.4 | -40.9 | -174.7 | -66.3 | 0 | 0 | 0 | 0 | 112.4 | L14 F15 | V11-L14 PolarHBondContact O-N 2.85Å; V11-F15 WeakPolarHBondContact O-CD2 3.12Å; V11-F15 PolarHBondContact O-N 3.27Å |
| 12 | A | 53.3 | Low | 53.6 | Low | 63 Ų | 63 | 104.4 Ų | 104.4 | 52% | 0.521 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -68.9 | -38.7 | 177 | 0 | 0 | 0 | 0 | 0 | 111.9 | F15 L16 | A12-F15 PolarHBondContact O-N 2.7Å; A12-L16 WeakPolarHBondContact O-CG 3.22Å; A12-L16 PolarHBondContact O-N 3.03Å |
| 13 | G | 50.3 | Low | 53.7 | Low | 39 Ų | 39 | 102.3 Ų | 102.3 | 40% | 0.402 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -63.4 | -40.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | D10 A17 | D10-G13 PolarHBondContact O-N 3Å; G13-A17 VanDerWaalsContact O-CB 3.22Å; G13-A17 WeakPolarHBondContact O-CB 3.47Å; G13-A17 PolarHBondContact O-N 3.34Å |
| 14 | L | 51.8 | Low | 54.4 | Low | 132 Ų | 132 | 102.8 Ų | 102.8 | 69% | 0.691 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -67.9 | -40.6 | 178.1 | -159.5 | 88.7 | 0 | 0 | 0 | 112.4 | D10 V11 A17 N18 | D10-L14 WeakPolarHBondContact O-CB 3.21Å; D10-L14 PolarHBondContact O-N 3.2Å; V11-L14 PolarHBondContact O-N 2.85Å; L14-A17 PolarHBondContact O-N 3.38Å; L14-N18 WeakPolarHBondContact O-CB 3.47Å; L14-N18 PolarHBondContact O-N 3.27Å |
| 15 | F | 51.3 | Low | 55.5 | Low | 151 Ų | 151 | 106.1 Ų | 106.1 | 66% | 0.662 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -65.2 | -43.3 | 176 | -86.2 | -73.6 | 0 | 0 | 0 | 112 | V11 A12 N18 S19 | V11-F15 WeakPolarHBondContact O-CD2 3.12Å; V11-F15 PolarHBondContact O-N 3.27Å; A12-F15 PolarHBondContact O-N 2.7Å; F15-N18 PolarHBondContact O-N 3.13Å; F15-S19 WeakPolarHBondContact O-CB 3.18Å; F15-S19 PolarHBondContact O-N 3.36Å; F15-S19 PolarHBondContact O-OG 3.32Å |
| 16 | L | 55.6 | Low | 56.5 | Low | 117 Ų | 117 | 99.9 Ų | 99.9 | 61% | 0.613 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -65.7 | -40.6 | 174.5 | -72.1 | 171.3 | 0 | 0 | 0 | 111.6 | A12 S19 S20 | A12-L16 WeakPolarHBondContact O-CG 3.22Å; A12-L16 PolarHBondContact O-N 3.03Å; L16-S19 PolarHBondContact O-N 2.78Å; L16-S20 WeakPolarHBondContact O-CB 3.43Å; L16-S20 PolarHBondContact O-N 3.23Å; L16-S20 PolarHBondContact O-OG 2.81Å; L16-S20 VanDerWaalsContact O-OG 3.14Å |
| 17 | A | 56.9 | Low | 57.2 | Low | 50 Ų | 50 | 100.1 Ų | 100.1 | 41% | 0.413 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61.6 | -46.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | G13 L14 S19 S20 E21 | G13-A17 VanDerWaalsContact O-CB 3.22Å; G13-A17 WeakPolarHBondContact O-CB 3.47Å; G13-A17 PolarHBondContact O-N 3.34Å; L14-A17 PolarHBondContact O-N 3.38Å; A17-S19 VanDerWaalsContact C-N 3.3Å; A17-S19 PolarHBondContact O-N 3.3Å; A17-S20 PolarHBondContact O-N 2.79Å; A17-E21 WeakPolarHBondContact O-CG 3.21Å; A17-E21 PolarHBondContact O-N 3.5Å |
| 18 | N | 58.2 | Low | 57.5 | Low | 101 Ų | 101 | 103.8 Ų | 103.8 | 54% | 0.54 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.5 | -36.7 | 176.6 | -165.2 | 22.5 | 0 | 0 | 0 | 111.8 | L14 F15 A22 | L14-N18 WeakPolarHBondContact O-CB 3.47Å; L14-N18 PolarHBondContact O-N 3.27Å; F15-N18 PolarHBondContact O-N 3.13Å; N18-A22 WeakPolarHBondContact O-CB 3.1Å; N18-A22 PolarHBondContact O-N 3.16Å |
| 19 | S | 62.1 | Low | 58 | Low | 68 Ų | 68 | 99.8 Ų | 99.8 | 48% | 0.476 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.9 | -40.6 | 175.2 | -53.3 | 0 | 0 | 0 | 0 | 112 | F15 L16 A17 A22 L23 | F15-S19 WeakPolarHBondContact O-CB 3.18Å; F15-S19 PolarHBondContact O-N 3.36Å; F15-S19 PolarHBondContact O-OG 3.32Å; L16-S19 PolarHBondContact O-N 2.78Å; A17-S19 VanDerWaalsContact C-N 3.3Å; A17-S19 PolarHBondContact O-N 3.3Å; S19-A22 PolarHBondContact O-N 3.49Å; S19-L23 WeakPolarHBondContact O-CA 3.38Å; S19-L23 WeakPolarHBondContact O-CB 3.17Å; S19-L23 PolarHBondContact O-N 3.15Å |
| 20 | S | 63.4 | Low | 58.1 | Low | 67 Ų | 67 | 99 Ų | 99 | 47% | 0.469 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -66.2 | -45.3 | 175.5 | -70.5 | 0 | 0 | 0 | 0 | 110.7 | L16 A17 A22 L23 E24 | L16-S20 WeakPolarHBondContact O-CB 3.43Å; L16-S20 PolarHBondContact O-N 3.23Å; L16-S20 PolarHBondContact O-OG 2.81Å; L16-S20 VanDerWaalsContact O-OG 3.14Å; A17-S20 PolarHBondContact O-N 2.79Å; S20-A22 VanDerWaalsContact C-N 3.35Å; S20-A22 PolarHBondContact O-N 3.44Å; S20-L23 PolarHBondContact O-N 3.03Å; S20-E24 VanDerWaalsContact O-CB 3.25Å; S20-E24 WeakPolarHBondContact O-CB 3.46Å; S20-E24 VanDerWaalsContact O-CG 3.26Å; S20-E24 WeakPolarHBondContact O-CG 2.82Å; S20-E24 PolarHBondContact O-N 2.87Å |
| 21 | E | 63.5 | Low | 58.2 | Low | 98 Ų | 98 | 96.1 Ų | 96.1 | 46% | 0.458 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.3 | -40 | 174.9 | -70.7 | -165.7 | 153.3 | 0 | 0 | 111.9 | A17 R25 | A17-E21 WeakPolarHBondContact O-CG 3.21Å; A17-E21 PolarHBondContact O-N 3.5Å; E21-R25 VanDerWaalsContact O-CB 3.3Å; E21-R25 WeakPolarHBondContact O-CB 3.5Å; E21-R25 VanDerWaalsContact O-CG 3.25Å; E21-R25 WeakPolarHBondContact O-CG 2.86Å; E21-R25 PolarHBondContact O-N 3.35Å; E21-R25 IonicContact OE2-NH2 3.95Å |
| 22 | A | 64.4 | Low | 58 | Low | 49 Ų | 49 | 98.7 Ų | 98.7 | 41% | 0.405 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.5 | -40.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | N18 S19 S20 R25 A26 | N18-A22 WeakPolarHBondContact O-CB 3.1Å; N18-A22 PolarHBondContact O-N 3.16Å; S19-A22 PolarHBondContact O-N 3.49Å; S20-A22 VanDerWaalsContact C-N 3.35Å; S20-A22 PolarHBondContact O-N 3.44Å; A22-R25 PolarHBondContact O-N 2.55Å; A22-A26 WeakPolarHBondContact O-CB 3.01Å; A22-A26 PolarHBondContact O-N 3.3Å |
| 23 | L | 59.6 | Low | 57.8 | Low | 113 Ų | 113 | 98.7 Ų | 98.7 | 59% | 0.592 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -67.9 | -42.9 | 175.6 | -176 | 66.3 | 0 | 0 | 0 | 110.3 | S19 S20 R25 A26 V27 | S19-L23 WeakPolarHBondContact O-CA 3.38Å; S19-L23 WeakPolarHBondContact O-CB 3.17Å; S19-L23 PolarHBondContact O-N 3.15Å; S20-L23 PolarHBondContact O-N 3.03Å; L23-R25 PolarHBondContact O-N 3.09Å; L23-A26 PolarHBondContact O-N 3.13Å; L23-V27 HydrophobicContact CD1-CG2 4.13Å; L23-V27 HydrophobicContact CG-CG2 4.13Å; L23-V27 WeakPolarHBondContact O-CA 3.47Å; L23-V27 WeakPolarHBondContact O-CB 3.14Å; L23-V27 WeakPolarHBondContact O-CG2 3.41Å; L23-V27 PolarHBondContact O-N 3.49Å |
| 24 | E | 60.6 | Low | 57.7 | Low | 127 Ų | 127 | 100.1 Ų | 100.1 | 59% | 0.593 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -63.9 | -40.1 | 174.7 | -77.4 | -164.8 | 131.2 | 0 | 0 | 111.5 | S20 R28 | S20-E24 VanDerWaalsContact O-CB 3.25Å; S20-E24 WeakPolarHBondContact O-CB 3.46Å; S20-E24 VanDerWaalsContact O-CG 3.26Å; S20-E24 WeakPolarHBondContact O-CG 2.82Å; S20-E24 PolarHBondContact O-N 2.87Å; E24-R28 VanDerWaalsContact O-CB 3.23Å; E24-R28 WeakPolarHBondContact O-CB 3.34Å; E24-R28 VanDerWaalsContact O-CG 3.29Å; E24-R28 WeakPolarHBondContact O-CG 3.19Å; E24-R28 PolarHBondContact O-N 3.42Å |
| 25 | R | 63.7 | Low | 57.4 | Low | 162 Ų | 162 | 99 Ų | 99 | 61% | 0.611 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66 | -41.8 | 172.6 | -76.5 | 178.7 | -173 | 136.1 | 9.3 | 111.7 | E21 A22 L23 R28 C29 | E21-R25 VanDerWaalsContact O-CB 3.3Å; E21-R25 WeakPolarHBondContact O-CB 3.5Å; E21-R25 VanDerWaalsContact O-CG 3.25Å; E21-R25 WeakPolarHBondContact O-CG 2.86Å; E21-R25 PolarHBondContact O-N 3.35Å; E21-R25 IonicContact OE2-NH2 3.95Å; A22-R25 PolarHBondContact O-N 2.55Å; L23-R25 PolarHBondContact O-N 3.09Å; R25-R28 PolarHBondContact O-N 2.65Å; R25-C29 WeakPolarHBondContact O-CB 3.38Å; R25-C29 PolarHBondContact O-N 2.95Å |
| 26 | A | 62 | Low | 56.9 | Low | 54 Ų | 54 | 96.4 Ų | 96.4 | 45% | 0.446 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -68.3 | -44.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | A22 L23 C29 C30 | A22-A26 WeakPolarHBondContact O-CB 3.01Å; A22-A26 PolarHBondContact O-N 3.3Å; L23-A26 PolarHBondContact O-N 3.13Å; A26-C29 PolarHBondContact O-N 3.27Å; A26-C30 PolarHBondContact O-N 3Å; A26-C30 VanDerWaalsContact O-N 3.11Å |
| 27 | V | 59.3 | Low | 56.4 | Low | 77 Ų | 77 | 97 Ų | 97 | 47% | 0.467 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -58.7 | -49.8 | 171.4 | 170.7 | 0 | 0 | 0 | 0 | 108.5 | L23 C29 C30 T31 | L23-V27 HydrophobicContact CD1-CG2 4.13Å; L23-V27 HydrophobicContact CG-CG2 4.13Å; L23-V27 WeakPolarHBondContact O-CA 3.47Å; L23-V27 WeakPolarHBondContact O-CB 3.14Å; L23-V27 WeakPolarHBondContact O-CG2 3.41Å; L23-V27 PolarHBondContact O-N 3.49Å; V27-C29 PolarHBondContact O-N 2.69Å; V27-C30 PolarHBondContact O-N 3.28Å; V27-T31 WeakPolarHBondContact CG1-OG1 3.36Å; V27-T31 WeakPolarHBondContact O-CA 3.21Å; V27-T31 WeakPolarHBondContact O-CB 3.37Å; V27-T31 PolarHBondContact O-N 3.47Å; V27-T31 PolarHBondContact O-OG1 3.38Å |
| 28 | R | 58 | Low | 55.9 | Low | 204 Ų | 204 | 101.1 Ų | 101.1 | 77% | 0.77 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -62.5 | -40.8 | 176.9 | -80.2 | -162.8 | -173.8 | -158.9 | 5.6 | 113.4 | E24 R25 C30 Q32 | E24-R28 VanDerWaalsContact O-CB 3.23Å; E24-R28 WeakPolarHBondContact O-CB 3.34Å; E24-R28 VanDerWaalsContact O-CG 3.29Å; E24-R28 WeakPolarHBondContact O-CG 3.19Å; E24-R28 PolarHBondContact O-N 3.42Å; R25-R28 PolarHBondContact O-N 2.65Å; R28-C30 VanDerWaalsContact C-N 3.28Å; R28-C30 PolarHBondContact O-N 3.07Å; R28-Q32 PolarHBondContact O-N 2.76Å |
| 29 | C | 62.5 | Low | 55.2 | Low | 98 Ų | 98 | 104.6 Ų | 104.6 | 66% | 0.662 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.6 | -38 | -177.2 | -160.7 | 0 | 0 | 0 | 0 | 111.2 | R25 A26 V27 | R25-C29 WeakPolarHBondContact O-CB 3.38Å; R25-C29 PolarHBondContact O-N 2.95Å; A26-C29 PolarHBondContact O-N 3.27Å; V27-C29 PolarHBondContact O-N 2.69Å |
| 30 | C | 54.6 | Low | 54.1 | Low | 81 Ų | 81 | 102.9 Ų | 102.9 | 55% | 0.547 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -102.2 | -18.1 | -177.3 | -60 | 0 | 0 | 0 | 0 | 114.5 | A26 V27 R28 A33 S34 | A26-C30 PolarHBondContact O-N 3Å; A26-C30 VanDerWaalsContact O-N 3.11Å; V27-C30 PolarHBondContact O-N 3.28Å; R28-C30 VanDerWaalsContact C-N 3.28Å; R28-C30 PolarHBondContact O-N 3.07Å; C30-A33 PolarHBondContact O-N 2.85Å; C30-S34 WeakPolarHBondContact O-CB 3.47Å; C30-S34 PolarHBondContact O-N 2.74Å |
| 31 | T | 56.2 | Low | 53 | Low | 66 Ų | 66 | 109.7 Ų | 109.7 | 41% | 0.405 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -70 | -37.2 | 175.7 | -53.7 | 0 | 0 | 0 | 0 | 110.2 | V27 V35 | V27-T31 WeakPolarHBondContact CG1-OG1 3.36Å; V27-T31 WeakPolarHBondContact O-CA 3.21Å; V27-T31 WeakPolarHBondContact O-CB 3.37Å; V27-T31 PolarHBondContact O-N 3.47Å; V27-T31 PolarHBondContact O-OG1 3.38Å; T31-V35 WeakPolarHBondContact O-CB 3.44Å; T31-V35 WeakPolarHBondContact O-CG2 3.34Å; T31-V35 PolarHBondContact O-N 2.93Å |
| 32 | Q | 51.6 | Low | 51.9 | Low | 155 Ų | 155 | 109 Ų | 109 | 72% | 0.724 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -67.5 | -41.1 | 171.2 | -168 | 166.2 | 84.4 | 0 | 0 | 110.7 | R28 V35 V36 | R28-Q32 PolarHBondContact O-N 2.76Å; Q32-V35 PolarHBondContact O-N 2.64Å; Q32-V36 WeakPolarHBondContact O-CG2 3.06Å; Q32-V36 PolarHBondContact O-N 2.72Å |
| 33 | A | 48.4 | Very low | 50.7 | Low | 63 Ų | 63 | 115.7 Ų | 115.7 | 52% | 0.521 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -67.8 | -36.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114 | C30 V35 V36 | C30-A33 PolarHBondContact O-N 2.85Å; A33-V35 VanDerWaalsContact C-N 3.32Å; A33-V36 PolarHBondContact O-N 3.48Å |
| 34 | S | 47.1 | Very low | 49.8 | Very low | 69 Ų | 69 | 114.3 Ų | 114.3 | 48% | 0.483 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -76.3 | -18.5 | 177 | 176.2 | 0 | 0 | 0 | 0 | 113.1 | C30 V36 Q58 | C30-S34 WeakPolarHBondContact O-CB 3.47Å; C30-S34 PolarHBondContact O-N 2.74Å; S34-V36 VanDerWaalsContact C-N 3.31Å; S34-Q58 PolarHBondContact OG-NE2 3.16Å |
| 35 | V | 47.1 | Very low | 48.9 | Very low | 110 Ų | 110 | 110.2 Ų | 110.2 | 67% | 0.667 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -6 | 171.8 | 173.9 | 0 | 0 | 0 | 0 | 111.1 | T31 Q32 A33 T37 | T31-V35 WeakPolarHBondContact O-CB 3.44Å; T31-V35 WeakPolarHBondContact O-CG2 3.34Å; T31-V35 PolarHBondContact O-N 2.93Å; Q32-V35 PolarHBondContact O-N 2.64Å; A33-V35 VanDerWaalsContact C-N 3.32Å; V35-T37 PolarHBondContact O-N 2.66Å |
| 36 | V | 40.9 | Very low | 48.4 | Very low | 95 Ų | 95 | 108.2 Ų | 108.2 | 58% | 0.576 | 65% | 0.649 | S | S | * | * | trans | -99.5 | 83.3 | 179.6 | 176.3 | 0 | 0 | 0 | 0 | 110 | Q32 A33 S34 | Q32-V36 WeakPolarHBondContact O-CG2 3.06Å; Q32-V36 PolarHBondContact O-N 2.72Å; A33-V36 PolarHBondContact O-N 3.48Å; S34-V36 VanDerWaalsContact C-N 3.31Å | ||
| 37 | T | 45.4 | Very low | 48 | Very low | 131 Ų | 131 | 110.6 Ų | 110.6 | 80% | 0.804 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -180 | 102.4 | 155.7 | 9.4 | 0 | 0 | 0 | 0 | 103.4 | V35 | V35-T37 PolarHBondContact O-N 2.66Š|
| 38 | D | 44.8 | Very low | 47.9 | Very low | 135 Ų | 135 | 114.4 Ų | 114.4 | 72% | 0.722 | 67% | 0.667 | S | S | * | * | cis | -168 | 96.5 | 43.3 | 178.4 | 32.5 | 0 | 0 | 0 | 105.9 | G40 | D38-G40 PolarHBondContact O-N 3.46Š| ||
| 39 | D | 44.1 | Very low | 48.2 | Very low | 174 Ų | 174 | 114 Ų | 114 | 93% | 0.93 | 67% | 0.665 | S | S | * | * | trans | -79.4 | 69.5 | 172.2 | -66.8 | -50.3 | 0 | 0 | 0 | 108.6 | ||||
| 40 | G | 38.9 | Very low | 48 | Very low | 32 Ų | 32 | 112.2 Ų | 112.2 | 33% | 0.33 | 65% | 0.654 | S | S | . | * | trans | -149.8 | 118.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | D38 | D38-G40 PolarHBondContact O-N 3.46Š| ||
| 41 | F | 39.8 | Very low | 48.6 | Very low | 210 Ų | 210 | 113.9 Ų | 113.9 | 92% | 0.921 | 66% | 0.656 | S | S | * | * | S | Bend | trans | 82.7 | 82 | -175.3 | -61 | -90 | 0 | 0 | 0 | 114 | ||
| 42 | A | 41.3 | Very low | 49.6 | Very low | 83 Ų | 83 | 118.3 Ų | 118.3 | 69% | 0.686 | 67% | 0.667 | S | S | * | * | 70.2 | 108.9 | 86.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 43 | E | 39.3 | Very low | 50.8 | Low | 190 Ų | 190 | 115.2 Ų | 115.2 | 89% | 0.888 | 66% | 0.655 | S | S | * | * | trans | 65.7 | 100.4 | 147.3 | -80.4 | 160.6 | 92 | 0 | 0 | 119.9 | ||||
| 44 | G | 39.7 | Very low | 52.2 | Low | 84 Ų | 84 | 117.1 Ų | 117.1 | 87% | 0.866 | 65% | 0.654 | S | S | * | * | 74.6 | 67.6 | 126.3 | 0 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 45 | G | 43 | Very low | 53.8 | Low | 41 Ų | 41 | 122.2 Ų | 122.2 | 42% | 0.423 | 66% | 0.662 | S | S | . | * | S | Bend | trans | -154.8 | 177.6 | 170.4 | 0 | 0 | 0 | 0 | 0 | 110.2 | D47 | G45-D47 PolarHBondContact O-N 3.29Š|
| 46 | P | 51.5 | Low | 55.6 | Low | 121 Ų | 121 | 121.3 Ų | 121.3 | 79% | 0.786 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -69.1 | 59.9 | -166.9 | 28.9 | -36.5 | 0 | 0 | 0 | 116.2 | ||
| 47 | D | 55.6 | Low | 57.9 | Low | 103 Ų | 103 | 120.7 Ų | 120.7 | 55% | 0.551 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -87.6 | -20.8 | -175.8 | -52.5 | -42.1 | 0 | 0 | 0 | 112.6 | G45 R49 S50 L51 | G45-D47 PolarHBondContact O-N 3.29Å; D47-R49 VanDerWaalsContact C-N 3.32Å; D47-R49 PolarHBondContact O-N 3.45Å; D47-S50 PolarHBondContact O-N 3.23Å; D47-L51 PolarHBondContact O-N 3.21Å |
| 48 | E | 57.1 | Low | 59.7 | Low | 158 Ų | 158 | 119 Ų | 119 | 74% | 0.738 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -57.5 | -46.8 | 178.9 | -55.8 | -174.9 | 156.1 | 0 | 0 | 110.8 | S50 Y52 | E48-S50 PolarHBondContact O-N 2.8Å; E48-Y52 WeakPolarHBondContact O-CD2 3.18Å; E48-Y52 PolarHBondContact O-N 2.75Å |
| 49 | R | 64.2 | Low | 61.8 | Low | 194 Ų | 194 | 117.6 Ų | 117.6 | 73% | 0.732 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -67.7 | -36.7 | -178.3 | -165.2 | -179 | -174.9 | -167.2 | 1.8 | 112 | D47 Y52 I53 | D47-R49 VanDerWaalsContact C-N 3.32Å; D47-R49 PolarHBondContact O-N 3.45Å; R49-Y52 PolarHBondContact O-N 2.77Å; R49-I53 HydrophobicContact CG-CD1 4.07Å; R49-I53 VanDerWaalsContact O-CG1 3.27Å; R49-I53 WeakPolarHBondContact O-CG1 3.45Å; R49-I53 PolarHBondContact O-N 3.34Å |
| 50 | S | 58 | Low | 64 | Low | 61 Ų | 61 | 111.5 Ų | 111.5 | 43% | 0.427 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -66.4 | -42.2 | -177.8 | -162.4 | 0 | 0 | 0 | 0 | 111.6 | D47 E48 Y52 I53 M54 | D47-S50 PolarHBondContact O-N 3.23Å; E48-S50 PolarHBondContact O-N 2.8Å; S50-Y52 VanDerWaalsContact C-N 3.35Å; S50-Y52 PolarHBondContact O-N 3.36Å; S50-I53 PolarHBondContact O-N 2.75Å; S50-M54 PolarHBondContact O-N 2.83Å |
| 51 | L | 67.4 | Low | 66.6 | Low | 116 Ų | 116 | 113.4 Ų | 113.4 | 61% | 0.607 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -61 | -41.1 | 174.3 | -69.9 | 175.2 | 0 | 0 | 0 | 112.4 | D47 M54 R55 | D47-L51 PolarHBondContact O-N 3.21Å; L51-M54 HydrophobicContact CD2-CE 3.95Å; L51-M54 PolarHBondContact O-N 2.91Å; L51-R55 PolarHBondContact O-N 3.41Å; L51-R55 VanDerWaalsContact O-N 3.11Å |
| 52 | Y | 75.6 | Confident | 69 | Low | 160 Ų | 160 | 109 Ų | 109 | 63% | 0.627 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.9 | -42.4 | 174.6 | -77.5 | -68.4 | 0 | 0 | 0 | 112.1 | E48 R49 S50 M54 R55 V56 | E48-Y52 WeakPolarHBondContact O-CD2 3.18Å; E48-Y52 PolarHBondContact O-N 2.75Å; R49-Y52 PolarHBondContact O-N 2.77Å; S50-Y52 VanDerWaalsContact C-N 3.35Å; S50-Y52 PolarHBondContact O-N 3.36Å; Y52-M54 PolarHBondContact O-N 3.48Å; Y52-R55 PolarHBondContact O-N 3.5Å; Y52-V56 VanDerWaalsContact O-CG2 3.29Å; Y52-V56 WeakPolarHBondContact O-CG2 3.42Å; Y52-V56 PolarHBondContact O-N 2.9Å |
| 53 | I | 78.2 | Confident | 71.6 | Confident | 90 Ų | 90 | 108 Ų | 108 | 46% | 0.462 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -60 | -48 | 178.4 | -68.4 | 162.2 | 0 | 0 | 0 | 110.2 | R49 S50 R55 V56 V57 | R49-I53 HydrophobicContact CG-CD1 4.07Å; R49-I53 VanDerWaalsContact O-CG1 3.27Å; R49-I53 WeakPolarHBondContact O-CG1 3.45Å; R49-I53 PolarHBondContact O-N 3.34Å; S50-I53 PolarHBondContact O-N 2.75Å; I53-R55 VanDerWaalsContact C-N 3.33Å; I53-R55 PolarHBondContact O-N 2.9Å; I53-V56 PolarHBondContact O-N 3.49Å; I53-V57 HydrophobicContact CG2-CG2 4.32Å; I53-V57 VanDerWaalsContact O-CG2 3.27Å; I53-V57 WeakPolarHBondContact O-CG2 3.02Å; I53-V57 PolarHBondContact O-N 3.42Å |
| 54 | M | 76.9 | Confident | 74.3 | Confident | 103 Ų | 103 | 103 Ų | 103 | 51% | 0.507 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -60.8 | -41.4 | 178.5 | -70 | -166.5 | -76.5 | 0 | 0 | 112.4 | S50 L51 Y52 V57 Q58 | S50-M54 PolarHBondContact O-N 2.83Å; L51-M54 HydrophobicContact CD2-CE 3.95Å; L51-M54 PolarHBondContact O-N 2.91Å; Y52-M54 PolarHBondContact O-N 3.48Å; M54-V57 PolarHBondContact O-N 2.86Å; M54-Q58 WeakPolarHBondContact O-CG 3.36Å; M54-Q58 PolarHBondContact O-N 3.41Å |
| 55 | R | 81.4 | Confident | 76.9 | Confident | 175 Ų | 175 | 103.4 Ų | 103.4 | 66% | 0.66 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.7 | -43.5 | 176.1 | -168.9 | -176.8 | -69.9 | -143.3 | -0 | 111.8 | L51 Y52 I53 V57 Q58 I59 | L51-R55 PolarHBondContact O-N 3.41Å; L51-R55 VanDerWaalsContact O-N 3.11Å; Y52-R55 PolarHBondContact O-N 3.5Å; I53-R55 VanDerWaalsContact C-N 3.33Å; I53-R55 PolarHBondContact O-N 2.9Å; R55-V57 VanDerWaalsContact C-N 3.34Å; R55-Q58 PolarHBondContact O-N 2.78Å; R55-I59 HydrophobicContact CG-CD1 3.87Å; R55-I59 WeakPolarHBondContact O-CB 3.45Å; R55-I59 WeakPolarHBondContact O-CD1 3.23Å; R55-I59 WeakPolarHBondContact O-CG1 3.13Å; R55-I59 PolarHBondContact O-N 3.07Å |
| 56 | V | 85.1 | Confident | 79.3 | Confident | 91 Ų | 91 | 104.8 Ų | 104.8 | 55% | 0.552 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -64.1 | -40.8 | 177.3 | 171.6 | 0 | 0 | 0 | 0 | 110.9 | Y52 I53 I59 A60 | Y52-V56 VanDerWaalsContact O-CG2 3.29Å; Y52-V56 WeakPolarHBondContact O-CG2 3.42Å; Y52-V56 PolarHBondContact O-N 2.9Å; I53-V56 PolarHBondContact O-N 3.49Å; V56-I59 PolarHBondContact O-N 2.97Å; V56-A60 WeakPolarHBondContact O-CB 3.05Å; V56-A60 PolarHBondContact O-N 3.21Å |
| 57 | V | 89.5 | Confident | 81.2 | Confident | 83 Ų | 83 | 103 Ų | 103 | 50% | 0.503 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.7 | -46.4 | 176.4 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | I53 M54 R55 A60 V61 | I53-V57 HydrophobicContact CG2-CG2 4.32Å; I53-V57 VanDerWaalsContact O-CG2 3.27Å; I53-V57 WeakPolarHBondContact O-CG2 3.02Å; I53-V57 PolarHBondContact O-N 3.42Å; M54-V57 PolarHBondContact O-N 2.86Å; R55-V57 VanDerWaalsContact C-N 3.34Å; V57-A60 PolarHBondContact O-N 3.48Å; V57-V61 WeakPolarHBondContact O-CG2 3.18Å; V57-V61 PolarHBondContact O-N 2.89Å |
| 58 | Q | 83.2 | Confident | 83.1 | Confident | 95 Ų | 95 | 101.8 Ų | 101.8 | 44% | 0.444 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.1 | -45.9 | 176.4 | -71.6 | -174.4 | 21.6 | 0 | 0 | 112.1 | S34 M54 R55 A60 V61 M62 | S34-Q58 PolarHBondContact OG-NE2 3.16Å; M54-Q58 WeakPolarHBondContact O-CG 3.36Å; M54-Q58 PolarHBondContact O-N 3.41Å; R55-Q58 PolarHBondContact O-N 2.78Å; Q58-A60 VanDerWaalsContact C-N 3.31Å; Q58-A60 PolarHBondContact O-N 3.5Å; Q58-V61 PolarHBondContact O-N 3.43Å; Q58-M62 WeakPolarHBondContact O-CG 2.94Å; Q58-M62 PolarHBondContact O-N 3.27Å |
| 59 | I | 88.4 | Confident | 84.8 | Confident | 106 Ų | 106 | 98.4 Ų | 98.4 | 54% | 0.544 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.3 | -43.5 | 176.2 | -67.4 | 164 | 0 | 0 | 0 | 110.3 | R55 V56 V61 M62 C63 | R55-I59 HydrophobicContact CG-CD1 3.87Å; R55-I59 WeakPolarHBondContact O-CB 3.45Å; R55-I59 WeakPolarHBondContact O-CD1 3.23Å; R55-I59 WeakPolarHBondContact O-CG1 3.13Å; R55-I59 PolarHBondContact O-N 3.07Å; V56-I59 PolarHBondContact O-N 2.97Å; I59-V61 PolarHBondContact O-N 2.84Å; I59-M62 PolarHBondContact O-N 3.32Å; I59-C63 WeakPolarHBondContact O-CB 3.27Å; I59-C63 PolarHBondContact O-N 3.47Å |
| 60 | A | 89.6 | Confident | 86.1 | Confident | 46 Ų | 46 | 92.1 Ų | 92.1 | 38% | 0.38 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111 | V56 V57 Q58 C63 V64 | V56-A60 WeakPolarHBondContact O-CB 3.05Å; V56-A60 PolarHBondContact O-N 3.21Å; V57-A60 PolarHBondContact O-N 3.48Å; Q58-A60 VanDerWaalsContact C-N 3.31Å; Q58-A60 PolarHBondContact O-N 3.5Å; A60-C63 PolarHBondContact O-N 2.99Å; A60-V64 WeakPolarHBondContact O-CB 3.06Å; A60-V64 WeakPolarHBondContact O-CG2 3.23Å; A60-V64 PolarHBondContact O-N 3.28Å |
| 61 | V | 93.7 | Very high | 87.7 | Confident | 72 Ų | 72 | 94.4 Ų | 94.4 | 44% | 0.436 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.9 | -49 | 175.8 | 173.5 | 0 | 0 | 0 | 0 | 110.9 | V57 Q58 I59 C63 V64 L65 | V57-V61 WeakPolarHBondContact O-CG2 3.18Å; V57-V61 PolarHBondContact O-N 2.89Å; Q58-V61 PolarHBondContact O-N 3.43Å; I59-V61 PolarHBondContact O-N 2.84Å; V61-C63 VanDerWaalsContact C-N 3.28Å; V61-C63 PolarHBondContact O-N 2.96Å; V61-V64 PolarHBondContact O-N 2.95Å; V61-L65 HydrophobicContact CG1-CD1 3.93Å; V61-L65 HydrophobicContact CG1-CG 4.32Å; V61-L65 WeakPolarHBondContact O-CB 3.48Å; V61-L65 VanDerWaalsContact O-CG 3.22Å; V61-L65 WeakPolarHBondContact O-CG 3.47Å; V61-L65 PolarHBondContact O-N 3.43Å |
| 62 | M | 90.8 | Very high | 88.9 | Confident | 118 Ų | 118 | 90.3 Ų | 90.3 | 58% | 0.581 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -61.7 | -37.9 | 178.6 | -66.3 | -65.3 | 143.4 | 0 | 0 | 112.2 | Q58 I59 S66 | Q58-M62 WeakPolarHBondContact O-CG 2.94Å; Q58-M62 PolarHBondContact O-N 3.27Å; I59-M62 PolarHBondContact O-N 3.32Å; M62-S66 WeakPolarHBondContact O-CB 3.34Å; M62-S66 PolarHBondContact O-N 2.78Å; M62-S66 PolarHBondContact O-OG 2.93Å |
| 63 | C | 94.5 | Very high | 89.5 | Confident | 62 Ų | 62 | 87.8 Ų | 87.8 | 42% | 0.419 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -66.3 | -48.2 | 175.5 | -174.9 | 0 | 0 | 0 | 0 | 111.3 | I59 A60 V61 L65 S66 L67 | I59-C63 WeakPolarHBondContact O-CB 3.27Å; I59-C63 PolarHBondContact O-N 3.47Å; A60-C63 PolarHBondContact O-N 2.99Å; V61-C63 VanDerWaalsContact C-N 3.28Å; V61-C63 PolarHBondContact O-N 2.96Å; C63-L65 VanDerWaalsContact C-N 3.33Å; C63-L65 PolarHBondContact O-N 3.29Å; C63-S66 PolarHBondContact O-N 3.47Å; C63-S66 VanDerWaalsContact O-N 3.16Å; C63-L67 WeakPolarHBondContact O-CB 3.47Å; C63-L67 VanDerWaalsContact O-CG 3.26Å; C63-L67 WeakPolarHBondContact O-CG 3.25Å; C63-L67 PolarHBondContact O-N 3.35Å |
| 64 | V | 96.8 | Very high | 89.8 | Confident | 85 Ų | 85 | 89.4 Ų | 89.4 | 52% | 0.515 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61.7 | -41.8 | 177.7 | 170.6 | 0 | 0 | 0 | 0 | 111.2 | A60 V61 L67 T68 | A60-V64 WeakPolarHBondContact O-CB 3.06Å; A60-V64 WeakPolarHBondContact O-CG2 3.23Å; A60-V64 PolarHBondContact O-N 3.28Å; V61-V64 PolarHBondContact O-N 2.95Å; V64-L67 PolarHBondContact O-N 3.36Å; V64-T68 HydrophobicContact CG1-CG2 4.47Å; V64-T68 WeakPolarHBondContact O-CB 3.46Å; V64-T68 WeakPolarHBondContact O-CG2 3.26Å; V64-T68 PolarHBondContact O-N 2.77Å; V64-T68 PolarHBondContact O-OG1 2.96Å |
| 65 | L | 94.2 | Very high | 90.1 | Very high | 91 Ų | 91 | 91.3 Ų | 91.3 | 48% | 0.476 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.4 | -46.3 | 173.8 | -68.7 | 174.9 | 0 | 0 | 0 | 111.1 | V61 C63 L67 T68 V69 | V61-L65 HydrophobicContact CG1-CD1 3.93Å; V61-L65 HydrophobicContact CG1-CG 4.32Å; V61-L65 WeakPolarHBondContact O-CB 3.48Å; V61-L65 VanDerWaalsContact O-CG 3.22Å; V61-L65 WeakPolarHBondContact O-CG 3.47Å; V61-L65 PolarHBondContact O-N 3.43Å; C63-L65 VanDerWaalsContact C-N 3.33Å; C63-L65 PolarHBondContact O-N 3.29Å; L65-L67 PolarHBondContact O-N 2.77Å; L65-T68 WeakPolarHBondContact CA-OG1 3.42Å; L65-T68 PolarHBondContact O-N 3.14Å; L65-T68 PolarHBondContact O-OG1 3.5Å; L65-V69 WeakPolarHBondContact O-CB 3.13Å; L65-V69 VanDerWaalsContact O-CG2 3.25Å; L65-V69 WeakPolarHBondContact O-CG2 3.24Å; L65-V69 PolarHBondContact O-N 2.81Å |
| 66 | S | 93.8 | Very high | 90.2 | Very high | 71 Ų | 71 | 88.3 Ų | 88.3 | 50% | 0.497 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.2 | -44.1 | 177.7 | -58.3 | 0 | 0 | 0 | 0 | 111.9 | M62 C63 V69 V70 | M62-S66 WeakPolarHBondContact O-CB 3.34Å; M62-S66 PolarHBondContact O-N 2.78Å; M62-S66 PolarHBondContact O-OG 2.93Å; C63-S66 PolarHBondContact O-N 3.47Å; C63-S66 VanDerWaalsContact O-N 3.16Å; S66-V69 PolarHBondContact O-N 2.91Å; S66-V70 VanDerWaalsContact O-CB 3.24Å; S66-V70 WeakPolarHBondContact O-CB 3.37Å; S66-V70 WeakPolarHBondContact O-CG2 3.22Å; S66-V70 PolarHBondContact O-N 3.4Å |
| 67 | L | 91.7 | Very high | 90.1 | Very high | 82 Ų | 82 | 84.9 Ų | 84.9 | 43% | 0.429 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.6 | -42.4 | 177.9 | -71 | 175.8 | 0 | 0 | 0 | 112 | C63 V64 L65 V70 F71 | C63-L67 WeakPolarHBondContact O-CB 3.47Å; C63-L67 VanDerWaalsContact O-CG 3.26Å; C63-L67 WeakPolarHBondContact O-CG 3.25Å; C63-L67 PolarHBondContact O-N 3.35Å; V64-L67 PolarHBondContact O-N 3.36Å; L65-L67 PolarHBondContact O-N 2.77Å; L67-V70 PolarHBondContact O-N 2.68Å; L67-F71 HydrophobicContact CB-CD2 4.37Å; L67-F71 HydrophobicContact CB-CE2 4.16Å; L67-F71 VanDerWaalsContact O-CB 3.27Å; L67-F71 WeakPolarHBondContact O-CB 3.41Å; L67-F71 WeakPolarHBondContact O-CD2 3.41Å; L67-F71 WeakPolarHBondContact O-CG 3.2Å; L67-F71 PolarHBondContact O-N 3.25Å |
| 68 | T | 94.2 | Very high | 89.7 | Confident | 78 Ų | 78 | 83.9 Ų | 83.9 | 48% | 0.479 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -68.1 | -39.2 | 177.6 | 50.4 | 0 | 0 | 0 | 0 | 112.3 | V64 L65 F71 G72 | V64-T68 HydrophobicContact CG1-CG2 4.47Å; V64-T68 WeakPolarHBondContact O-CB 3.46Å; V64-T68 WeakPolarHBondContact O-CG2 3.26Å; V64-T68 PolarHBondContact O-N 2.77Å; V64-T68 PolarHBondContact O-OG1 2.96Å; L65-T68 WeakPolarHBondContact CA-OG1 3.42Å; L65-T68 PolarHBondContact O-N 3.14Å; L65-T68 PolarHBondContact O-OG1 3.5Å; T68-F71 PolarHBondContact O-N 2.84Å; T68-G72 PolarHBondContact O-N 2.89Å |
| 69 | V | 94.4 | Very high | 89.3 | Confident | 87 Ų | 87 | 84.7 Ų | 84.7 | 53% | 0.527 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63 | -49 | 173.2 | 170.4 | 0 | 0 | 0 | 0 | 110.2 | L65 S66 F71 G72 I73 | L65-V69 WeakPolarHBondContact O-CB 3.13Å; L65-V69 VanDerWaalsContact O-CG2 3.25Å; L65-V69 WeakPolarHBondContact O-CG2 3.24Å; L65-V69 PolarHBondContact O-N 2.81Å; S66-V69 PolarHBondContact O-N 2.91Å; V69-F71 PolarHBondContact O-N 3.36Å; V69-G72 PolarHBondContact O-N 3.38Å; V69-I73 HydrophobicContact CG1-CD1 3.64Å; V69-I73 HydrophobicContact CG1-CG1 4.4Å; V69-I73 WeakPolarHBondContact O-CB 3.17Å; V69-I73 VanDerWaalsContact O-CG1 3.23Å; V69-I73 WeakPolarHBondContact O-CG1 3.48Å; V69-I73 PolarHBondContact O-N 3.23Å |
| 70 | V | 91 | Very high | 88.3 | Confident | 62 Ų | 62 | 84.6 Ų | 84.6 | 38% | 0.376 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.5 | -47.1 | 177.3 | 168.1 | 0 | 0 | 0 | 0 | 110.7 | S66 L67 I73 F74 | S66-V70 VanDerWaalsContact O-CB 3.24Å; S66-V70 WeakPolarHBondContact O-CB 3.37Å; S66-V70 WeakPolarHBondContact O-CG2 3.22Å; S66-V70 PolarHBondContact O-N 3.4Å; L67-V70 PolarHBondContact O-N 2.68Å; V70-I73 PolarHBondContact O-N 2.9Å; V70-F74 HydrophobicContact CB-CE2 4.49Å; V70-F74 HydrophobicContact CG1-CD2 3.42Å; V70-F74 VanDerWaalsContact CG1-CD2 3.42Å; V70-F74 HydrophobicContact CG1-CE2 3.1Å; V70-F74 HydrophobicContact CG1-CZ 4.13Å; V70-F74 WeakPolarHBondContact O-CB 3.39Å; V70-F74 WeakPolarHBondContact O-CD2 3.44Å; V70-F74 WeakPolarHBondContact O-CG 3.39Å; V70-F74 PolarHBondContact O-N 3.39Å |
| 71 | F | 90.7 | Very high | 87 | Confident | 110 Ų | 110 | 87.5 Ų | 87.5 | 48% | 0.482 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65 | -38.5 | 175 | -69.5 | -39.9 | 0 | 0 | 0 | 112.6 | L67 T68 V69 F74 F75 | L67-F71 HydrophobicContact CB-CD2 4.37Å; L67-F71 HydrophobicContact CB-CE2 4.16Å; L67-F71 VanDerWaalsContact O-CB 3.27Å; L67-F71 WeakPolarHBondContact O-CB 3.41Å; L67-F71 WeakPolarHBondContact O-CD2 3.41Å; L67-F71 WeakPolarHBondContact O-CG 3.2Å; L67-F71 PolarHBondContact O-N 3.25Å; T68-F71 PolarHBondContact O-N 2.84Å; V69-F71 PolarHBondContact O-N 3.36Å; F71-F74 CarbonylContact O-C 3.51Å; F71-F74 PolarHBondContact O-N 3.29Å; F71-F75 HydrophobicContact CB-CD2 4.21Å; F71-F75 HydrophobicContact CB-CE2 3.94Å; F71-F75 WeakPolarHBondContact O-CB 3.42Å; F71-F75 WeakPolarHBondContact O-CD2 3.27Å; F71-F75 WeakPolarHBondContact O-CG 3.36Å; F71-F75 PolarHBondContact O-N 2.93Å |
| 72 | G | 92.5 | Very high | 85.9 | Confident | 29 Ų | 29 | 90.1 Ų | 90.1 | 30% | 0.299 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.8 | -46 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | T68 V69 F74 F75 L76 | T68-G72 PolarHBondContact O-N 2.89Å; V69-G72 PolarHBondContact O-N 3.38Å; G72-F74 VanDerWaalsContact C-N 3.31Å; G72-F74 PolarHBondContact O-N 3.37Å; G72-F75 PolarHBondContact O-N 3.01Å; G72-L76 VanDerWaalsContact O-CB 3.23Å; G72-L76 WeakPolarHBondContact O-CB 3.22Å; G72-L76 WeakPolarHBondContact O-CD1 3.2Å; G72-L76 WeakPolarHBondContact O-CG 3.44Å; G72-L76 PolarHBondContact O-N 3.35Å |
| 73 | I | 88.2 | Confident | 85.1 | Confident | 107 Ų | 107 | 92 Ų | 92 | 55% | 0.549 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65 | -35.2 | 174.5 | -64.2 | 162.7 | 0 | 0 | 0 | 110.8 | V69 V70 G77 | V69-I73 HydrophobicContact CG1-CD1 3.64Å; V69-I73 HydrophobicContact CG1-CG1 4.4Å; V69-I73 WeakPolarHBondContact O-CB 3.17Å; V69-I73 VanDerWaalsContact O-CG1 3.23Å; V69-I73 WeakPolarHBondContact O-CG1 3.48Å; V69-I73 PolarHBondContact O-N 3.23Å; V70-I73 PolarHBondContact O-N 2.9Å; I73-G77 WeakPolarHBondContact O-CA 3.29Å; I73-G77 PolarHBondContact O-N 2.73Å |
| 74 | F | 86.1 | Confident | 83.6 | Confident | 124 Ų | 124 | 91 Ų | 91 | 54% | 0.544 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -75.3 | -32.2 | 174.4 | -75.2 | -52.8 | 0 | 0 | 0 | 113.1 | V70 F71 G72 G77 C78 | V70-F74 HydrophobicContact CB-CE2 4.49Å; V70-F74 HydrophobicContact CG1-CD2 3.42Å; V70-F74 VanDerWaalsContact CG1-CD2 3.42Å; V70-F74 HydrophobicContact CG1-CE2 3.1Å; V70-F74 HydrophobicContact CG1-CZ 4.13Å; V70-F74 WeakPolarHBondContact O-CB 3.39Å; V70-F74 WeakPolarHBondContact O-CD2 3.44Å; V70-F74 WeakPolarHBondContact O-CG 3.39Å; V70-F74 PolarHBondContact O-N 3.39Å; F71-F74 CarbonylContact O-C 3.51Å; F71-F74 PolarHBondContact O-N 3.29Å; G72-F74 VanDerWaalsContact C-N 3.31Å; G72-F74 PolarHBondContact O-N 3.37Å; F74-G77 CarbonylContact O-C 3.38Å; F74-C78 WeakPolarHBondContact O-CA 3.44Å; F74-C78 WeakPolarHBondContact O-CB 3.2Å; F74-C78 PolarHBondContact O-N 3.49Å; F74-C78 PolarHBondContact O-SG 3.45Å |
| 75 | F | 83.3 | Confident | 81.9 | Confident | 143 Ų | 143 | 93.4 Ų | 93.4 | 63% | 0.627 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -74.7 | -46.1 | 175.9 | -74 | -57.3 | 0 | 0 | 0 | 110.4 | F71 G72 G77 N79 | F71-F75 HydrophobicContact CB-CD2 4.21Å; F71-F75 HydrophobicContact CB-CE2 3.94Å; F71-F75 WeakPolarHBondContact O-CB 3.42Å; F71-F75 WeakPolarHBondContact O-CD2 3.27Å; F71-F75 WeakPolarHBondContact O-CG 3.36Å; F71-F75 PolarHBondContact O-N 2.93Å; G72-F75 PolarHBondContact O-N 3.01Å; F75-G77 VanDerWaalsContact C-N 3.26Å; F75-G77 PolarHBondContact O-N 2.72Å; F75-N79 WeakPolarHBondContact O-CB 3.22Å; F75-N79 PolarHBondContact O-N 2.85Å; F75-N79 PolarHBondContact O-ND2 3.36Å |
| 76 | L | 83.7 | Confident | 80.4 | Confident | 113 Ų | 113 | 91.5 Ų | 91.5 | 59% | 0.592 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -58.8 | -46.3 | 169.5 | -66.1 | 169.4 | 0 | 0 | 0 | 109.2 | G72 N79 L80 | G72-L76 VanDerWaalsContact O-CB 3.23Å; G72-L76 WeakPolarHBondContact O-CB 3.22Å; G72-L76 WeakPolarHBondContact O-CD1 3.2Å; G72-L76 WeakPolarHBondContact O-CG 3.44Å; G72-L76 PolarHBondContact O-N 3.35Å; L76-N79 PolarHBondContact O-N 3.26Å; L76-L80 WeakPolarHBondContact O-CB 3.34Å; L76-L80 WeakPolarHBondContact O-CG 3.27Å; L76-L80 PolarHBondContact O-N 3.2Å |
| 77 | G | 82.5 | Confident | 78.5 | Confident | 18 Ų | 18 | 94.1 Ų | 94.1 | 19% | 0.186 | 51% | 0.505 | C | S | . | . | H | α-helix | trans | -53.4 | -61.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111 | I73 F74 F75 N79 L80 L81 | I73-G77 WeakPolarHBondContact O-CA 3.29Å; I73-G77 PolarHBondContact O-N 2.73Å; F74-G77 CarbonylContact O-C 3.38Å; F75-G77 VanDerWaalsContact C-N 3.26Å; F75-G77 PolarHBondContact O-N 2.72Å; G77-N79 VanDerWaalsContact C-N 3.31Å; G77-N79 PolarHBondContact O-N 3.41Å; G77-L80 CarbonylContact O-C 3.54Å; G77-L80 VanDerWaalsContact O-C 3.28Å; G77-L80 WeakPolarHBondContact O-CA 3.09Å; G77-L80 WeakPolarHBondContact O-CB 3.48Å; G77-L80 PolarHBondContact O-N 2.99Å; G77-L81 WeakPolarHBondContact O-CA 3.26Å; G77-L81 WeakPolarHBondContact O-CB 3.41Å; G77-L81 WeakPolarHBondContact O-CG 3.48Å; G77-L81 PolarHBondContact O-N 3.03Å |
| 78 | C | 80.4 | Confident | 76.8 | Confident | 62 Ų | 62 | 95.9 Ų | 95.9 | 42% | 0.419 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -53 | -44.5 | 177.2 | -73 | 0 | 0 | 0 | 0 | 112.4 | F74 L80 L81 I82 | F74-C78 WeakPolarHBondContact O-CA 3.44Å; F74-C78 WeakPolarHBondContact O-CB 3.2Å; F74-C78 PolarHBondContact O-N 3.49Å; F74-C78 PolarHBondContact O-SG 3.45Å; C78-L80 VanDerWaalsContact C-N 3.34Å; C78-L80 PolarHBondContact O-N 3.48Å; C78-L81 PolarHBondContact O-N 3.43Å; C78-I82 WeakPolarHBondContact O-CB 3.21Å; C78-I82 WeakPolarHBondContact O-CD1 3.16Å; C78-I82 WeakPolarHBondContact O-CG1 3.43Å; C78-I82 PolarHBondContact O-N 3.23Å |
| 79 | N | 74.8 | Confident | 75 | Confident | 112 Ų | 112 | 96.1 Ų | 96.1 | 60% | 0.599 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -63 | -41.7 | 174 | -77.4 | -72.7 | 0 | 0 | 0 | 111.8 | F75 L76 G77 K83 | F75-N79 WeakPolarHBondContact O-CB 3.22Å; F75-N79 PolarHBondContact O-N 2.85Å; F75-N79 PolarHBondContact O-ND2 3.36Å; L76-N79 PolarHBondContact O-N 3.26Å; G77-N79 VanDerWaalsContact C-N 3.31Å; G77-N79 PolarHBondContact O-N 3.41Å; N79-K83 WeakPolarHBondContact O-CB 3.1Å; N79-K83 PolarHBondContact O-N 2.85Å |
| 80 | L | 68.3 | Low | 73 | Confident | 104 Ų | 104 | 96.9 Ų | 96.9 | 55% | 0.545 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -74.9 | -27.3 | 177.4 | -68.3 | 174.2 | 0 | 0 | 0 | 112.6 | L76 G77 C78 K83 S84 | L76-L80 WeakPolarHBondContact O-CB 3.34Å; L76-L80 WeakPolarHBondContact O-CG 3.27Å; L76-L80 PolarHBondContact O-N 3.2Å; G77-L80 CarbonylContact O-C 3.54Å; G77-L80 VanDerWaalsContact O-C 3.28Å; G77-L80 WeakPolarHBondContact O-CA 3.09Å; G77-L80 WeakPolarHBondContact O-CB 3.48Å; G77-L80 PolarHBondContact O-N 2.99Å; C78-L80 VanDerWaalsContact C-N 3.34Å; C78-L80 PolarHBondContact O-N 3.48Å; L80-K83 CarbonylContact O-C 3.28Å; L80-K83 PolarHBondContact O-N 3.47Å; L80-S84 WeakPolarHBondContact O-CA 3.48Å; L80-S84 WeakPolarHBondContact O-CB 3.25Å; L80-S84 PolarHBondContact O-N 3.11Å; L80-S84 PolarHBondContact O-OG 3.2Å |
| 81 | L | 62.5 | Low | 70.9 | Confident | 107 Ų | 107 | 100 Ų | 100 | 56% | 0.56 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -77.4 | -45.7 | 179.6 | -74.7 | 176.2 | 0 | 0 | 0 | 107.5 | G77 C78 K83 S84 E85 | G77-L81 WeakPolarHBondContact O-CA 3.26Å; G77-L81 WeakPolarHBondContact O-CB 3.41Å; G77-L81 WeakPolarHBondContact O-CG 3.48Å; G77-L81 PolarHBondContact O-N 3.03Å; C78-L81 PolarHBondContact O-N 3.43Å; L81-K83 VanDerWaalsContact C-N 3.28Å; L81-K83 PolarHBondContact O-N 3.34Å; L81-S84 WeakPolarHBondContact CA-OG 3.13Å; L81-S84 PolarHBondContact O-N 3.49Å; L81-S84 PolarHBondContact O-OG 3.33Å; L81-E85 WeakPolarHBondContact O-CB 3.17Å; L81-E85 PolarHBondContact O-N 2.55Å |
| 82 | I | 70.5 | Confident | 69 | Low | 127 Ų | 127 | 100.4 Ų | 100.4 | 65% | 0.651 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.4 | -37.9 | 169.8 | -64.5 | 162.7 | 0 | 0 | 0 | 110.3 | C78 | C78-I82 WeakPolarHBondContact O-CB 3.21Å; C78-I82 WeakPolarHBondContact O-CD1 3.16Å; C78-I82 WeakPolarHBondContact O-CG1 3.43Å; C78-I82 PolarHBondContact O-N 3.23Å |
| 83 | K | 72.7 | Confident | 67 | Low | 159 Ų | 159 | 105.4 Ų | 105.4 | 69% | 0.691 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -74.3 | -31 | 176.2 | -165.4 | 178.6 | 179.1 | 79.3 | 0 | 113.6 | N79 L80 L81 | N79-K83 WeakPolarHBondContact O-CB 3.1Å; N79-K83 PolarHBondContact O-N 2.85Å; L80-K83 CarbonylContact O-C 3.28Å; L80-K83 PolarHBondContact O-N 3.47Å; L81-K83 VanDerWaalsContact C-N 3.28Å; L81-K83 PolarHBondContact O-N 3.34Å |
| 84 | S | 63.1 | Low | 65.1 | Low | 40 Ų | 40 | 103 Ų | 103 | 28% | 0.28 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -93.1 | -22.2 | -176.6 | 61.1 | 0 | 0 | 0 | 0 | 113.7 | L80 L81 G86 M87 I88 | L80-S84 WeakPolarHBondContact O-CA 3.48Å; L80-S84 WeakPolarHBondContact O-CB 3.25Å; L80-S84 PolarHBondContact O-N 3.11Å; L80-S84 PolarHBondContact O-OG 3.2Å; L81-S84 WeakPolarHBondContact CA-OG 3.13Å; L81-S84 PolarHBondContact O-N 3.49Å; L81-S84 PolarHBondContact O-OG 3.33Å; S84-G86 PolarHBondContact O-N 3.41Å; S84-M87 WeakPolarHBondContact O-CA 3.49Å; S84-M87 WeakPolarHBondContact O-CB 3.23Å; S84-M87 PolarHBondContact O-N 3.42Å; S84-I88 PolarHBondContact O-N 3.11Å; S84-I88 VanDerWaalsContact O-N 3.15Å |
| 85 | E | 61.6 | Low | 63.4 | Low | 136 Ų | 136 | 108.7 Ų | 108.7 | 64% | 0.636 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -55 | -34.4 | 168 | -175.9 | 175.8 | -179.6 | 0 | 0 | 110.4 | L81 M87 N89 | L81-E85 WeakPolarHBondContact O-CB 3.17Å; L81-E85 PolarHBondContact O-N 2.55Å; E85-M87 VanDerWaalsContact C-N 3.28Å; E85-M87 PolarHBondContact O-N 2.76Å; E85-N89 WeakPolarHBondContact O-CB 3.29Å; E85-N89 PolarHBondContact O-N 2.78Å |
| 86 | G | 61.9 | Low | 61.8 | Low | 50 Ų | 50 | 112.5 Ų | 112.5 | 52% | 0.515 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -59.1 | -33.7 | 169.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | S84 F90 | S84-G86 PolarHBondContact O-N 3.41Å; G86-F90 PolarHBondContact O-N 3.41Å |
| 87 | M | 54.7 | Low | 59.8 | Low | 127 Ų | 127 | 112 Ų | 112 | 63% | 0.626 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -86.8 | -36.6 | -174.2 | -162.5 | 174.9 | 73.5 | 0 | 0 | 113.4 | S84 E85 N89 F90 L91 | S84-M87 WeakPolarHBondContact O-CA 3.49Å; S84-M87 WeakPolarHBondContact O-CB 3.23Å; S84-M87 PolarHBondContact O-N 3.42Å; E85-M87 VanDerWaalsContact C-N 3.28Å; E85-M87 PolarHBondContact O-N 2.76Å; M87-N89 VanDerWaalsContact C-N 3.29Å; M87-N89 PolarHBondContact O-N 3.27Å; M87-F90 PolarHBondContact O-N 2.79Å; M87-F90 VanDerWaalsContact O-N 3.16Å; M87-L91 PolarHBondContact O-N 2.7Å |
| 88 | I | 56.8 | Low | 57.9 | Low | 119 Ų | 119 | 115.2 Ų | 115.2 | 61% | 0.61 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -69 | -33.8 | 176 | -49.7 | 168.8 | 0 | 0 | 0 | 110.1 | S84 F90 L91 V92 | S84-I88 PolarHBondContact O-N 3.11Å; S84-I88 VanDerWaalsContact O-N 3.15Å; I88-F90 VanDerWaalsContact C-N 3.3Å; I88-F90 PolarHBondContact O-N 2.78Å; I88-L91 PolarHBondContact O-N 3.32Å; I88-V92 PolarHBondContact O-N 3.44Å |
| 89 | N | 55.5 | Low | 56.2 | Low | 83 Ų | 83 | 121.8 Ų | 121.8 | 44% | 0.444 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -69.5 | -28.8 | 172.9 | -161 | -5 | 0 | 0 | 0 | 112.1 | E85 M87 K93 | E85-N89 WeakPolarHBondContact O-CB 3.29Å; E85-N89 PolarHBondContact O-N 2.78Å; M87-N89 VanDerWaalsContact C-N 3.29Å; M87-N89 PolarHBondContact O-N 3.27Å; N89-K93 WeakPolarHBondContact O-CG 3.19Å; N89-K93 PolarHBondContact O-N 3.5Å; N89-K93 PolarHBondContact OD1-NZ 3.23Å |
| 90 | F | 51.8 | Low | 54.6 | Low | 103 Ų | 103 | 124.8 Ų | 124.8 | 45% | 0.452 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -72.9 | -39.7 | 174.2 | -157.5 | -113.4 | 0 | 0 | 0 | 111.6 | G86 M87 I88 V92 K93 D94 | G86-F90 PolarHBondContact O-N 3.41Å; M87-F90 PolarHBondContact O-N 2.79Å; M87-F90 VanDerWaalsContact O-N 3.16Å; I88-F90 VanDerWaalsContact C-N 3.3Å; I88-F90 PolarHBondContact O-N 2.78Å; F90-V92 VanDerWaalsContact C-N 3.35Å; F90-V92 PolarHBondContact O-N 2.84Å; F90-K93 CarbonylContact O-C 3.54Å; F90-K93 WeakPolarHBondContact O-CA 3.3Å; F90-K93 PolarHBondContact O-N 3.35Å; F90-D94 VanDerWaalsContact CD1-CG 3.41Å; F90-D94 WeakPolarHBondContact CD1-OD2 3.2Å; F90-D94 WeakPolarHBondContact CE1-OD1 3.02Å; F90-D94 WeakPolarHBondContact CE1-OD2 3.44Å; F90-D94 WeakPolarHBondContact CZ-OD1 3.32Å; F90-D94 VanDerWaalsContact O-CB 3.22Å; F90-D94 WeakPolarHBondContact O-CB 3.25Å; F90-D94 PolarHBondContact O-N 2.78Å |
| 91 | L | 48 | Very low | 53.4 | Low | 126 Ų | 126 | 125.9 Ų | 125.9 | 66% | 0.66 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -68.9 | -25.9 | 176.7 | -77.4 | 170.5 | 0 | 0 | 0 | 114.7 | M87 I88 | M87-L91 PolarHBondContact O-N 2.7Å; I88-L91 PolarHBondContact O-N 3.32Å |
| 92 | V | 50.1 | Low | 52.3 | Low | 119 Ų | 119 | 127.7 Ų | 127.7 | 72% | 0.721 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -75.2 | -27.8 | 168.3 | 158.3 | 0 | 0 | 0 | 0 | 111.8 | I88 F90 | I88-V92 PolarHBondContact O-N 3.44Å; F90-V92 VanDerWaalsContact C-N 3.35Å; F90-V92 PolarHBondContact O-N 2.84Å |
| 93 | K | 51.2 | Low | 51.2 | Low | 135 Ų | 135 | 126.9 Ų | 126.9 | 59% | 0.587 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -93.2 | -13.6 | 178.3 | -70.6 | -167.9 | 175.2 | 90.9 | 0 | 114.7 | N89 F90 R95 | N89-K93 WeakPolarHBondContact O-CG 3.19Å; N89-K93 PolarHBondContact O-N 3.5Å; N89-K93 PolarHBondContact OD1-NZ 3.23Å; F90-K93 CarbonylContact O-C 3.54Å; F90-K93 WeakPolarHBondContact O-CA 3.3Å; F90-K93 PolarHBondContact O-N 3.35Å; K93-R95 CarbonylContact O-C 3.36Å; K93-R95 PolarHBondContact O-N 3.32Å |
| 94 | D | 47.8 | Very low | 50 | Low | 56 Ų | 56 | 123.6 Ų | 123.6 | 30% | 0.299 | 64% | 0.64 | S | S | . | * | trans | -80.4 | 20.8 | -177.4 | -98.4 | -14 | 0 | 0 | 0 | 114.9 | F90 R96 | F90-D94 VanDerWaalsContact CD1-CG 3.41Å; F90-D94 WeakPolarHBondContact CD1-OD2 3.2Å; F90-D94 WeakPolarHBondContact CE1-OD1 3.02Å; F90-D94 WeakPolarHBondContact CE1-OD2 3.44Å; F90-D94 WeakPolarHBondContact CZ-OD1 3.32Å; F90-D94 VanDerWaalsContact O-CB 3.22Å; F90-D94 WeakPolarHBondContact O-CB 3.25Å; F90-D94 PolarHBondContact O-N 2.78Å; D94-R96 PolarHBondContact O-N 3.29Å | ||
| 95 | R | 50.6 | Low | 49.2 | Very low | 244 Ų | 244 | 127.1 Ų | 127.1 | 92% | 0.921 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -65.1 | 73.1 | 134.6 | -72.6 | -104.3 | -165.7 | 159.5 | 4.4 | 108.5 | K93 | K93-R95 CarbonylContact O-C 3.36Å; K93-R95 PolarHBondContact O-N 3.32Å |
| 96 | R | 49 | Very low | 48.2 | Very low | 222 Ų | 222 | 127.6 Ų | 127.6 | 84% | 0.838 | 67% | 0.672 | S | S | * | * | S | Bend | trans | 114 | 96.7 | 165.4 | -156.6 | 176.8 | -167.4 | 156.8 | 2.4 | 114.3 | D94 S98 | D94-R96 PolarHBondContact O-N 3.29Å; R96-S98 PolarHBondContact O-N 3.49Å |
| 97 | P | 43 | Very low | 47.1 | Very low | 102 Ų | 102 | 127.4 Ų | 127.4 | 66% | 0.662 | 67% | 0.669 | S | S | * | * | trans | -72 | 108.3 | -177 | 29.6 | -32.6 | 0 | 0 | 0 | 110.5 | ||||
| 98 | S | 42.5 | Very low | 46.7 | Very low | 86 Ų | 86 | 127.5 Ų | 127.5 | 60% | 0.601 | 68% | 0.679 | S | S | * | * | trans | -91.9 | 136.6 | 167.6 | -171.3 | 0 | 0 | 0 | 0 | 109.3 | R96 E100 | R96-S98 PolarHBondContact O-N 3.49Å; S98-E100 PolarHBondContact O-N 3.38Å | ||
| 99 | K | 44.9 | Very low | 45.8 | Very low | 200 Ų | 200 | 136.5 Ų | 136.5 | 87% | 0.87 | 71% | 0.708 | S | S | * | * | trans | -65.2 | 105.3 | -173.6 | -58.9 | 156.5 | 78.9 | 88.5 | 0 | 110.4 | ||||
| 100 | E | 40.2 | Very low | 45.3 | Very low | 175 Ų | 175 | 139.2 Ų | 139.2 | 82% | 0.818 | 72% | 0.721 | S | S | * | * | trans | -151.4 | 102.4 | 153.4 | 16.6 | -139.2 | 148 | 0 | 0 | 110.3 | S98 | S98-E100 PolarHBondContact O-N 3.38Š| ||
| 101 | V | 42.5 | Very low | 45 | Very low | 127 Ų | 127 | 141.1 Ų | 141.1 | 77% | 0.77 | 74% | 0.735 | S | S | * | * | trans | -66.4 | 126.6 | 178.8 | 86.4 | 0 | 0 | 0 | 0 | 107.6 | A103 | V101-A103 PolarHBondContact O-N 3.25Š| ||
| 102 | E | 40.1 | Very low | 44.8 | Very low | 146 Ų | 146 | 141.9 Ų | 141.9 | 68% | 0.682 | 74% | 0.739 | S | S | * | * | 47.4 | 75.9 | 129.8 | -159.7 | 177.1 | -179.3 | 0 | 0 | 115.1 | V104 | E102-V104 HydrophobicContact CG-CB 3.93Å; E102-V104 HydrophobicContact CG-CG2 3.51Å; E102-V104 PolarHBondContact O-N 2.72Å; E102-V104 WeakPolarHBondContact OE1-CG2 3.11Å | |||
| 103 | A | 48 | Very low | 44.5 | Very low | 110 Ų | 110 | 143.2 Ų | 143.2 | 91% | 0.909 | 74% | 0.74 | S | S | * | * | trans | -65.7 | 71 | 148 | 0 | 0 | 0 | 0 | 0 | 108.1 | V101 V105 | V101-A103 PolarHBondContact O-N 3.25Å; A103-V105 PolarHBondContact O-N 3.43Å; A103-V105 VanDerWaalsContact O-N 3.13Å | ||
| 104 | V | 46.1 | Very low | 44.1 | Very low | 90 Ų | 90 | 143.8 Ų | 143.8 | 55% | 0.545 | 75% | 0.75 | S | S | . | * | trans | -57.5 | 112.3 | 161 | 132.6 | 0 | 0 | 0 | 0 | 105.8 | E102 V106 | E102-V104 HydrophobicContact CG-CB 3.93Å; E102-V104 HydrophobicContact CG-CG2 3.51Å; E102-V104 PolarHBondContact O-N 2.72Å; E102-V104 WeakPolarHBondContact OE1-CG2 3.11Å; V104-V106 PolarHBondContact O-N 3.31Å; V104-V106 VanDerWaalsContact O-N 3.13Å | ||
| 105 | V | 47.3 | Very low | 43.8 | Very low | 114 Ų | 114 | 149.6 Ų | 149.6 | 69% | 0.691 | 78% | 0.78 | S | S | * | * | trans | 27.9 | 83.4 | 139.3 | -177 | 0 | 0 | 0 | 0 | 112.4 | A103 G107 | A103-V105 PolarHBondContact O-N 3.43Å; A103-V105 VanDerWaalsContact O-N 3.13Å; V105-G107 PolarHBondContact O-N 2.98Å; V105-G107 VanDerWaalsContact O-N 3.09Å | ||
| 106 | V | 40.6 | Very low | 43.3 | Very low | 146 Ų | 146 | 142.9 Ų | 142.9 | 89% | 0.885 | 77% | 0.77 | S | S | * | * | trans | -64.8 | 109.2 | 162.3 | 177.6 | 0 | 0 | 0 | 0 | 106 | V104 | V104-V106 PolarHBondContact O-N 3.31Å; V104-V106 VanDerWaalsContact O-N 3.13Å | ||
| 107 | G | 38.2 | Very low | 42.9 | Very low | 45 Ų | 45 | 136.8 Ų | 136.8 | 46% | 0.464 | 77% | 0.765 | S | S | . | * | trans | -62.2 | 160.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | V105 | V105-G107 PolarHBondContact O-N 2.98Å; V105-G107 VanDerWaalsContact O-N 3.09Å | ||
| 108 | P | 46.5 | Very low | 42.9 | Very low | 129 Ų | 129 | 139.7 Ų | 139.7 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | trans | -68.7 | 141.1 | 174.7 | 32.3 | -31.7 | 0 | 0 | 0 | 109.3 | ||||
| 109 | Y | 37.9 | Very low | 42.9 | Very low | 308 Ų | 308 | 144.5 Ų | 144.5 | 100% | 1.208 | 79% | 0.789 | S | S | * | * | trans | -42.9 | 0 | 179.5 | -63.2 | -88.9 | 0 | 0 | 0 | 115.7 |
Retrieved 109 of 109 residues in 224 ms
(Link to these results)