| 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 | 36.9 | Very low | 41.8 | Very low | 238 Ų | 238 | 130.4 Ų | 130.4 | 100% | 1.172 | 85% | 0.848 | S | S | * | * | 0 | 119.2 | 0 | -69.6 | 157.6 | 91.3 | 0 | 0 | 107.1 | |||||
| 2 | H | 39.8 | Very low | 43.2 | Very low | 189 Ų | 189 | 129.9 Ų | 129.9 | 88% | 0.875 | 85% | 0.845 | S | S | * | * | trans | 7 | 141.8 | 151.1 | -71.4 | 93.8 | 0 | 0 | 0 | 118.7 | ||||
| 3 | C | 37.1 | Very low | 44 | Very low | 118 Ų | 118 | 129.2 Ų | 129.2 | 80% | 0.797 | 84% | 0.836 | S | S | * | * | cis | -150.7 | 152.6 | 30.3 | -65.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 4 | G | 42.4 | Very low | 44.7 | Very low | 79 Ų | 79 | 126.9 Ų | 126.9 | 81% | 0.814 | 81% | 0.814 | S | S | * | * | 58.6 | 115.1 | 66.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 5 | G | 47.5 | Very low | 45.3 | Very low | 70 Ų | 70 | 124.4 Ų | 124.4 | 72% | 0.722 | 81% | 0.809 | S | S | * | * | cis | 131.7 | 136.6 | 23.7 | 0 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 6 | T | 41 | Very low | 45.9 | Very low | 151 Ų | 151 | 122.9 Ų | 122.9 | 93% | 0.926 | 80% | 0.802 | S | S | * | * | trans | -173.7 | 132.6 | 149.9 | 40.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 7 | L | 47 | Very low | 46.3 | Very low | 184 Ų | 184 | 121.9 Ų | 121.9 | 96% | 0.963 | 79% | 0.786 | S | S | * | * | trans | -78.6 | 166.7 | 177.9 | -67.5 | 101.5 | 0 | 0 | 0 | 114 | ||||
| 8 | G | 36.5 | Very low | 46.8 | Very low | 70 Ų | 70 | 124.3 Ų | 124.3 | 72% | 0.722 | 78% | 0.778 | S | S | * | * | trans | 154.5 | 89.1 | 153 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 9 | S | 41.3 | Very low | 47.3 | Very low | 112 Ų | 112 | 122.4 Ų | 122.4 | 78% | 0.783 | 77% | 0.768 | S | S | * | * | 54.4 | 106.5 | 85.8 | -163.9 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 10 | T | 41.4 | Very low | 47.9 | Very low | 136 Ų | 136 | 120.1 Ų | 120.1 | 83% | 0.834 | 75% | 0.753 | S | S | * | * | 166 | 126.3 | 123.1 | 37.1 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 11 | A | 48.6 | Very low | 48.4 | Very low | 87 Ų | 87 | 121.6 Ų | 121.6 | 72% | 0.719 | 75% | 0.745 | S | S | * | * | trans | 72 | 130.4 | 143.5 | 0 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 12 | P | 58.5 | Low | 49.6 | Very low | 125 Ų | 125 | 119.7 Ų | 119.7 | 81% | 0.812 | 73% | 0.725 | S | S | * | * | trans | -96.5 | 112.7 | 170.7 | 35.7 | -26.7 | 0 | 0 | 0 | 111.5 | ||||
| 13 | V | 53.4 | Low | 50.7 | Low | 121 Ų | 121 | 114.6 Ų | 114.6 | 73% | 0.733 | 71% | 0.709 | S | S | * | * | trans | -147.8 | 107.8 | 169.2 | -75.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 14 | N | 54.3 | Low | 52.1 | Low | 97 Ų | 97 | 114.6 Ų | 114.6 | 52% | 0.519 | 70% | 0.7 | S | S | . | * | trans | 159.9 | 4.1 | 144.2 | -85.7 | -38 | 0 | 0 | 0 | 115.7 | S16 M17 Y18 | N14-S16 PolarHBondContact O-N 3.07Å; N14-M17 PolarHBondContact O-N 3.21Å; N14-Y18 HydrophobicContact CB-CD2 4.1Å; N14-Y18 HydrophobicContact CB-CE2 3.74Å; N14-Y18 WeakPolarHBondContact O-CD2 3.12Å | ||
| 15 | A | 53.1 | Low | 53.2 | Low | 89 Ų | 89 | 118.8 Ų | 118.8 | 74% | 0.736 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -59.4 | -32.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 16 | S | 55 | Low | 54.4 | Low | 101 Ų | 101 | 119.2 Ų | 119.2 | 71% | 0.706 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -72.6 | -30.9 | -179 | -165 | 0 | 0 | 0 | 0 | 113.9 | N14 T20 | N14-S16 PolarHBondContact O-N 3.07Å; S16-T20 PolarHBondContact O-OG1 3.2Å |
| 17 | M | 53 | Low | 55.8 | Low | 106 Ų | 106 | 114.8 Ų | 114.8 | 52% | 0.522 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -76.8 | -25.4 | 179.8 | -102.6 | -103 | 140.1 | 0 | 0 | 113.2 | N14 T20 R21 | N14-M17 PolarHBondContact O-N 3.21Å; M17-T20 PolarHBondContact O-OG1 2.76Å; M17-R21 WeakPolarHBondContact O-CG 3.41Å; M17-R21 PolarHBondContact O-N 2.81Å |
| 18 | Y | 55.9 | Low | 56.9 | Low | 164 Ų | 164 | 112 Ų | 112 | 64% | 0.643 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -83.2 | -31.5 | 178.5 | -73.1 | -70.8 | 0 | 0 | 0 | 113 | N14 R22 | N14-Y18 HydrophobicContact CB-CD2 4.1Å; N14-Y18 HydrophobicContact CB-CE2 3.74Å; N14-Y18 WeakPolarHBondContact O-CD2 3.12Å; Y18-R22 WeakPolarHBondContact O-CB 3.49Å; Y18-R22 PolarHBondContact O-N 2.93Å |
| 19 | C | 55.8 | Low | 58.3 | Low | 88 Ų | 88 | 117.3 Ų | 117.3 | 60% | 0.595 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -66.1 | -44.3 | 174.8 | -102.4 | 0 | 0 | 0 | 0 | 112.3 | R22 C23 | C19-R22 PolarHBondContact O-N 3.02Å; C19-C23 WeakPolarHBondContact O-CB 3.4Å; C19-C23 PolarHBondContact O-N 3.11Å; C19-C23 PolarHBondContact O-SG 2.79Å |
| 20 | T | 59.4 | Low | 59.8 | Low | 77 Ų | 77 | 114.6 Ų | 114.6 | 47% | 0.472 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -67.8 | -40.8 | 179.9 | 47.1 | 0 | 0 | 0 | 0 | 112.5 | S16 M17 L24 | S16-T20 PolarHBondContact O-OG1 3.2Å; M17-T20 PolarHBondContact O-OG1 2.76Å; T20-L24 PolarHBondContact O-N 2.94Å |
| 21 | R | 59.2 | Low | 61.2 | Low | 152 Ų | 152 | 111.2 Ų | 111.2 | 57% | 0.574 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -70 | -34.2 | 175.7 | -75.2 | -176.5 | 171.2 | -143.5 | -3.1 | 113.4 | M17 R25 | M17-R21 WeakPolarHBondContact O-CG 3.41Å; M17-R21 PolarHBondContact O-N 2.81Å; R21-R25 WeakPolarHBondContact O-CB 3.33Å; R21-R25 VanDerWaalsContact O-CG 3.3Å; R21-R25 WeakPolarHBondContact O-CG 3.21Å; R21-R25 PolarHBondContact O-N 2.94Å; R21-R25 VanDerWaalsContact O-N 3.14Å |
| 22 | R | 61.1 | Low | 62.2 | Low | 198 Ų | 198 | 109.1 Ų | 109.1 | 75% | 0.747 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -72.7 | -41.3 | 177.2 | -160.9 | 169.5 | -174.9 | 178.8 | -0.2 | 110.8 | Y18 C19 R25 T26 | Y18-R22 WeakPolarHBondContact O-CB 3.49Å; Y18-R22 PolarHBondContact O-N 2.93Å; C19-R22 PolarHBondContact O-N 3.02Å; R22-R25 PolarHBondContact O-N 2.96Å; R22-T26 WeakPolarHBondContact O-CG2 3.36Å; R22-T26 PolarHBondContact O-N 2.81Å; R22-T26 PolarHBondContact O-OG1 3.22Å |
| 23 | C | 63.2 | Low | 62.7 | Low | 81 Ų | 81 | 107.3 Ų | 107.3 | 55% | 0.547 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -63.7 | -41.9 | 173.9 | -72.8 | 0 | 0 | 0 | 0 | 113.1 | C19 R25 T26 A27 | C19-C23 WeakPolarHBondContact O-CB 3.4Å; C19-C23 PolarHBondContact O-N 3.11Å; C19-C23 PolarHBondContact O-SG 2.79Å; C23-R25 PolarHBondContact O-N 3.38Å; C23-T26 WeakPolarHBondContact CA-OG1 3.15Å; C23-T26 PolarHBondContact O-N 3.45Å; C23-T26 PolarHBondContact O-OG1 3.39Å; C23-A27 VanDerWaalsContact O-CB 3.31Å; C23-A27 WeakPolarHBondContact O-CB 3.44Å; C23-A27 PolarHBondContact O-N 3.08Å |
| 24 | L | 66.2 | Low | 63.6 | Low | 118 Ų | 118 | 106.4 Ų | 106.4 | 62% | 0.618 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -64 | -40.9 | 175.2 | -113.9 | 83.8 | 0 | 0 | 0 | 112 | T20 A27 L28 | T20-L24 PolarHBondContact O-N 2.94Å; L24-A27 PolarHBondContact O-N 2.82Å; L24-L28 WeakPolarHBondContact O-CB 2.83Å; L24-L28 WeakPolarHBondContact O-CD1 3.46Å; L24-L28 PolarHBondContact O-N 2.98Å |
| 25 | R | 65.8 | Low | 64.3 | Low | 168 Ų | 168 | 107.8 Ų | 107.8 | 63% | 0.634 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -70.7 | -35.2 | 179.9 | -77.1 | 178.4 | 175.1 | 177.2 | -1.8 | 112.7 | R21 R22 C23 R29 | R21-R25 WeakPolarHBondContact O-CB 3.33Å; R21-R25 VanDerWaalsContact O-CG 3.3Å; R21-R25 WeakPolarHBondContact O-CG 3.21Å; R21-R25 PolarHBondContact O-N 2.94Å; R21-R25 VanDerWaalsContact O-N 3.14Å; R22-R25 PolarHBondContact O-N 2.96Å; C23-R25 PolarHBondContact O-N 3.38Å; R25-R29 WeakPolarHBondContact O-CB 3.49Å; R25-R29 VanDerWaalsContact O-CG 3.26Å; R25-R29 WeakPolarHBondContact O-CG 3.39Å; R25-R29 PolarHBondContact O-N 3.23Å; R25-R29 VanDerWaalsContact O-N 3.12Å |
| 26 | T | 71.9 | Confident | 64.9 | Low | 79 Ų | 79 | 111.4 Ų | 111.4 | 49% | 0.485 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -72 | -38.7 | 174.1 | 47 | 0 | 0 | 0 | 0 | 111.6 | R22 C23 R29 A30 | R22-T26 WeakPolarHBondContact O-CG2 3.36Å; R22-T26 PolarHBondContact O-N 2.81Å; R22-T26 PolarHBondContact O-OG1 3.22Å; C23-T26 WeakPolarHBondContact CA-OG1 3.15Å; C23-T26 PolarHBondContact O-N 3.45Å; C23-T26 PolarHBondContact O-OG1 3.39Å; T26-R29 PolarHBondContact O-N 3.04Å; T26-A30 WeakPolarHBondContact O-CB 3.45Å; T26-A30 PolarHBondContact O-N 2.98Å |
| 27 | A | 71.6 | Confident | 65.3 | Low | 58 Ų | 58 | 112.2 Ų | 112.2 | 48% | 0.479 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.6 | -44.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | C23 L24 R29 A30 A31 | C23-A27 VanDerWaalsContact O-CB 3.31Å; C23-A27 WeakPolarHBondContact O-CB 3.44Å; C23-A27 PolarHBondContact O-N 3.08Å; L24-A27 PolarHBondContact O-N 2.82Å; A27-R29 VanDerWaalsContact C-N 3.34Å; A27-R29 PolarHBondContact O-N 2.95Å; A27-A30 PolarHBondContact O-N 3.02Å; A27-A31 WeakPolarHBondContact O-CB 2.91Å; A27-A31 PolarHBondContact O-N 2.9Å |
| 28 | L | 70 | Confident | 65.8 | Low | 124 Ų | 124 | 113.2 Ų | 113.2 | 65% | 0.649 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -63.2 | -38.1 | 174.9 | -103.1 | 81.1 | 0 | 0 | 0 | 112.4 | L24 A32 | L24-L28 WeakPolarHBondContact O-CB 2.83Å; L24-L28 WeakPolarHBondContact O-CD1 3.46Å; L24-L28 PolarHBondContact O-N 2.98Å; L28-A32 VanDerWaalsContact O-CB 3.25Å; L28-A32 WeakPolarHBondContact O-CB 3.27Å; L28-A32 PolarHBondContact O-N 2.93Å |
| 29 | R | 66.6 | Low | 65.8 | Low | 183 Ų | 183 | 110.1 Ų | 110.1 | 69% | 0.691 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -69.1 | -38 | 177 | -78.2 | 177.5 | -178.8 | 178.2 | -0.5 | 112.4 | R25 T26 A27 N33 | R25-R29 WeakPolarHBondContact O-CB 3.49Å; R25-R29 VanDerWaalsContact O-CG 3.26Å; R25-R29 WeakPolarHBondContact O-CG 3.39Å; R25-R29 PolarHBondContact O-N 3.23Å; R25-R29 VanDerWaalsContact O-N 3.12Å; T26-R29 PolarHBondContact O-N 3.04Å; A27-R29 VanDerWaalsContact C-N 3.34Å; A27-R29 PolarHBondContact O-N 2.95Å; R29-N33 WeakPolarHBondContact O-CB 3.16Å; R29-N33 PolarHBondContact O-N 2.67Å |
| 30 | A | 71.4 | Confident | 66.1 | Low | 55 Ų | 55 | 112.9 Ų | 112.9 | 46% | 0.455 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -66.5 | -45.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | T26 A27 A32 N33 V34 | T26-A30 WeakPolarHBondContact O-CB 3.45Å; T26-A30 PolarHBondContact O-N 2.98Å; A27-A30 PolarHBondContact O-N 3.02Å; A30-A32 PolarHBondContact O-N 2.98Å; A30-N33 PolarHBondContact O-N 3.41Å; A30-V34 WeakPolarHBondContact O-CG2 3.37Å; A30-V34 PolarHBondContact O-N 2.91Å |
| 31 | A | 71.9 | Confident | 66.1 | Low | 65 Ų | 65 | 117.5 Ų | 117.5 | 54% | 0.537 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -62.5 | -40.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A27 V34 H35 | A27-A31 WeakPolarHBondContact O-CB 2.91Å; A27-A31 PolarHBondContact O-N 2.9Å; A31-V34 PolarHBondContact O-N 3.43Å; A31-H35 WeakPolarHBondContact O-CB 3.36Å; A31-H35 PolarHBondContact O-N 2.87Å |
| 32 | A | 69.5 | Low | 65.8 | Low | 42 Ų | 42 | 117 Ų | 117 | 35% | 0.347 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66 | -36.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L28 A30 R36 | L28-A32 VanDerWaalsContact O-CB 3.25Å; L28-A32 WeakPolarHBondContact O-CB 3.27Å; L28-A32 PolarHBondContact O-N 2.93Å; A30-A32 PolarHBondContact O-N 2.98Å; A32-R36 WeakPolarHBondContact O-CB 3.32Å; A32-R36 WeakPolarHBondContact O-CG 3.15Å; A32-R36 PolarHBondContact O-N 2.87Å |
| 33 | N | 69.1 | Low | 65.6 | Low | 87 Ų | 87 | 111 Ų | 111 | 47% | 0.465 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -73.4 | -38.6 | 176.6 | -84.4 | -10.9 | 0 | 0 | 0 | 112.4 | R29 A30 H35 R36 H37 | R29-N33 WeakPolarHBondContact O-CB 3.16Å; R29-N33 PolarHBondContact O-N 2.67Å; A30-N33 PolarHBondContact O-N 3.41Å; N33-H35 VanDerWaalsContact C-N 3.35Å; N33-R36 PolarHBondContact O-N 3.48Å; N33-H37 WeakPolarHBondContact O-CB 3.37Å; N33-H37 PolarHBondContact O-CD2 3.36Å; N33-H37 PolarHBondContact O-N 2.87Å |
| 34 | V | 72 | Confident | 65.1 | Low | 103 Ų | 103 | 112.7 Ų | 112.7 | 62% | 0.624 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -64.7 | -41 | 174.3 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | A30 A31 H37 H38 | A30-V34 WeakPolarHBondContact O-CG2 3.37Å; A30-V34 PolarHBondContact O-N 2.91Å; A31-V34 PolarHBondContact O-N 3.43Å; V34-H37 PolarHBondContact O-N 2.96Å; V34-H38 WeakPolarHBondContact O-CB 3.5Å; V34-H38 PolarHBondContact O-N 3.49Å |
| 35 | H | 69.6 | Low | 64.6 | Low | 125 Ų | 125 | 111.2 Ų | 111.2 | 58% | 0.579 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -66.6 | -39.6 | 176.5 | -166.8 | 67.9 | 0 | 0 | 0 | 112.7 | A31 N33 H38 L39 | A31-H35 WeakPolarHBondContact O-CB 3.36Å; A31-H35 PolarHBondContact O-N 2.87Å; N33-H35 VanDerWaalsContact C-N 3.35Å; H35-H38 PolarHBondContact O-N 2.76Å; H35-L39 WeakPolarHBondContact O-CG 3.19Å; H35-L39 PolarHBondContact O-N 3.48Å |
| 36 | R | 64.9 | Low | 63.8 | Low | 165 Ų | 165 | 111.1 Ų | 111.1 | 62% | 0.623 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -64.8 | -42.6 | 172.4 | -77.9 | -179.1 | -162.4 | 168.7 | 3.1 | 112.4 | A32 N33 H38 L39 Q40 | A32-R36 WeakPolarHBondContact O-CB 3.32Å; A32-R36 WeakPolarHBondContact O-CG 3.15Å; A32-R36 PolarHBondContact O-N 2.87Å; N33-R36 PolarHBondContact O-N 3.48Å; R36-H38 VanDerWaalsContact C-N 3.3Å; R36-H38 PolarHBondContact O-N 3.02Å; R36-L39 PolarHBondContact O-N 3.34Å; R36-Q40 WeakPolarHBondContact O-CB 3.3Å; R36-Q40 PolarHBondContact O-N 2.76Å |
| 37 | H | 62.9 | Low | 62.1 | Low | 119 Ų | 119 | 112.8 Ų | 112.8 | 55% | 0.551 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -64.5 | -36 | 176.7 | -93.2 | -74 | 0 | 0 | 0 | 112.2 | N33 V34 Q40 Q41 | N33-H37 WeakPolarHBondContact O-CB 3.37Å; N33-H37 PolarHBondContact O-CD2 3.36Å; N33-H37 PolarHBondContact O-N 2.87Å; V34-H37 PolarHBondContact O-N 2.96Å; H37-Q40 PolarHBondContact O-N 3Å; H37-Q41 PolarHBondContact O-N 3.09Å |
| 38 | H | 63 | Low | 61.4 | Low | 127 Ų | 127 | 114.7 Ų | 114.7 | 59% | 0.588 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -66.7 | -44.9 | 175.3 | -159.4 | 71.1 | 0 | 0 | 0 | 111.8 | V34 H35 R36 Q40 Q41 Q42 | V34-H38 WeakPolarHBondContact O-CB 3.5Å; V34-H38 PolarHBondContact O-N 3.49Å; H35-H38 PolarHBondContact O-N 2.76Å; R36-H38 VanDerWaalsContact C-N 3.3Å; R36-H38 PolarHBondContact O-N 3.02Å; H38-Q40 VanDerWaalsContact C-N 3.28Å; H38-Q40 PolarHBondContact O-N 3.32Å; H38-Q41 PolarHBondContact O-N 2.8Å; H38-Q42 WeakPolarHBondContact O-CB 3.33Å; H38-Q42 PolarHBondContact O-N 3.34Å |
| 39 | L | 57.6 | Low | 60.5 | Low | 99 Ų | 99 | 114.8 Ų | 114.8 | 52% | 0.518 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -63.5 | -33.6 | 173.9 | -73.9 | 169.7 | 0 | 0 | 0 | 112.7 | H35 R36 Q42 | H35-L39 WeakPolarHBondContact O-CG 3.19Å; H35-L39 PolarHBondContact O-N 3.48Å; R36-L39 PolarHBondContact O-N 3.34Å; L39-Q42 PolarHBondContact O-N 2.89Å |
| 40 | Q | 61 | Low | 59.8 | Low | 145 Ų | 145 | 117 Ų | 117 | 68% | 0.678 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -78.8 | -23.2 | -178.3 | -160.3 | 173.5 | -23.9 | 0 | 0 | 113 | R36 H37 H38 | R36-Q40 WeakPolarHBondContact O-CB 3.3Å; R36-Q40 PolarHBondContact O-N 2.76Å; H37-Q40 PolarHBondContact O-N 3Å; H38-Q40 VanDerWaalsContact C-N 3.28Å; H38-Q40 PolarHBondContact O-N 3.32Å |
| 41 | Q | 59.1 | Low | 58.5 | Low | 174 Ų | 174 | 122.7 Ų | 122.7 | 81% | 0.813 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -85.4 | -21.3 | 170.6 | -72.9 | -154.5 | 1.1 | 0 | 0 | 113.5 | H37 H38 | H37-Q41 PolarHBondContact O-N 3.09Å; H38-Q41 PolarHBondContact O-N 2.8Å |
| 42 | Q | 54 | Low | 57.2 | Low | 141 Ų | 141 | 127 Ų | 127 | 66% | 0.659 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -88.7 | -2.6 | -176.4 | -154.5 | 175.2 | -6.6 | 0 | 0 | 114.3 | H38 L39 P44 | H38-Q42 WeakPolarHBondContact O-CB 3.33Å; H38-Q42 PolarHBondContact O-N 3.34Å; L39-Q42 PolarHBondContact O-N 2.89Å; Q42-P44 WeakPolarHBondContact O-CD 3.44Å |
| 43 | A | 55.9 | Low | 55.9 | Low | 74 Ų | 74 | 133.7 Ų | 133.7 | 61% | 0.612 | 70% | 0.698 | S | S | * | * | trans | -111.5 | 82.1 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 44 | P | 52.9 | Low | 54.3 | Low | 115 Ų | 115 | 135.2 Ų | 135.2 | 75% | 0.747 | 71% | 0.711 | S | S | * | * | trans | -77.4 | 129.8 | 159 | 32.8 | -27.3 | 0 | 0 | 0 | 108.2 | Q42 | Q42-P44 WeakPolarHBondContact O-CD 3.44Š| ||
| 45 | A | 56.5 | Low | 52.8 | Low | 88 Ų | 88 | 135.5 Ų | 135.5 | 73% | 0.727 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 69.5 | 123.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 46 | L | 49.2 | Very low | 51.5 | Low | 166 Ų | 166 | 134.9 Ų | 134.9 | 87% | 0.869 | 73% | 0.727 | S | S | * | * | 147.8 | 126.1 | 129 | -71.1 | -178.2 | 0 | 0 | 0 | 112.1 | |||||
| 47 | C | 36.1 | Very low | 49.9 | Very low | 114 Ų | 114 | 133.5 Ų | 133.5 | 77% | 0.77 | 74% | 0.737 | S | S | * | * | trans | 64 | 104.7 | 158 | -86.4 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 48 | S | 55.5 | Low | 48.8 | Very low | 98 Ų | 98 | 132.5 Ų | 132.5 | 69% | 0.685 | 75% | 0.749 | S | S | * | * | 39.6 | 128.6 | 69.7 | 79.4 | 0 | 0 | 0 | 0 | 114.8 | |||||
| 49 | V | 52.3 | Low | 47.9 | Very low | 125 Ų | 125 | 134.8 Ų | 134.8 | 76% | 0.758 | 76% | 0.758 | S | S | * | * | trans | 93.4 | 88.4 | 165.1 | -163.9 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 50 | R | 51.5 | Low | 47.1 | Very low | 230 Ų | 230 | 135.7 Ų | 135.7 | 87% | 0.868 | 77% | 0.773 | S | S | * | * | 160.6 | 112.9 | 127.7 | -90 | 168.4 | -160.6 | -167.5 | 5.4 | 110.6 | |||||
| 51 | L | 43.8 | Very low | 46.6 | Very low | 174 Ų | 174 | 134.5 Ų | 134.5 | 91% | 0.911 | 77% | 0.767 | S | S | * | * | 174 | 90.5 | 125 | -92.1 | 149.9 | 0 | 0 | 0 | 109.9 | |||||
| 52 | L | 44.3 | Very low | 45.7 | Very low | 157 Ų | 157 | 131 Ų | 131 | 82% | 0.822 | 77% | 0.767 | S | S | * | * | trans | -83.2 | 141.6 | 157 | -89.4 | 151.8 | 0 | 0 | 0 | 109.1 | ||||
| 53 | K | 42 | Very low | 44.9 | Very low | 182 Ų | 182 | 130.5 Ų | 130.5 | 79% | 0.791 | 77% | 0.769 | S | S | * | * | trans | 78.3 | 132.2 | 155.2 | -124.4 | 77.7 | 179.2 | 179.2 | 0 | 115.7 | ||||
| 54 | T | 37.1 | Very low | 44.5 | Very low | 119 Ų | 119 | 131.3 Ų | 131.3 | 73% | 0.73 | 78% | 0.775 | S | S | * | * | cis | -158.3 | 145.4 | 39.4 | 49.8 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 55 | S | 40.6 | Very low | 44.7 | Very low | 109 Ų | 109 | 131.7 Ų | 131.7 | 76% | 0.762 | 78% | 0.775 | S | S | * | * | trans | 66.9 | 112.7 | 138.8 | 58.5 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 56 | S | 41.2 | Very low | 44.8 | Very low | 111 Ų | 111 | 132.9 Ų | 132.9 | 78% | 0.776 | 78% | 0.776 | S | S | * | * | 73.4 | 105.5 | 128.7 | -155.7 | 0 | 0 | 0 | 0 | 120.3 | |||||
| 57 | T | 30.9 | Very low | 45.1 | Very low | 137 Ų | 137 | 129.1 Ų | 129.1 | 84% | 0.84 | 77% | 0.769 | S | S | * | * | -170.4 | 140.4 | 124.1 | 31.5 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 58 | A | 40.6 | Very low | 45.9 | Very low | 98 Ų | 98 | 131.3 Ų | 131.3 | 81% | 0.81 | 77% | 0.772 | S | S | * | * | trans | 69.2 | 88.8 | 160 | 0 | 0 | 0 | 0 | 0 | 119 | S60 | A58-S60 PolarHBondContact O-N 2.86Å; A58-S60 VanDerWaalsContact O-N 3.15Å | ||
| 59 | F | 42.9 | Very low | 45.9 | Very low | 174 Ų | 174 | 134.5 Ų | 134.5 | 76% | 0.763 | 78% | 0.781 | S | S | * | * | trans | -60.4 | 97.5 | 151.4 | -178.1 | -97.8 | 0 | 0 | 0 | 109.6 | E61 | F59-E61 HydrophobicContact CD2-CB 4.32Å; F59-E61 HydrophobicContact CE2-CB 4Å; F59-E61 HydrophobicContact CE2-CG 4.39Å; F59-E61 WeakPolarHBondContact CE2-OE2 3.32Å; F59-E61 HydrophobicContact CZ-CB 4.12Å | ||
| 60 | S | 41.6 | Very low | 46.4 | Very low | 119 Ų | 119 | 131.8 Ų | 131.8 | 83% | 0.832 | 78% | 0.779 | S | S | * | * | trans | -131.1 | 83.5 | 154.9 | -122.1 | 0 | 0 | 0 | 0 | 105.9 | A58 A62 | A58-S60 PolarHBondContact O-N 2.86Å; A58-S60 VanDerWaalsContact O-N 3.15Å; S60-A62 VanDerWaalsContact C-N 3.29Å; S60-A62 PolarHBondContact O-N 3.4Å | ||
| 61 | E | 50.1 | Low | 46.9 | Very low | 120 Ų | 120 | 124.1 Ų | 124.1 | 56% | 0.561 | 77% | 0.765 | S | S | * | * | trans | -72.4 | 78.8 | -173.2 | 179.7 | 151.7 | 106 | 0 | 0 | 109.4 | F59 L63 | F59-E61 HydrophobicContact CD2-CB 4.32Å; F59-E61 HydrophobicContact CE2-CB 4Å; F59-E61 HydrophobicContact CE2-CG 4.39Å; F59-E61 WeakPolarHBondContact CE2-OE2 3.32Å; F59-E61 HydrophobicContact CZ-CB 4.12Å; E61-L63 HydrophobicContact CG-CD1 4.12Å; E61-L63 HydrophobicContact CG-CD2 3.54Å; E61-L63 HydrophobicContact CG-CG 3.46Å; E61-L63 VanDerWaalsContact CG-CG 3.46Å; E61-L63 PolarHBondContact O-N 3.35Å | ||
| 62 | A | 39.7 | Very low | 48.1 | Very low | 99 Ų | 99 | 121.8 Ų | 121.8 | 82% | 0.818 | 76% | 0.76 | S | S | * | * | trans | -73.2 | 80.9 | 154.7 | 0 | 0 | 0 | 0 | 0 | 106.8 | S60 A64 | S60-A62 VanDerWaalsContact C-N 3.29Å; S60-A62 PolarHBondContact O-N 3.4Å; A62-A64 PolarHBondContact O-N 3.01Å | ||
| 63 | L | 39.1 | Very low | 49.5 | Very low | 132 Ų | 132 | 121.9 Ų | 121.9 | 69% | 0.691 | 75% | 0.754 | S | S | * | * | trans | -53.2 | 113 | 170 | -68.6 | 167.7 | 0 | 0 | 0 | 107.2 | E61 T65 | E61-L63 HydrophobicContact CG-CD1 4.12Å; E61-L63 HydrophobicContact CG-CD2 3.54Å; E61-L63 HydrophobicContact CG-CG 3.46Å; E61-L63 VanDerWaalsContact CG-CG 3.46Å; E61-L63 PolarHBondContact O-N 3.35Å; L63-T65 PolarHBondContact O-N 2.93Å; L63-T65 VanDerWaalsContact O-N 3.09Å | ||
| 64 | A | 46.3 | Very low | 51.3 | Low | 90 Ų | 90 | 122.4 Ų | 122.4 | 74% | 0.744 | 76% | 0.759 | S | S | * | * | trans | -47.5 | 120.6 | 163 | 0 | 0 | 0 | 0 | 0 | 107.3 | A62 | A62-A64 PolarHBondContact O-N 3.01Š| ||
| 65 | T | 56.8 | Low | 53.5 | Low | 123 Ų | 123 | 122.9 Ų | 122.9 | 76% | 0.755 | 75% | 0.748 | S | S | * | * | trans | -39.4 | 128.4 | 166.8 | 39.1 | 0 | 0 | 0 | 0 | 109.5 | L63 A67 | L63-T65 PolarHBondContact O-N 2.93Å; L63-T65 VanDerWaalsContact O-N 3.09Å; T65-A67 PolarHBondContact O-N 3.08Å | ||
| 66 | P | 59.3 | Low | 55.8 | Low | 114 Ų | 114 | 120.3 Ų | 120.3 | 74% | 0.74 | 73% | 0.731 | S | S | * | * | trans | -58.4 | 114.3 | 172.2 | 24.1 | -31.3 | 0 | 0 | 0 | 106.8 | L68 | P66-L68 WeakPolarHBondContact O-CD2 3.31Å; P66-L68 PolarHBondContact O-N 3.31Å | ||
| 67 | A | 54.9 | Low | 58.1 | Low | 87 Ų | 87 | 119.3 Ų | 119.3 | 72% | 0.719 | 72% | 0.721 | S | S | * | * | trans | -55.9 | 128.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | T65 D69 | T65-A67 PolarHBondContact O-N 3.08Å; A67-D69 PolarHBondContact O-N 3.29Å; A67-D69 VanDerWaalsContact O-N 3.16Å | ||
| 68 | L | 53.7 | Low | 61 | Low | 159 Ų | 159 | 120.7 Ų | 120.7 | 83% | 0.832 | 72% | 0.716 | S | S | * | * | trans | -67.1 | 117.8 | -179 | -34.1 | -174.9 | 0 | 0 | 0 | 105.5 | P66 G70 | P66-L68 WeakPolarHBondContact O-CD2 3.31Å; P66-L68 PolarHBondContact O-N 3.31Å; L68-G70 PolarHBondContact O-N 2.94Å | ||
| 69 | D | 56 | Low | 63.4 | Low | 165 Ų | 165 | 119.7 Ų | 119.7 | 88% | 0.882 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -65.9 | 64.4 | 171.5 | -93.8 | -69.5 | 0 | 0 | 0 | 110.1 | A67 | A67-D69 PolarHBondContact O-N 3.29Å; A67-D69 VanDerWaalsContact O-N 3.16Å |
| 70 | G | 61.6 | Low | 65.7 | Low | 69 Ų | 69 | 117 Ų | 117 | 71% | 0.711 | 69% | 0.686 | S | S | * | * | trans | -103.2 | 17.2 | 158.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | L68 | L68-G70 PolarHBondContact O-N 2.94Š| ||
| 71 | A | 62.1 | Low | 68.2 | Low | 69 Ų | 69 | 117.4 Ų | 117.4 | 57% | 0.57 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -67 | 128.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 108.7 | K73 | A71-K73 PolarHBondContact O-N 3.45Å; A71-K73 VanDerWaalsContact O-N 3.07Å |
| 72 | P | 70.1 | Confident | 70.2 | Confident | 124 Ų | 124 | 116.3 Ų | 116.3 | 81% | 0.805 | 67% | 0.672 | S | S | * | * | trans | -58 | 119.5 | 172.9 | 23.8 | -30.9 | 0 | 0 | 0 | 107.8 | E74 | P72-E74 PolarHBondContact O-N 2.95Š| ||
| 73 | K | 73.1 | Confident | 72.7 | Confident | 159 Ų | 159 | 116 Ų | 116 | 69% | 0.691 | 66% | 0.659 | S | S | * | * | trans | -57.5 | 113 | 170.6 | -74.8 | 176.7 | -178.9 | 169.6 | 0 | 106.9 | A71 Y75 | A71-K73 PolarHBondContact O-N 3.45Å; A71-K73 VanDerWaalsContact O-N 3.07Å; K73-Y75 HydrophobicContact CB-CE1 4.1Å; K73-Y75 HydrophobicContact CB-CE2 4.24Å; K73-Y75 WeakPolarHBondContact O-CD2 3.26Å; K73-Y75 VanDerWaalsContact O-CE2 3.25Å; K73-Y75 WeakPolarHBondContact O-CE2 3.49Å; K73-Y75 PolarHBondContact O-N 2.86Å; K73-Y75 VanDerWaalsContact O-N 3.11Å | ||
| 74 | E | 80.1 | Confident | 75.2 | Confident | 194 Ų | 194 | 113.3 Ų | 113.3 | 91% | 0.907 | 65% | 0.652 | S | S | * | * | trans | -71.5 | 106.7 | 177 | -161 | -166.8 | 163.8 | 0 | 0 | 107.7 | P72 | P72-E74 PolarHBondContact O-N 2.95Š| ||
| 75 | Y | 83.3 | Confident | 77.5 | Confident | 128 Ų | 128 | 113.5 Ų | 113.5 | 50% | 0.502 | 64% | 0.641 | S | S | . | * | trans | -83.8 | 137.8 | 175.7 | -57.4 | -73.9 | 0 | 0 | 0 | 108.9 | K73 I79 | K73-Y75 HydrophobicContact CB-CE1 4.1Å; K73-Y75 HydrophobicContact CB-CE2 4.24Å; K73-Y75 WeakPolarHBondContact O-CD2 3.26Å; K73-Y75 VanDerWaalsContact O-CE2 3.25Å; K73-Y75 WeakPolarHBondContact O-CE2 3.49Å; K73-Y75 PolarHBondContact O-N 2.86Å; K73-Y75 VanDerWaalsContact O-N 3.11Å; Y75-I79 HydrophobicContact CD1-CG2 4.41Å; Y75-I79 HydrophobicContact CG-CG2 4.44Å | ||
| 76 | S | 89.1 | Confident | 79.2 | Confident | 56 Ų | 56 | 111.2 Ų | 111.2 | 39% | 0.392 | 62% | 0.623 | S | S | . | * | trans | -54.8 | 149.9 | 174.4 | 72.8 | 0 | 0 | 0 | 0 | 111.1 | K78 I79 Q80 | S76-K78 PolarHBondContact O-N 3.14Å; S76-I79 WeakPolarHBondContact O-CB 3.38Å; S76-I79 PolarHBondContact O-N 3.28Å; S76-I79 WeakPolarHBondContact OG-CD1 3.42Å; S76-I79 WeakPolarHBondContact OG-CG1 3.19Å; S76-Q80 PolarHBondContact O-N 3.44Å | ||
| 77 | P | 89.8 | Confident | 80.8 | Confident | 90 Ų | 90 | 109.8 Ų | 109.8 | 58% | 0.584 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -56.9 | -31.1 | -175.5 | 21.1 | -33.8 | 0 | 0 | 0 | 112.9 | I79 Q80 Q81 | P77-I79 VanDerWaalsContact C-N 3.31Å; P77-I79 PolarHBondContact O-N 3.32Å; P77-Q80 PolarHBondContact O-N 3.39Å; P77-Q81 WeakPolarHBondContact O-CG 3.23Å; P77-Q81 PolarHBondContact O-N 2.9Å |
| 78 | K | 91.6 | Very high | 82.7 | Confident | 165 Ų | 165 | 110 Ų | 110 | 72% | 0.717 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -61.4 | -37.1 | 175.7 | -62.3 | -177.6 | 179.8 | -179.5 | 0 | 113.1 | S76 L82 | S76-K78 PolarHBondContact O-N 3.14Å; K78-L82 PolarHBondContact O-N 3.01Å |
| 79 | I | 90.9 | Very high | 84.6 | Confident | 77 Ų | 77 | 105.1 Ų | 105.1 | 40% | 0.395 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -73.2 | -40.2 | -179.5 | -63.4 | 167.8 | 0 | 0 | 0 | 109.8 | Y75 S76 P77 Q81 L82 V83 | Y75-I79 HydrophobicContact CD1-CG2 4.41Å; Y75-I79 HydrophobicContact CG-CG2 4.44Å; S76-I79 WeakPolarHBondContact O-CB 3.38Å; S76-I79 PolarHBondContact O-N 3.28Å; S76-I79 WeakPolarHBondContact OG-CD1 3.42Å; S76-I79 WeakPolarHBondContact OG-CG1 3.19Å; P77-I79 VanDerWaalsContact C-N 3.31Å; P77-I79 PolarHBondContact O-N 3.32Å; I79-Q81 VanDerWaalsContact C-N 3.32Å; I79-Q81 PolarHBondContact O-N 2.94Å; I79-L82 PolarHBondContact O-N 3.17Å; I79-V83 WeakPolarHBondContact O-CG2 3.32Å; I79-V83 PolarHBondContact O-N 3.24Å |
| 80 | Q | 90.4 | Very high | 86.4 | Confident | 118 Ų | 118 | 101 Ų | 101 | 55% | 0.551 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -63.5 | -40.1 | 176 | -65.4 | -179.1 | -35.8 | 0 | 0 | 111.5 | S76 P77 V83 S84 | S76-Q80 PolarHBondContact O-N 3.44Å; P77-Q80 PolarHBondContact O-N 3.39Å; Q80-V83 PolarHBondContact O-N 2.99Å; Q80-S84 PolarHBondContact O-N 3.37Å; Q80-S84 VanDerWaalsContact O-N 3.07Å |
| 81 | Q | 93.4 | Very high | 87.7 | Confident | 127 Ų | 127 | 105.4 Ų | 105.4 | 59% | 0.593 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.6 | -49.1 | 173.3 | -73.1 | -176.8 | -49 | 0 | 0 | 111.7 | P77 I79 V83 S84 D85 | P77-Q81 WeakPolarHBondContact O-CG 3.23Å; P77-Q81 PolarHBondContact O-N 2.9Å; I79-Q81 VanDerWaalsContact C-N 3.32Å; I79-Q81 PolarHBondContact O-N 2.94Å; Q81-V83 VanDerWaalsContact C-N 3.28Å; Q81-V83 PolarHBondContact O-N 3.17Å; Q81-S84 WeakPolarHBondContact O-CB 3.49Å; Q81-S84 PolarHBondContact O-N 2.64Å; Q81-D85 VanDerWaalsContact O-CG 3.24Å; Q81-D85 PolarHBondContact O-N 3.43Å |
| 82 | L | 93.3 | Very high | 89 | Confident | 98 Ų | 98 | 108.5 Ų | 108.5 | 51% | 0.513 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -57.6 | -40.3 | 178 | -179.4 | 63.8 | 0 | 0 | 0 | 112.6 | K78 I79 D85 I86 | K78-L82 PolarHBondContact O-N 3.01Å; I79-L82 PolarHBondContact O-N 3.17Å; L82-D85 PolarHBondContact O-N 3.48Å; L82-I86 HydrophobicContact CD1-CD1 4.13Å; L82-I86 HydrophobicContact CD1-CG1 4.38Å; L82-I86 HydrophobicContact CG-CD1 3.91Å; L82-I86 WeakPolarHBondContact O-CD1 3.45Å; L82-I86 VanDerWaalsContact O-CG1 3.22Å; L82-I86 WeakPolarHBondContact O-CG1 3.38Å; L82-I86 PolarHBondContact O-N 3.37Å |
| 83 | V | 92.1 | Very high | 90 | Very high | 91 Ų | 91 | 106.8 Ų | 106.8 | 55% | 0.552 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -66.1 | -40 | 177.1 | 172.3 | 0 | 0 | 0 | 0 | 111.3 | I79 Q80 Q81 A87 | I79-V83 WeakPolarHBondContact O-CG2 3.32Å; I79-V83 PolarHBondContact O-N 3.24Å; Q80-V83 PolarHBondContact O-N 2.99Å; Q81-V83 VanDerWaalsContact C-N 3.28Å; Q81-V83 PolarHBondContact O-N 3.17Å; V83-A87 WeakPolarHBondContact O-CB 3.33Å; V83-A87 PolarHBondContact O-N 2.93Å |
| 84 | S | 92.3 | Very high | 90.9 | Very high | 76 Ų | 76 | 102 Ų | 102 | 53% | 0.531 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -62.7 | -43.9 | 174.7 | -172.3 | 0 | 0 | 0 | 0 | 111.6 | Q80 Q81 A87 S88 | Q80-S84 PolarHBondContact O-N 3.37Å; Q80-S84 VanDerWaalsContact O-N 3.07Å; Q81-S84 WeakPolarHBondContact O-CB 3.49Å; Q81-S84 PolarHBondContact O-N 2.64Å; S84-A87 PolarHBondContact O-N 3.48Å; S84-S88 PolarHBondContact O-N 3.36Å; S84-S88 VanDerWaalsContact O-N 3.14Å |
| 85 | D | 94 | Very high | 91.3 | Very high | 95 Ų | 95 | 95.5 Ų | 95.5 | 51% | 0.508 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.2 | -47.8 | 179.2 | -63.1 | -21.2 | 0 | 0 | 0 | 110.5 | Q81 L82 A87 S88 L89 | Q81-D85 VanDerWaalsContact O-CG 3.24Å; Q81-D85 PolarHBondContact O-N 3.43Å; L82-D85 PolarHBondContact O-N 3.48Å; D85-A87 VanDerWaalsContact C-N 3.32Å; D85-A87 PolarHBondContact O-N 3.27Å; D85-S88 PolarHBondContact O-N 3.02Å; D85-S88 VanDerWaalsContact O-N 3.16Å; D85-S88 PolarHBondContact O-OG 3.46Å; D85-L89 WeakPolarHBondContact O-CG 3.38Å; D85-L89 PolarHBondContact O-N 2.89Å |
| 86 | I | 92.9 | Very high | 91.8 | Very high | 75 Ų | 75 | 93.7 Ų | 93.7 | 39% | 0.385 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -60.8 | -40.4 | 176.5 | -65.9 | 164.6 | 0 | 0 | 0 | 111.6 | L82 S88 L89 L97 | L82-I86 HydrophobicContact CD1-CD1 4.13Å; L82-I86 HydrophobicContact CD1-CG1 4.38Å; L82-I86 HydrophobicContact CG-CD1 3.91Å; L82-I86 WeakPolarHBondContact O-CD1 3.45Å; L82-I86 VanDerWaalsContact O-CG1 3.22Å; L82-I86 WeakPolarHBondContact O-CG1 3.38Å; L82-I86 PolarHBondContact O-N 3.37Å; I86-S88 PolarHBondContact O-N 3.49Å; I86-L89 PolarHBondContact O-N 3.28Å; I86-L97 HydrophobicContact CG1-CD1 4.44Å |
| 87 | A | 91.9 | Very high | 91.9 | Very high | 83 Ų | 83 | 93.7 Ų | 93.7 | 69% | 0.686 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -68.2 | -22.9 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | V83 S84 D85 | V83-A87 WeakPolarHBondContact O-CB 3.33Å; V83-A87 PolarHBondContact O-N 2.93Å; S84-A87 PolarHBondContact O-N 3.48Å; D85-A87 VanDerWaalsContact C-N 3.32Å; D85-A87 PolarHBondContact O-N 3.27Å |
| 88 | S | 94.8 | Very high | 91.9 | Very high | 91 Ų | 91 | 93.3 Ų | 93.3 | 64% | 0.636 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -84.9 | -15.2 | 178.3 | 72.6 | 0 | 0 | 0 | 0 | 114.5 | S84 D85 I86 | S84-S88 PolarHBondContact O-N 3.36Å; S84-S88 VanDerWaalsContact O-N 3.14Å; D85-S88 PolarHBondContact O-N 3.02Å; D85-S88 VanDerWaalsContact O-N 3.16Å; D85-S88 PolarHBondContact O-OG 3.46Å; I86-S88 PolarHBondContact O-N 3.49Å |
| 89 | L | 93.9 | Very high | 91.9 | Very high | 58 Ų | 58 | 90.2 Ų | 90.2 | 30% | 0.304 | 50% | 0.501 | S | S | . | . | S | Bend | trans | -75 | 149.8 | -178.3 | -67.2 | 176.2 | 0 | 0 | 0 | 111.8 | D85 I86 E93 V94 L97 | D85-L89 WeakPolarHBondContact O-CG 3.38Å; D85-L89 PolarHBondContact O-N 2.89Å; I86-L89 PolarHBondContact O-N 3.28Å; L89-E93 HydrophobicContact CB-CB 4.09Å; L89-E93 HydrophobicContact CD2-CB 4Å; L89-E93 HydrophobicContact CG-CB 4.43Å; L89-V94 HydrophobicContact CB-CG2 3.95Å; L89-L97 HydrophobicContact CD1-CD1 3.6Å |
| 90 | T | 93.1 | Very high | 91.8 | Very high | 79 Ų | 79 | 91.4 Ų | 91.4 | 49% | 0.485 | 51% | 0.508 | S | S | . | . | trans | -79.2 | 161.5 | 171 | 64.8 | 0 | 0 | 0 | 0 | 111.4 | L92 E93 V94 | T90-L92 PolarHBondContact O-N 2.83Å; T90-L92 VanDerWaalsContact O-N 3.12Å; T90-E93 WeakPolarHBondContact CB-OE2 3.41Å; T90-E93 WeakPolarHBondContact CG2-OE2 3.25Å; T90-E93 PolarHBondContact N-OE2 3.3Å; T90-E93 PolarHBondContact O-N 2.97Å; T90-E93 WeakPolarHBondContact OG1-CG 3.47Å; T90-E93 PolarHBondContact OG1-OE2 3Å; T90-V94 WeakPolarHBondContact O-CG2 3.25Å; T90-V94 PolarHBondContact O-N 2.75Å | ||
| 91 | L | 90.6 | Very high | 91.7 | Very high | 160 Ų | 160 | 90 Ų | 90 | 84% | 0.838 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -56.3 | -31.9 | -178.7 | -68.7 | 176.8 | 0 | 0 | 0 | 113.6 | S95 | L91-S95 PolarHBondContact O-N 3.45Å; L91-S95 PolarHBondContact O-OG 2.83Å |
| 92 | L | 88.5 | Confident | 91.3 | Very high | 135 Ų | 135 | 88 Ų | 88 | 71% | 0.707 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -71.8 | -41.4 | 177 | -65.6 | 175.9 | 0 | 0 | 0 | 111.8 | T90 V94 S95 D96 | T90-L92 PolarHBondContact O-N 2.83Å; T90-L92 VanDerWaalsContact O-N 3.12Å; L92-V94 VanDerWaalsContact C-N 3.28Å; L92-V94 PolarHBondContact O-N 2.96Å; L92-S95 WeakPolarHBondContact CA-OG 3.42Å; L92-S95 PolarHBondContact O-N 3.12Å; L92-S95 PolarHBondContact O-OG 2.87Å; L92-D96 PolarHBondContact O-N 2.82Å |
| 93 | E | 90.3 | Very high | 91 | Very high | 88 Ų | 88 | 89.6 Ų | 89.6 | 41% | 0.411 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -69.4 | -29.6 | 177 | -66.2 | 166.1 | 124.8 | 0 | 0 | 111.7 | L89 T90 D96 L97 | L89-E93 HydrophobicContact CB-CB 4.09Å; L89-E93 HydrophobicContact CD2-CB 4Å; L89-E93 HydrophobicContact CG-CB 4.43Å; T90-E93 WeakPolarHBondContact CB-OE2 3.41Å; T90-E93 WeakPolarHBondContact CG2-OE2 3.25Å; T90-E93 PolarHBondContact N-OE2 3.3Å; T90-E93 PolarHBondContact O-N 2.97Å; T90-E93 WeakPolarHBondContact OG1-CG 3.47Å; T90-E93 PolarHBondContact OG1-OE2 3Å; E93-D96 PolarHBondContact O-N 3.38Å; E93-L97 VanDerWaalsContact O-CB 3.32Å; E93-L97 WeakPolarHBondContact O-CB 3.37Å; E93-L97 PolarHBondContact O-N 3.19Å |
| 94 | V | 92.2 | Very high | 90.6 | Very high | 58 Ų | 58 | 90.1 Ų | 90.1 | 35% | 0.352 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.6 | -37.6 | 173.2 | 175.1 | 0 | 0 | 0 | 0 | 111.4 | L89 T90 L92 N98 | L89-V94 HydrophobicContact CB-CG2 3.95Å; T90-V94 WeakPolarHBondContact O-CG2 3.25Å; T90-V94 PolarHBondContact O-N 2.75Å; L92-V94 VanDerWaalsContact C-N 3.28Å; L92-V94 PolarHBondContact O-N 2.96Å; V94-N98 WeakPolarHBondContact O-CB 3.46Å; V94-N98 PolarHBondContact O-N 3.45Å |
| 95 | S | 88.6 | Confident | 90 | Very high | 57 Ų | 57 | 91.6 Ų | 91.6 | 40% | 0.399 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.1 | -43.5 | 172.2 | 37.1 | 0 | 0 | 0 | 0 | 112.1 | L91 L92 L97 N98 E99 | L91-S95 PolarHBondContact O-N 3.45Å; L91-S95 PolarHBondContact O-OG 2.83Å; L92-S95 WeakPolarHBondContact CA-OG 3.42Å; L92-S95 PolarHBondContact O-N 3.12Å; L92-S95 PolarHBondContact O-OG 2.87Å; S95-L97 PolarHBondContact O-N 2.7Å; S95-N98 WeakPolarHBondContact O-CB 3.37Å; S95-N98 PolarHBondContact O-N 2.98Å; S95-E99 PolarHBondContact O-N 3.04Å |
| 96 | D | 93.3 | Very high | 88.6 | Confident | 91 Ų | 91 | 93.1 Ų | 93.1 | 49% | 0.487 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64 | -41.3 | 177.7 | -66.9 | -18.5 | 0 | 0 | 0 | 111.7 | L92 E93 N98 E99 L100 | L92-D96 PolarHBondContact O-N 2.82Å; E93-D96 PolarHBondContact O-N 3.38Å; D96-N98 VanDerWaalsContact C-N 3.32Å; D96-N98 PolarHBondContact O-N 2.98Å; D96-E99 PolarHBondContact O-N 2.92Å; D96-L100 WeakPolarHBondContact O-CG 3.08Å; D96-L100 PolarHBondContact O-N 3.12Å |
| 97 | L | 93.2 | Very high | 87 | Confident | 56 Ų | 56 | 94 Ų | 94 | 29% | 0.293 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -59.6 | -43.8 | 173.5 | -177.2 | 156.8 | 0 | 0 | 0 | 110.9 | I86 L89 E93 S95 E99 L100 L101 | I86-L97 HydrophobicContact CG1-CD1 4.44Å; L89-L97 HydrophobicContact CD1-CD1 3.6Å; E93-L97 VanDerWaalsContact O-CB 3.32Å; E93-L97 WeakPolarHBondContact O-CB 3.37Å; E93-L97 PolarHBondContact O-N 3.19Å; S95-L97 PolarHBondContact O-N 2.7Å; L97-E99 PolarHBondContact O-N 2.87Å; L97-L100 PolarHBondContact O-N 3.41Å; L97-L101 HydrophobicContact CD2-CD1 3.44Å; L97-L101 VanDerWaalsContact CD2-CD1 3.44Å; L97-L101 HydrophobicContact CD2-CG 3.91Å; L97-L101 WeakPolarHBondContact O-CG 3.43Å; L97-L101 PolarHBondContact O-N 3.21Å |
| 98 | N | 89.5 | Confident | 85.2 | Confident | 82 Ų | 82 | 95.5 Ų | 95.5 | 44% | 0.439 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.3 | -44.7 | 177 | -166.6 | -59.4 | 0 | 0 | 0 | 111.4 | V94 S95 D96 L100 L101 K102 | V94-N98 WeakPolarHBondContact O-CB 3.46Å; V94-N98 PolarHBondContact O-N 3.45Å; S95-N98 WeakPolarHBondContact O-CB 3.37Å; S95-N98 PolarHBondContact O-N 2.98Å; D96-N98 VanDerWaalsContact C-N 3.32Å; D96-N98 PolarHBondContact O-N 2.98Å; N98-L100 PolarHBondContact O-N 3.32Å; N98-L101 PolarHBondContact O-N 3.3Å; N98-K102 WeakPolarHBondContact O-CG 3.02Å; N98-K102 PolarHBondContact O-N 2.81Å; N98-K102 WeakPolarHBondContact OD1-CE 3.32Å |
| 99 | E | 89.9 | Confident | 83.2 | Confident | 99 Ų | 99 | 94 Ų | 94 | 46% | 0.463 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.4 | -43.1 | 174.8 | -69 | -166.1 | -179.3 | 0 | 0 | 113.1 | S95 D96 L97 K102 K103 | S95-E99 PolarHBondContact O-N 3.04Å; D96-E99 PolarHBondContact O-N 2.92Å; L97-E99 PolarHBondContact O-N 2.87Å; E99-K102 WeakPolarHBondContact O-CB 3.48Å; E99-K102 PolarHBondContact O-N 3.46Å; E99-K103 WeakPolarHBondContact O-CG 3.4Å; E99-K103 PolarHBondContact O-N 3.49Å; E99-K103 IonicContact OE2-NZ 3.41Å; E99-K103 PolarHBondContact OE2-NZ 3.09Å; E99-K103 VanDerWaalsContact OE2-NZ 3.09Å |
| 100 | L | 89.9 | Confident | 81.1 | Confident | 102 Ų | 102 | 97.5 Ų | 97.5 | 53% | 0.534 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66 | -38.4 | 178.5 | -73.7 | 176.5 | 0 | 0 | 0 | 111.9 | D96 L97 N98 K103 T104 | D96-L100 WeakPolarHBondContact O-CG 3.08Å; D96-L100 PolarHBondContact O-N 3.12Å; L97-L100 PolarHBondContact O-N 3.41Å; N98-L100 PolarHBondContact O-N 3.32Å; L100-K103 PolarHBondContact O-N 3.08Å; L100-T104 VanDerWaalsContact O-CB 3.25Å; L100-T104 WeakPolarHBondContact O-CB 3.37Å; L100-T104 PolarHBondContact O-N 2.92Å; L100-T104 PolarHBondContact O-OG1 2.95Å |
| 101 | L | 89.1 | Confident | 79.3 | Confident | 88 Ų | 88 | 96.5 Ų | 96.5 | 46% | 0.461 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.2 | -42.7 | 173.5 | -72.7 | -178.1 | 0 | 0 | 0 | 111.4 | L97 N98 L105 | L97-L101 HydrophobicContact CD2-CD1 3.44Å; L97-L101 VanDerWaalsContact CD2-CD1 3.44Å; L97-L101 HydrophobicContact CD2-CG 3.91Å; L97-L101 WeakPolarHBondContact O-CG 3.43Å; L97-L101 PolarHBondContact O-N 3.21Å; N98-L101 PolarHBondContact O-N 3.3Å; L101-L105 HydrophobicContact CB-CD1 4.5Å; L101-L105 HydrophobicContact CD2-CD1 4.34Å; L101-L105 VanDerWaalsContact O-CB 3.25Å; L101-L105 WeakPolarHBondContact O-CB 3.46Å; L101-L105 WeakPolarHBondContact O-CG 3.31Å; L101-L105 PolarHBondContact O-N 3.28Å |
| 102 | K | 84.8 | Confident | 77.3 | Confident | 85 Ų | 85 | 95.9 Ų | 95.9 | 37% | 0.37 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -59.1 | -47.3 | 174.6 | -71.6 | 179.3 | 178.1 | -165.8 | 0 | 112 | N98 E99 I107 D109 | N98-K102 WeakPolarHBondContact O-CG 3.02Å; N98-K102 PolarHBondContact O-N 2.81Å; N98-K102 WeakPolarHBondContact OD1-CE 3.32Å; E99-K102 WeakPolarHBondContact O-CB 3.48Å; E99-K102 PolarHBondContact O-N 3.46Å; K102-I107 PolarHBondContact O-N 3.07Å; K102-D109 IonicContact NZ-OD2 2.83Å; K102-D109 PolarHBondContact NZ-OD2 2.65Å |
| 103 | K | 87.3 | Confident | 75 | Confident | 132 Ų | 132 | 94.4 Ų | 94.4 | 57% | 0.574 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -65.2 | -45.5 | 179.3 | -70.7 | 164.9 | -175.5 | 155.7 | 0 | 112.4 | E99 L100 | E99-K103 WeakPolarHBondContact O-CG 3.4Å; E99-K103 PolarHBondContact O-N 3.49Å; E99-K103 IonicContact OE2-NZ 3.41Å; E99-K103 PolarHBondContact OE2-NZ 3.09Å; E99-K103 VanDerWaalsContact OE2-NZ 3.09Å; L100-K103 PolarHBondContact O-N 3.08Å |
| 104 | T | 83.1 | Confident | 73 | Confident | 103 Ų | 103 | 95.5 Ų | 95.5 | 63% | 0.632 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -76.5 | -39.3 | -173.4 | -54.1 | 0 | 0 | 0 | 0 | 112.7 | L100 N106 | L100-T104 VanDerWaalsContact O-CB 3.25Å; L100-T104 WeakPolarHBondContact O-CB 3.37Å; L100-T104 PolarHBondContact O-N 2.92Å; L100-T104 PolarHBondContact O-OG1 2.95Å; T104-N106 PolarHBondContact O-N 2.88Å |
| 105 | L | 78.5 | Confident | 70.9 | Confident | 106 Ų | 106 | 101.8 Ų | 101.8 | 56% | 0.555 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83.4 | 3.5 | -178.1 | -62.8 | 174.8 | 0 | 0 | 0 | 112.5 | L101 I107 | L101-L105 HydrophobicContact CB-CD1 4.5Å; L101-L105 HydrophobicContact CD2-CD1 4.34Å; L101-L105 VanDerWaalsContact O-CB 3.25Å; L101-L105 WeakPolarHBondContact O-CB 3.46Å; L101-L105 WeakPolarHBondContact O-CG 3.31Å; L101-L105 PolarHBondContact O-N 3.28Å; L105-I107 HydrophobicContact CB-CD1 3.69Å; L105-I107 HydrophobicContact CB-CG1 3.64Å; L105-I107 HydrophobicContact CD1-CD1 3.8Å; L105-I107 HydrophobicContact CG-CD1 4.41Å; L105-I107 PolarHBondContact O-N 3.45Å |
| 106 | N | 64.9 | Low | 68.7 | Low | 128 Ų | 128 | 102.4 Ų | 102.4 | 68% | 0.684 | 56% | 0.563 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 43.8 | 30 | -169.1 | -79.9 | 95 | 0 | 0 | 0 | 112 | T104 Q108 | T104-N106 PolarHBondContact O-N 2.88Å; N106-Q108 PolarHBondContact O-N 3.39Å |
| 107 | I | 60.5 | Low | 66.4 | Low | 94 Ų | 94 | 102.6 Ų | 102.6 | 48% | 0.482 | 58% | 0.578 | S | S | . | * | trans | -78.7 | 65.5 | 163 | -49.8 | 169.8 | 0 | 0 | 0 | 103.9 | K102 L105 D109 | K102-I107 PolarHBondContact O-N 3.07Å; L105-I107 HydrophobicContact CB-CD1 3.69Å; L105-I107 HydrophobicContact CB-CG1 3.64Å; L105-I107 HydrophobicContact CD1-CD1 3.8Å; L105-I107 HydrophobicContact CG-CD1 4.41Å; L105-I107 PolarHBondContact O-N 3.45Å; I107-D109 PolarHBondContact O-N 3.03Å | ||
| 108 | Q | 52.4 | Low | 64.1 | Low | 114 Ų | 114 | 109.1 Ų | 109.1 | 53% | 0.533 | 61% | 0.609 | S | S | . | * | trans | -32.8 | 112.3 | 145.4 | -83 | -56.9 | 80.2 | 0 | 0 | 106.3 | N106 V110 M113 | N106-Q108 PolarHBondContact O-N 3.39Å; Q108-V110 VanDerWaalsContact C-N 3.32Å; Q108-V110 PolarHBondContact O-N 2.9Å; Q108-M113 HydrophobicContact CB-CE 3.32Å; Q108-M113 HydrophobicContact CG-CE 3.6Å; Q108-M113 VanDerWaalsContact NE2-CE 3.32Å | ||
| 109 | D | 52.7 | Low | 61.7 | Low | 59 Ų | 59 | 108.9 Ų | 108.9 | 32% | 0.316 | 63% | 0.626 | S | S | . | * | trans | -47.7 | 104.1 | 176.4 | -157.7 | -65.1 | 0 | 0 | 0 | 106.7 | K102 I107 G111 M112 | K102-D109 IonicContact NZ-OD2 2.83Å; K102-D109 PolarHBondContact NZ-OD2 2.65Å; I107-D109 PolarHBondContact O-N 3.03Å; D109-G111 PolarHBondContact O-N 3.43Å; D109-G111 WeakPolarHBondContact OD1-CA 3.43Å; D109-G111 PolarHBondContact OD1-N 3.45Å; D109-M112 HydrophobicContact CB-CB 4.31Å; D109-M112 PolarHBondContact O-N 3.38Å; D109-M112 PolarHBondContact OD1-N 3.04Å | ||
| 110 | V | 50.5 | Low | 59.3 | Low | 131 Ų | 131 | 108.6 Ų | 108.6 | 79% | 0.794 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.9 | 3.6 | 175.8 | -123.9 | 0 | 0 | 0 | 0 | 110.1 | Q108 | Q108-V110 VanDerWaalsContact C-N 3.32Å; Q108-V110 PolarHBondContact O-N 2.9Å |
| 111 | G | 54.8 | Low | 56.8 | Low | 59 Ų | 59 | 109.2 Ų | 109.2 | 61% | 0.608 | 65% | 0.653 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.1 | 5 | 167.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | D109 | D109-G111 PolarHBondContact O-N 3.43Å; D109-G111 WeakPolarHBondContact OD1-CA 3.43Å; D109-G111 PolarHBondContact OD1-N 3.45Å |
| 112 | M | 49.1 | Very low | 54.6 | Low | 147 Ų | 147 | 109.5 Ų | 109.5 | 72% | 0.724 | 67% | 0.669 | S | S | * | * | trans | -152.7 | 71.6 | 171.9 | -159.9 | 63.4 | 171 | 0 | 0 | 112.9 | D109 P114 | D109-M112 HydrophobicContact CB-CB 4.31Å; D109-M112 PolarHBondContact O-N 3.38Å; D109-M112 PolarHBondContact OD1-N 3.04Å; M112-P114 WeakPolarHBondContact O-CD 3.46Å | ||
| 113 | M | 40.9 | Very low | 52.1 | Low | 104 Ų | 104 | 112.3 Ų | 112.3 | 51% | 0.512 | 69% | 0.693 | S | S | . | * | trans | -91 | 116.8 | 159.1 | -71.5 | -72.1 | 172.6 | 0 | 0 | 109.4 | Q108 M115 | Q108-M113 HydrophobicContact CB-CE 3.32Å; Q108-M113 HydrophobicContact CG-CE 3.6Å; Q108-M113 VanDerWaalsContact NE2-CE 3.32Å; M113-M115 PolarHBondContact O-N 3.18Å | ||
| 114 | P | 48.6 | Very low | 50.6 | Low | 111 Ų | 111 | 112 Ų | 112 | 72% | 0.721 | 70% | 0.704 | S | S | * | * | trans | -73 | 84 | 159.6 | 30.8 | -28.3 | 0 | 0 | 0 | 107.4 | M112 G116 | M112-P114 WeakPolarHBondContact O-CD 3.46Å; P114-G116 VanDerWaalsContact C-N 3.32Å; P114-G116 PolarHBondContact O-N 3.43Å | ||
| 115 | M | 47.3 | Very low | 48.2 | Very low | 189 Ų | 189 | 112 Ų | 112 | 93% | 0.931 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | 91.7 | 170 | -145.1 | -71.6 | -174.3 | 0 | 0 | 107.1 | M113 | M113-M115 PolarHBondContact O-N 3.18Š|
| 116 | G | 43.2 | Very low | 46 | Very low | 70 Ų | 70 | 110.6 Ų | 110.6 | 72% | 0.722 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 177.5 | -13.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | P114 M118 | P114-G116 VanDerWaalsContact C-N 3.32Å; P114-G116 PolarHBondContact O-N 3.43Å; G116-M118 PolarHBondContact O-N 3.47Å |
| 117 | A | 44.5 | Very low | 44.5 | Very low | 95 Ų | 95 | 113.8 Ų | 113.8 | 79% | 0.785 | 73% | 0.729 | S | S | * | * | trans | -90.7 | 68.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 118 | M | 44.7 | Very low | 43.2 | Very low | 193 Ų | 193 | 113.7 Ų | 113.7 | 95% | 0.951 | 74% | 0.742 | S | S | * | * | trans | -163.4 | 97.8 | 154.8 | -102.8 | -59.6 | 169.2 | 0 | 0 | 108.8 | G116 | G116-M118 PolarHBondContact O-N 3.47Š| ||
| 119 | G | 39.8 | Very low | 42.3 | Very low | 77 Ų | 77 | 112.4 Ų | 112.4 | 79% | 0.794 | 75% | 0.751 | S | S | * | * | trans | -176.1 | 101 | 177.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 120 | A | 38.5 | Very low | 41.5 | Very low | 93 Ų | 93 | 118.1 Ų | 118.1 | 77% | 0.769 | 78% | 0.776 | S | S | * | * | trans | -67.5 | 154.4 | -165.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 121 | S | 38.5 | Very low | 40.8 | Very low | 115 Ų | 115 | 120.3 Ų | 120.3 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | trans | 66 | 110.1 | 139.6 | -66.8 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 122 | A | 41.2 | Very low | 39.8 | Very low | 95 Ų | 95 | 125.7 Ų | 125.7 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | 58.5 | 100.3 | 124.3 | 0 | 0 | 0 | 0 | 0 | 119.8 | |||||
| 123 | V | 33.7 | Very low | 39.7 | Very low | 144 Ų | 144 | 127.6 Ų | 127.6 | 87% | 0.873 | 79% | 0.794 | S | S | * | * | trans | -162.1 | 132.2 | 132.7 | -107.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 124 | P | 55.3 | Low | 39.5 | Very low | 124 Ų | 124 | 127 Ų | 127 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | trans | -91.8 | 166.2 | 171.2 | 35.9 | -28.8 | 0 | 0 | 0 | 111.4 | ||||
| 125 | A | 33.3 | Very low | 39.3 | Very low | 104 Ų | 104 | 127.9 Ų | 127.9 | 86% | 0.86 | 81% | 0.811 | S | S | * | * | trans | 93.2 | 136.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 126 | A | 32.6 | Very low | 38.8 | Very low | 77 Ų | 77 | 124.8 Ų | 124.8 | 64% | 0.636 | 80% | 0.802 | S | S | * | * | cis | -173.8 | 152.2 | -8.5 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 127 | Q | 31.8 | Very low | 38.9 | Very low | 195 Ų | 195 | 130.6 Ų | 130.6 | 91% | 0.911 | 81% | 0.808 | S | S | * | * | trans | 65.9 | 146.4 | 158.1 | -64.9 | 164.7 | -29.8 | 0 | 0 | 117.3 | ||||
| 128 | A | 33.4 | Very low | 38.8 | Very low | 91 Ų | 91 | 132.9 Ų | 132.9 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | cis | 179.7 | 156.5 | -14.6 | 0 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 129 | A | 33.8 | Very low | 38.9 | Very low | 87 Ų | 87 | 130.5 Ų | 130.5 | 72% | 0.719 | 79% | 0.792 | S | S | * | * | trans | 75 | 112.8 | 171.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 130 | E | 35.6 | Very low | 39.3 | Very low | 180 Ų | 180 | 132.8 Ų | 132.8 | 84% | 0.841 | 78% | 0.78 | S | S | * | * | 55.8 | 123.3 | 81.9 | -80.1 | 170.7 | 160.7 | 0 | 0 | 110.6 | |||||
| 131 | E | 36.8 | Very low | 40 | Very low | 177 Ų | 177 | 132.7 Ų | 132.7 | 83% | 0.827 | 77% | 0.77 | S | S | * | * | cis | -171.2 | 178.1 | 14.9 | -151.5 | 165 | -172.5 | 0 | 0 | 106 | ||||
| 132 | E | 33.5 | Very low | 40.8 | Very low | 172 Ų | 172 | 131.7 Ų | 131.7 | 80% | 0.804 | 75% | 0.753 | S | S | * | * | trans | 83.3 | 95 | 172.2 | -76.2 | -170.8 | 134.5 | 0 | 0 | 120.3 | ||||
| 133 | E | 45.7 | Very low | 42 | Very low | 187 Ų | 187 | 129.3 Ų | 129.3 | 87% | 0.874 | 73% | 0.725 | S | S | * | * | 32 | 100.6 | 119.2 | -67.4 | -176.7 | 149.8 | 0 | 0 | 119.1 | |||||
| 134 | A | 38.8 | Very low | 43.9 | Very low | 91 Ų | 91 | 123.7 Ų | 123.7 | 75% | 0.752 | 69% | 0.691 | S | S | * | * | trans | -156.1 | 108.4 | 135.9 | 0 | 0 | 0 | 0 | 0 | 108.4 | V136 | A134-V136 PolarHBondContact O-N 3.43Š| ||
| 135 | P | 43 | Very low | 45.1 | Very low | 129 Ų | 129 | 117.8 Ų | 117.8 | 84% | 0.838 | 65% | 0.652 | S | S | * | * | trans | -64.3 | 124.6 | -168.6 | 25.5 | -32.3 | 0 | 0 | 0 | 110.2 | K137 | P135-K137 PolarHBondContact O-N 3.16Å; P135-K137 VanDerWaalsContact O-N 3.07Å | ||
| 136 | V | 37.5 | Very low | 47.2 | Very low | 124 Ų | 124 | 115.4 Ų | 115.4 | 75% | 0.752 | 62% | 0.623 | S | S | * | * | trans | -40.8 | 115.1 | 166 | 175.9 | 0 | 0 | 0 | 0 | 108.5 | A134 I138 | A134-V136 PolarHBondContact O-N 3.43Å; V136-I138 HydrophobicContact CG1-CG1 4.46Å; V136-I138 PolarHBondContact O-N 2.88Å | ||
| 137 | K | 44.5 | Very low | 49.3 | Very low | 192 Ų | 192 | 111.7 Ų | 111.7 | 84% | 0.835 | 59% | 0.592 | S | S | * | * | trans | -58.5 | 83.6 | 171.5 | -158.2 | 175.1 | -170.3 | 176.8 | 0 | 107.7 | P135 E139 | P135-K137 PolarHBondContact O-N 3.16Å; P135-K137 VanDerWaalsContact O-N 3.07Å; K137-E139 VanDerWaalsContact C-N 3.31Å; K137-E139 PolarHBondContact O-N 2.83Å | ||
| 138 | I | 43 | Very low | 51.3 | Low | 144 Ų | 144 | 104.9 Ų | 104.9 | 74% | 0.738 | 56% | 0.564 | S | S | * | * | trans | -67.6 | 99.9 | 169.6 | -62 | -166 | 0 | 0 | 0 | 105.3 | V136 K140 | V136-I138 HydrophobicContact CG1-CG1 4.46Å; V136-I138 PolarHBondContact O-N 2.88Å; I138-K140 VanDerWaalsContact C-N 3.28Å; I138-K140 PolarHBondContact O-N 3.35Å | ||
| 139 | E | 46.6 | Very low | 53.2 | Low | 143 Ų | 143 | 106.5 Ų | 106.5 | 67% | 0.668 | 56% | 0.556 | S | S | * | * | trans | -56.8 | 93.2 | 171.5 | -61.7 | -174 | 123.9 | 0 | 0 | 108.5 | K137 T141 | K137-E139 VanDerWaalsContact C-N 3.31Å; K137-E139 PolarHBondContact O-N 2.83Å; E139-T141 PolarHBondContact O-N 3.44Å | ||
| 140 | K | 47.7 | Very low | 55.3 | Low | 124 Ų | 124 | 104.8 Ų | 104.8 | 54% | 0.539 | 54% | 0.535 | S | S | . | . | trans | -56.7 | 108.2 | 165.6 | -78.7 | 177.5 | 166.5 | -175.7 | 0 | 107.3 | I138 F143 E211 | I138-K140 VanDerWaalsContact C-N 3.28Å; I138-K140 PolarHBondContact O-N 3.35Å; K140-F143 WeakPolarHBondContact O-CE2 3.47Å; K140-F143 WeakPolarHBondContact O-CZ 3.27Å; K140-E211 PolarHBondContact NZ-OXT 3.19Å | ||
| 141 | T | 54.2 | Low | 57.3 | Low | 92 Ų | 92 | 103 Ų | 103 | 56% | 0.564 | 52% | 0.524 | S | S | * | . | trans | -85.8 | 9 | 169.5 | 47.6 | 0 | 0 | 0 | 0 | 111.8 | E139 | E139-T141 PolarHBondContact O-N 3.44Š| ||
| 142 | Q | 54.4 | Low | 59 | Low | 93 Ų | 93 | 98.3 Ų | 98.3 | 44% | 0.435 | 52% | 0.515 | S | S | . | . | trans | -129.2 | 107.2 | -176.3 | -69.4 | 163.5 | 75.3 | 0 | 0 | 108.1 | N188 | Q142-N188 HydrophobicContact CB-CB 4.43Å; Q142-N188 HydrophobicContact CG-CB 4.34Å; Q142-N188 PolarHBondContact OE1-OD1 3.35Å | ||
| 143 | F | 67.2 | Low | 61.1 | Low | 46 Ų | 46 | 94.9 Ų | 94.9 | 20% | 0.202 | 52% | 0.517 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.8 | 136.4 | 177 | -67.4 | -93.4 | 0 | 0 | 0 | 109.3 | K140 N188 V189 K191 A194 L210 E211 | K140-F143 WeakPolarHBondContact O-CE2 3.47Å; K140-F143 WeakPolarHBondContact O-CZ 3.27Å; F143-N188 PolarHBondContact O-N 3.46Å; F143-V189 HydrophobicContact CB-CG2 4.47Å; F143-V189 PolarHBondContact N-O 3.35Å; F143-V189 WeakPolarHBondContact O-CG2 3.31Å; F143-V189 PolarHBondContact O-N 3.28Å; F143-K191 HydrophobicContact CD2-CG 3.75Å; F143-K191 HydrophobicContact CE2-CB 4.29Å; F143-K191 HydrophobicContact CE2-CD 3.9Å; F143-K191 VanDerWaalsContact CE2-CE 3.49Å; F143-K191 HydrophobicContact CE2-CG 3.09Å; F143-K191 HydrophobicContact CZ-CD 4.24Å; F143-K191 HydrophobicContact CZ-CG 3.76Å; F143-A194 HydrophobicContact CB-CB 3.75Å; F143-A194 HydrophobicContact CG-CB 4.24Å; F143-L210 HydrophobicContact CD1-CB 4.24Å; F143-E211 CarbonylContact C-O 3.57Å; F143-E211 WeakPolarHBondContact CA-O 3.35Å |
| 144 | T | 73.6 | Confident | 62.8 | Low | 25 Ų | 25 | 88.2 Ų | 88.2 | 15% | 0.153 | 49% | 0.486 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101 | 122.2 | 172 | -62.8 | 0 | 0 | 0 | 0 | 108.7 | K146 E184 A187 E211 | T144-K146 HydrophobicContact CG2-CG 4.24Å; T144-K146 PolarHBondContact O-N 3.38Å; T144-E184 HydrophobicContact CG2-CB 4.28Å; T144-E184 HydrophobicContact CG2-CG 3.71Å; T144-A187 HydrophobicContact CG2-CB 4.39Å; T144-E211 PolarHBondContact N-O 3.26Å; T144-E211 PolarHBondContact O-N 3.25Å; T144-E211 VanDerWaalsContact O-N 3.11Å |
| 145 | V | 79.3 | Confident | 64.8 | Low | 0 Ų | 0 | 87 Ų | 87 | 0% | 0 | 46% | 0.463 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.1 | 101.1 | -178.8 | -176.9 | 0 | 0 | 0 | 0 | 108.1 | I185 R186 V189 A194 L197 L201 V208 L210 | V145-I185 PolarHBondContact O-N 3.02Å; V145-R186 PolarHBondContact N-O 3.12Å; V145-V189 HydrophobicContact CG2-CG2 3.57Å; V145-A194 HydrophobicContact CG2-CB 4.43Å; V145-L197 HydrophobicContact CG2-CD1 4.4Å; V145-L201 HydrophobicContact CG1-CD1 4.02Å; V145-V208 HydrophobicContact CB-CG1 4.5Å; V145-V208 HydrophobicContact CG1-CG1 3.35Å; V145-L210 HydrophobicContact CG2-CD2 3.86Å |
| 146 | K | 77.5 | Confident | 66.8 | Low | 54 Ų | 54 | 85.6 Ų | 85.6 | 24% | 0.235 | 45% | 0.452 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 128.9 | 177.2 | -77.8 | 177.8 | 178.7 | 172.5 | 0 | 111.1 | T144 E184 V208 V209 E211 | T144-K146 HydrophobicContact CG2-CG 4.24Å; T144-K146 PolarHBondContact O-N 3.38Å; K146-E184 HydrophobicContact CD-CG 4.13Å; K146-E184 VanDerWaalsContact CE-CG 3.42Å; K146-E184 WeakPolarHBondContact CE-OE1 3.4Å; K146-E184 HydrophobicContact CG-CG 3.58Å; K146-E184 IonicContact NZ-OE1 2.67Å; K146-E184 PolarHBondContact NZ-OE1 3.21Å; K146-V208 CarbonylContact O-C 3.57Å; K146-V208 VanDerWaalsContact O-CA 3.31Å; K146-V208 WeakPolarHBondContact O-CA 3.21Å; K146-V209 PolarHBondContact N-O 3Å; K146-V209 PolarHBondContact O-N 3.48Å; K146-E211 WeakPolarHBondContact CD-OE2 3.13Å; K146-E211 WeakPolarHBondContact CE-OE2 3.46Å; K146-E211 IonicContact NZ-OE2 3.09Å; K146-E211 PolarHBondContact NZ-OE2 3.25Å |
| 147 | L | 77.7 | Confident | 69.2 | Low | 0 Ų | 0 | 85.3 Ų | 85.3 | 0% | 0 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 120.5 | 169.8 | -168.6 | 74.1 | 0 | 0 | 0 | 108.1 | L158 L181 Q183 I185 V208 | L147-L158 HydrophobicContact CD1-CD2 4.37Å; L147-L158 HydrophobicContact CD2-CD2 3.73Å; L147-L181 HydrophobicContact CB-CD2 4Å; L147-L181 HydrophobicContact CD2-CD2 3.63Å; L147-L181 HydrophobicContact CG-CD2 3.68Å; L147-L181 WeakPolarHBondContact O-CD2 3.33Å; L147-Q183 PolarHBondContact N-O 3.39Å; L147-Q183 PolarHBondContact O-N 3.33Å; L147-I185 HydrophobicContact CB-CD1 4.05Å; L147-I185 HydrophobicContact CB-CG1 3.8Å; L147-I185 HydrophobicContact CD2-CD1 4.25Å; L147-V208 HydrophobicContact CD1-CG2 3.79Å |
| 148 | T | 73.1 | Confident | 71 | Confident | 51 Ų | 51 | 76.2 Ų | 76.2 | 31% | 0.313 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.1 | -37.1 | -173.5 | 48.2 | 0 | 0 | 0 | 0 | 112.8 | L181 T207 V209 | T148-L181 WeakPolarHBondContact O-CD1 3.4Å; T148-T207 PolarHBondContact N-O 2.98Å; T148-T207 PolarHBondContact OG1-O 3.18Å; T148-V209 HydrophobicContact CG2-CB 4.14Å; T148-V209 HydrophobicContact CG2-CG2 3.65Å |
| 149 | E | 73.7 | Confident | 73.2 | Confident | 125 Ų | 125 | 70.3 Ų | 70.3 | 58% | 0.584 | 37% | 0.371 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -138.3 | 151.3 | 178.5 | -56.3 | -177.6 | 153.6 | 0 | 0 | 110.9 | G206 T207 | E149-G206 CarbonylContact O-C 3.52Å; E149-G206 WeakPolarHBondContact O-CA 3.45Å; E149-T207 PolarHBondContact O-N 3.2Å |
| 150 | L | 77.3 | Confident | 75 | Confident | 52 Ų | 52 | 69.6 Ų | 69.6 | 27% | 0.272 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.2 | 132.9 | 179.3 | 79.2 | 175.4 | 0 | 0 | 0 | 110.4 | A152 K155 V178 L181 | L150-A152 PolarHBondContact O-N 3.12Å; L150-K155 HydrophobicContact CD1-CD 4.33Å; L150-K155 HydrophobicContact CD1-CG 4.12Å; L150-V178 HydrophobicContact CD1-CG1 3.71Å; L150-V178 VanDerWaalsContact CD1-O 3.31Å; L150-V178 WeakPolarHBondContact CD1-O 3.4Å; L150-L181 HydrophobicContact CB-CD1 4.03Å; L150-L181 HydrophobicContact CD1-CD1 4.44Å; L150-L181 HydrophobicContact CD2-CD1 3.17Å; L150-L181 HydrophobicContact CD2-CG 4.13Å; L150-L181 HydrophobicContact CG-CD1 4.01Å |
| 151 | K | 79.4 | Confident | 76.8 | Confident | 142 Ų | 142 | 66.9 Ų | 66.9 | 62% | 0.617 | 36% | 0.355 | S | S | * | . | trans | -77.5 | 120.2 | 167.7 | -84 | 174.4 | 178.6 | 131.9 | 0 | 110.1 | A153 E154 K155 G205 | K151-A153 PolarHBondContact O-N 3Å; K151-A153 VanDerWaalsContact O-N 3.12Å; K151-E154 PolarHBondContact O-N 3.43Å; K151-K155 PolarHBondContact O-N 2.87Å; K151-G205 WeakPolarHBondContact CB-O 3.48Å; K151-G205 PolarHBondContact N-O 3.08Å | ||
| 152 | A | 72 | Confident | 78.2 | Confident | 78 Ų | 78 | 62.5 Ų | 62.5 | 65% | 0.645 | 33% | 0.328 | S | S | * | . | G | 310 helix | trans | -55.6 | -32 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | L150 E154 | L150-A152 PolarHBondContact O-N 3.12Å; A152-E154 VanDerWaalsContact C-N 3.28Å; A152-E154 PolarHBondContact O-N 2.89Å |
| 153 | A | 76.6 | Confident | 79.6 | Confident | 101 Ų | 101 | 62.7 Ų | 62.7 | 84% | 0.835 | 33% | 0.327 | S | S | * | . | G | 310 helix | trans | -68.3 | -23.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | K151 | K151-A153 PolarHBondContact O-N 3Å; K151-A153 VanDerWaalsContact O-N 3.12Å |
| 154 | E | 82.3 | Confident | 80.4 | Confident | 47 Ų | 47 | 65.1 Ų | 65.1 | 22% | 0.22 | 34% | 0.343 | C | S | . | . | G | 310 helix | trans | -115.1 | 6.4 | -171.9 | -54.1 | -153.9 | 115.2 | 0 | 0 | 113.5 | K151 A152 V156 K157 L158 A204 G205 | K151-E154 PolarHBondContact O-N 3.43Å; A152-E154 VanDerWaalsContact C-N 3.28Å; A152-E154 PolarHBondContact O-N 2.89Å; E154-V156 PolarHBondContact O-N 3.3Å; E154-V156 VanDerWaalsContact O-N 3.09Å; E154-K157 HydrophobicContact CB-CD 4.49Å; E154-K157 WeakPolarHBondContact O-CA 3.12Å; E154-K157 WeakPolarHBondContact O-CB 3.42Å; E154-K157 PolarHBondContact O-N 3.38Å; E154-K157 IonicContact OE1-NZ 3.78Å; E154-K157 PolarHBondContact OE1-NZ 3.14Å; E154-L158 PolarHBondContact O-N 2.72Å; E154-A204 WeakPolarHBondContact CB-O 3.34Å; E154-G205 WeakPolarHBondContact OE2-CA 3.24Å |
| 155 | K | 79.8 | Confident | 80.6 | Confident | 65 Ų | 65 | 64.9 Ų | 64.9 | 28% | 0.283 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -47.3 | -43.4 | 177.7 | -72.5 | -178.9 | 171.9 | -163.4 | 0 | 113.3 | L150 K151 K157 L158 I159 E179 | L150-K155 HydrophobicContact CD1-CD 4.33Å; L150-K155 HydrophobicContact CD1-CG 4.12Å; K151-K155 PolarHBondContact O-N 2.87Å; K155-K157 VanDerWaalsContact C-N 3.34Å; K155-K157 PolarHBondContact O-N 3.07Å; K155-L158 PolarHBondContact O-N 3.27Å; K155-I159 WeakPolarHBondContact O-CB 3.49Å; K155-I159 VanDerWaalsContact O-CD1 3.24Å; K155-I159 WeakPolarHBondContact O-CD1 3.35Å; K155-I159 WeakPolarHBondContact O-CG1 3.47Å; K155-I159 PolarHBondContact O-N 3.04Å; K155-E179 IonicContact NZ-OE1 2.76Å |
| 156 | V | 85.1 | Confident | 80.5 | Confident | 99 Ų | 99 | 66.2 Ų | 66.2 | 60% | 0.6 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -67.5 | -34.5 | -179.6 | -179.1 | 0 | 0 | 0 | 0 | 112.1 | E154 K160 | E154-V156 PolarHBondContact O-N 3.3Å; E154-V156 VanDerWaalsContact O-N 3.09Å; V156-K160 WeakPolarHBondContact O-CG 3.33Å; V156-K160 PolarHBondContact O-N 3.16Å |
| 157 | K | 87.3 | Confident | 80.4 | Confident | 118 Ų | 118 | 71.9 Ų | 71.9 | 51% | 0.513 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -71.3 | -45.8 | 175 | -61 | 179.4 | -173.1 | 169.7 | 0 | 109.9 | E154 K155 I159 K160 E161 | E154-K157 HydrophobicContact CB-CD 4.49Å; E154-K157 WeakPolarHBondContact O-CA 3.12Å; E154-K157 WeakPolarHBondContact O-CB 3.42Å; E154-K157 PolarHBondContact O-N 3.38Å; E154-K157 IonicContact OE1-NZ 3.78Å; E154-K157 PolarHBondContact OE1-NZ 3.14Å; K155-K157 VanDerWaalsContact C-N 3.34Å; K155-K157 PolarHBondContact O-N 3.07Å; K157-I159 PolarHBondContact O-N 3.05Å; K157-K160 WeakPolarHBondContact O-CB 3.49Å; K157-K160 PolarHBondContact O-N 3.43Å; K157-E161 PolarHBondContact O-N 3.01Å |
| 158 | L | 84.3 | Confident | 80.4 | Confident | 2 Ų | 2 | 76 Ų | 76 | 1% | 0.01 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -59.3 | -44 | 177.2 | -156.9 | 86.1 | 0 | 0 | 0 | 112.7 | L147 E154 K155 K160 E161 V162 V178 L201 A204 | L147-L158 HydrophobicContact CD1-CD2 4.37Å; L147-L158 HydrophobicContact CD2-CD2 3.73Å; E154-L158 PolarHBondContact O-N 2.72Å; K155-L158 PolarHBondContact O-N 3.27Å; L158-K160 VanDerWaalsContact C-N 3.28Å; L158-K160 PolarHBondContact O-N 3.39Å; L158-E161 PolarHBondContact O-N 2.89Å; L158-E161 VanDerWaalsContact O-N 3.16Å; L158-V162 HydrophobicContact CG-CG2 4.47Å; L158-V162 WeakPolarHBondContact O-CB 3.44Å; L158-V162 VanDerWaalsContact O-CG2 3.31Å; L158-V162 WeakPolarHBondContact O-CG2 3.47Å; L158-V162 PolarHBondContact O-N 3.33Å; L158-V178 HydrophobicContact CD2-CB 4.38Å; L158-V178 HydrophobicContact CD2-CG1 3.62Å; L158-V178 HydrophobicContact CD2-CG2 3.9Å; L158-V178 HydrophobicContact CG-CG2 4.44Å; L158-L201 HydrophobicContact CD1-CD2 4.45Å; L158-L201 WeakPolarHBondContact CD1-O 3.41Å; L158-A204 HydrophobicContact CD1-CB 3.9Å |
| 159 | I | 87.6 | Confident | 80.7 | Confident | 19 Ų | 19 | 75.4 Ų | 75.4 | 10% | 0.097 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -61.8 | -36.8 | 178.1 | -70.1 | 158.2 | 0 | 0 | 0 | 111.7 | K155 K157 K163 L171 A174 K175 V178 | K155-I159 WeakPolarHBondContact O-CB 3.49Å; K155-I159 VanDerWaalsContact O-CD1 3.24Å; K155-I159 WeakPolarHBondContact O-CD1 3.35Å; K155-I159 WeakPolarHBondContact O-CG1 3.47Å; K155-I159 PolarHBondContact O-N 3.04Å; K157-I159 PolarHBondContact O-N 3.05Å; I159-K163 WeakPolarHBondContact O-CB 3.47Å; I159-K163 PolarHBondContact O-N 3.49Å; I159-L171 HydrophobicContact CG2-CD2 4.1Å; I159-A174 HydrophobicContact CG2-CB 3.96Å; I159-K175 HydrophobicContact CD1-CG 3.68Å; I159-K175 HydrophobicContact CG1-CG 4.3Å; I159-K175 HydrophobicContact CG2-CG 4.21Å; I159-V178 HydrophobicContact CG1-CB 4.16Å; I159-V178 HydrophobicContact CG1-CG1 4.34Å; I159-V178 HydrophobicContact CG1-CG2 4Å |
| 160 | K | 85.3 | Confident | 81.2 | Confident | 128 Ų | 128 | 74.4 Ų | 74.4 | 56% | 0.557 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -68.5 | -41.9 | 176.2 | -71.1 | 173.2 | -178.4 | -178.1 | 0 | 110.6 | V156 K157 L158 K163 N164 | V156-K160 WeakPolarHBondContact O-CG 3.33Å; V156-K160 PolarHBondContact O-N 3.16Å; K157-K160 WeakPolarHBondContact O-CB 3.49Å; K157-K160 PolarHBondContact O-N 3.43Å; L158-K160 VanDerWaalsContact C-N 3.28Å; L158-K160 PolarHBondContact O-N 3.39Å; K160-K163 WeakPolarHBondContact O-CB 3.22Å; K160-K163 PolarHBondContact O-N 3.4Å; K160-N164 VanDerWaalsContact O-CG 3.25Å; K160-N164 PolarHBondContact O-N 2.9Å; K160-N164 VanDerWaalsContact O-N 3.12Å; K160-N164 PolarHBondContact O-ND2 3.11Å |
| 161 | E | 84.9 | Confident | 81.5 | Confident | 67 Ų | 67 | 76 Ų | 76 | 31% | 0.313 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -70.9 | -41.4 | -179.4 | -147.1 | 58 | -165 | 0 | 0 | 112.4 | K157 L158 K163 N164 C165 A200 A204 | K157-E161 PolarHBondContact O-N 3.01Å; L158-E161 PolarHBondContact O-N 2.89Å; L158-E161 VanDerWaalsContact O-N 3.16Å; E161-K163 VanDerWaalsContact C-N 3.28Å; E161-K163 PolarHBondContact O-N 3.02Å; E161-N164 CarbonylContact O-C 3.58Å; E161-N164 WeakPolarHBondContact O-CA 3.41Å; E161-N164 WeakPolarHBondContact O-CB 3.47Å; E161-N164 PolarHBondContact O-N 3.34Å; E161-N164 PolarHBondContact OE2-ND2 3.06Å; E161-C165 WeakPolarHBondContact O-CB 3.2Å; E161-C165 PolarHBondContact O-N 3.39Å; E161-C165 PolarHBondContact O-SG 2.99Å; E161-A200 HydrophobicContact CG-CB 4.42Å; E161-A204 HydrophobicContact CB-CB 4.03Å; E161-A204 HydrophobicContact CG-CB 4.33Å |
| 162 | V | 84.4 | Confident | 81.6 | Confident | 0 Ų | 0 | 73.2 Ų | 73.2 | 0% | 0 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -59.6 | -38.1 | 173.3 | 171.3 | 0 | 0 | 0 | 0 | 111.7 | L158 N164 C165 I166 L169 V178 I185 L201 | L158-V162 HydrophobicContact CG-CG2 4.47Å; L158-V162 WeakPolarHBondContact O-CB 3.44Å; L158-V162 VanDerWaalsContact O-CG2 3.31Å; L158-V162 WeakPolarHBondContact O-CG2 3.47Å; L158-V162 PolarHBondContact O-N 3.33Å; V162-N164 VanDerWaalsContact C-N 3.32Å; V162-N164 PolarHBondContact O-N 2.7Å; V162-C165 PolarHBondContact O-N 3.16Å; V162-I166 HydrophobicContact CG1-CD1 4.16Å; V162-I166 PolarHBondContact O-N 3.24Å; V162-L169 HydrophobicContact CG1-CD1 4.22Å; V162-V178 HydrophobicContact CB-CG2 4.45Å; V162-V178 HydrophobicContact CG2-CG2 3.96Å; V162-I185 HydrophobicContact CG1-CD1 4.47Å; V162-I185 HydrophobicContact CG2-CD1 4.26Å; V162-L201 HydrophobicContact CG2-CD2 3.8Å |
| 163 | K | 84.3 | Confident | 82.2 | Confident | 97 Ų | 97 | 74.5 Ų | 74.5 | 42% | 0.422 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -64.9 | -35.7 | 173.5 | -176.3 | -169.2 | 170.8 | -162.5 | 0 | 112.2 | I159 K160 E161 I166 | I159-K163 WeakPolarHBondContact O-CB 3.47Å; I159-K163 PolarHBondContact O-N 3.49Å; K160-K163 WeakPolarHBondContact O-CB 3.22Å; K160-K163 PolarHBondContact O-N 3.4Å; E161-K163 VanDerWaalsContact C-N 3.28Å; E161-K163 PolarHBondContact O-N 3.02Å; K163-I166 CarbonylContact O-C 3.52Å |
| 164 | N | 83.1 | Confident | 82.5 | Confident | 98 Ų | 98 | 69.7 Ų | 69.7 | 52% | 0.524 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -73.8 | -40.1 | 177.3 | -65.6 | -24.7 | 0 | 0 | 0 | 111.4 | K160 E161 V162 | K160-N164 VanDerWaalsContact O-CG 3.25Å; K160-N164 PolarHBondContact O-N 2.9Å; K160-N164 VanDerWaalsContact O-N 3.12Å; K160-N164 PolarHBondContact O-ND2 3.11Å; E161-N164 CarbonylContact O-C 3.58Å; E161-N164 WeakPolarHBondContact O-CA 3.41Å; E161-N164 WeakPolarHBondContact O-CB 3.47Å; E161-N164 PolarHBondContact O-N 3.34Å; E161-N164 PolarHBondContact OE2-ND2 3.06Å; V162-N164 VanDerWaalsContact C-N 3.32Å; V162-N164 PolarHBondContact O-N 2.7Å |
| 165 | C | 78.1 | Confident | 82.6 | Confident | 20 Ų | 20 | 72.8 Ų | 72.8 | 14% | 0.135 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -71.4 | -32.1 | 178.9 | -64.4 | 0 | 0 | 0 | 0 | 113 | E161 V162 R186 L197 | E161-C165 WeakPolarHBondContact O-CB 3.2Å; E161-C165 PolarHBondContact O-N 3.39Å; E161-C165 PolarHBondContact O-SG 2.99Å; V162-C165 PolarHBondContact O-N 3.16Å; C165-R186 PolarHBondContact O-NE 3.35Å; C165-R186 PolarHBondContact O-NH2 3.07Å; C165-L197 HydrophobicContact CB-CD2 3.76Å |
| 166 | I | 77.4 | Confident | 82.8 | Confident | 28 Ų | 28 | 76 Ų | 76 | 14% | 0.144 | 39% | 0.394 | C | S | . | . | S | Bend | trans | -119.7 | 89.4 | 177.4 | -47.9 | 167.7 | 0 | 0 | 0 | 109 | V162 K163 G168 L169 I185 R186 | V162-I166 HydrophobicContact CG1-CD1 4.16Å; V162-I166 PolarHBondContact O-N 3.24Å; K163-I166 CarbonylContact O-C 3.52Å; I166-G168 PolarHBondContact O-N 2.95Å; I166-L169 HydrophobicContact CB-CD1 3.66Å; I166-L169 HydrophobicContact CB-CG 4.05Å; I166-L169 HydrophobicContact CD1-CD1 3.63Å; I166-L169 HydrophobicContact CG1-CD1 4.26Å; I166-L169 HydrophobicContact CG2-CD1 3.78Å; I166-L169 HydrophobicContact CG2-CG 3.75Å; I166-L169 PolarHBondContact O-N 3.09Å; I166-I185 HydrophobicContact CD1-CG2 3.74Å; I166-I185 WeakPolarHBondContact CD1-O 3.18Å; I166-I185 HydrophobicContact CG1-CG2 4.25Å; I166-R186 HydrophobicContact CG1-CG 4.23Å |
| 167 | Q | 75.7 | Confident | 82.6 | Confident | 173 Ų | 173 | 73.1 Ų | 73.1 | 81% | 0.808 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.8 | 126.7 | 174.7 | -61.9 | 171.8 | 5.1 | 0 | 0 | 109.4 | ||
| 168 | G | 77.4 | Confident | 82.2 | Confident | 85 Ų | 85 | 67.6 Ų | 67.6 | 88% | 0.876 | 35% | 0.351 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 109.5 | -7.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | I166 | I166-G168 PolarHBondContact O-N 2.95Š|
| 169 | L | 79.5 | Confident | 82.2 | Confident | 39 Ų | 39 | 73.5 Ų | 73.5 | 20% | 0.204 | 38% | 0.378 | C | S | . | . | trans | -81.7 | 134.9 | 171.3 | -66 | 179.9 | 0 | 0 | 0 | 112.2 | V162 I166 Q173 L177 | V162-L169 HydrophobicContact CG1-CD1 4.22Å; I166-L169 HydrophobicContact CB-CD1 3.66Å; I166-L169 HydrophobicContact CB-CG 4.05Å; I166-L169 HydrophobicContact CD1-CD1 3.63Å; I166-L169 HydrophobicContact CG1-CD1 4.26Å; I166-L169 HydrophobicContact CG2-CD1 3.78Å; I166-L169 HydrophobicContact CG2-CG 3.75Å; I166-L169 PolarHBondContact O-N 3.09Å; L169-Q173 HydrophobicContact CD2-CB 4.13Å; L169-L177 HydrophobicContact CD1-CD1 3.37Å; L169-L177 HydrophobicContact CD2-CD1 3.86Å; L169-L177 HydrophobicContact CG-CD1 4.27Å | ||
| 170 | N | 84.2 | Confident | 81.8 | Confident | 104 Ų | 104 | 75.7 Ų | 75.7 | 56% | 0.556 | 40% | 0.396 | S | S | * | . | trans | -78.4 | 154.9 | 169.4 | -165.6 | -45.2 | 0 | 0 | 0 | 109.9 | V172 Q173 A174 | N170-V172 PolarHBondContact O-N 3.02Å; N170-V172 VanDerWaalsContact O-N 3.08Å; N170-V172 PolarHBondContact OD1-N 2.98Å; N170-Q173 HydrophobicContact CB-CG 4.28Å; N170-Q173 WeakPolarHBondContact O-CA 3.33Å; N170-Q173 PolarHBondContact O-N 2.96Å; N170-A174 PolarHBondContact O-N 3.49Å | ||
| 171 | L | 82.5 | Confident | 81.1 | Confident | 85 Ų | 85 | 71.9 Ų | 71.9 | 45% | 0.445 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -51 | -32.9 | 174 | -85.7 | 167.3 | 0 | 0 | 0 | 113 | I159 K175 | I159-L171 HydrophobicContact CG2-CD2 4.1Å; L171-K175 WeakPolarHBondContact O-CB 3.33Å; L171-K175 WeakPolarHBondContact O-CD 3.47Å; L171-K175 WeakPolarHBondContact O-CG 3.36Å; L171-K175 PolarHBondContact O-N 3.19Å; L171-K175 VanDerWaalsContact O-N 3.12Å |
| 172 | V | 81.5 | Confident | 80.7 | Confident | 85 Ų | 85 | 73.8 Ų | 73.8 | 52% | 0.515 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -70.7 | -39.8 | 176 | -178 | 0 | 0 | 0 | 0 | 111.6 | N170 K176 | N170-V172 PolarHBondContact O-N 3.02Å; N170-V172 VanDerWaalsContact O-N 3.08Å; N170-V172 PolarHBondContact OD1-N 2.98Å; V172-K176 WeakPolarHBondContact O-CG 3.48Å; V172-K176 PolarHBondContact O-N 3.37Å |
| 173 | Q | 84.3 | Confident | 80.4 | Confident | 104 Ų | 104 | 77.2 Ų | 77.2 | 49% | 0.486 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -72.2 | -41.1 | 178.3 | -61 | -62 | -18.8 | 0 | 0 | 111.3 | L169 N170 K175 K176 L177 | L169-Q173 HydrophobicContact CD2-CB 4.13Å; N170-Q173 HydrophobicContact CB-CG 4.28Å; N170-Q173 WeakPolarHBondContact O-CA 3.33Å; N170-Q173 PolarHBondContact O-N 2.96Å; Q173-K175 VanDerWaalsContact C-N 3.34Å; Q173-K175 PolarHBondContact O-N 3.15Å; Q173-K176 PolarHBondContact O-N 3.05Å; Q173-L177 WeakPolarHBondContact O-CG 3.41Å; Q173-L177 PolarHBondContact O-N 3.39Å |
| 174 | A | 83.8 | Confident | 80.2 | Confident | 0 Ų | 0 | 77 Ų | 77 | 0% | 0 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.8 | -38.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | I159 N170 L177 V178 | I159-A174 HydrophobicContact CG2-CB 3.96Å; N170-A174 PolarHBondContact O-N 3.49Å; A174-L177 PolarHBondContact O-N 3.38Å; A174-V178 WeakPolarHBondContact O-CG2 3.4Å; A174-V178 PolarHBondContact O-N 2.89Å |
| 175 | K | 83.6 | Confident | 79.9 | Confident | 112 Ų | 112 | 72.9 Ų | 72.9 | 49% | 0.487 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.1 | -48.7 | 171.5 | -78.6 | 171.2 | -179.4 | -170.9 | 0 | 111.8 | I159 L171 Q173 L177 V178 E179 | I159-K175 HydrophobicContact CD1-CG 3.68Å; I159-K175 HydrophobicContact CG1-CG 4.3Å; I159-K175 HydrophobicContact CG2-CG 4.21Å; L171-K175 WeakPolarHBondContact O-CB 3.33Å; L171-K175 WeakPolarHBondContact O-CD 3.47Å; L171-K175 WeakPolarHBondContact O-CG 3.36Å; L171-K175 PolarHBondContact O-N 3.19Å; L171-K175 VanDerWaalsContact O-N 3.12Å; Q173-K175 VanDerWaalsContact C-N 3.34Å; Q173-K175 PolarHBondContact O-N 3.15Å; K175-L177 VanDerWaalsContact C-N 3.34Å; K175-L177 PolarHBondContact O-N 2.89Å; K175-V178 PolarHBondContact O-N 3.37Å; K175-E179 WeakPolarHBondContact O-CG 3.25Å; K175-E179 PolarHBondContact O-N 3.36Å |
| 176 | K | 84.9 | Confident | 79.4 | Confident | 133 Ų | 133 | 76.6 Ų | 76.6 | 58% | 0.578 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -61.8 | -40.3 | 178.2 | -72.4 | -161.1 | 175.4 | -162.9 | 0 | 112.6 | V172 Q173 E179 S180 | V172-K176 WeakPolarHBondContact O-CG 3.48Å; V172-K176 PolarHBondContact O-N 3.37Å; Q173-K176 PolarHBondContact O-N 3.05Å; K176-E179 PolarHBondContact O-N 3.45Å; K176-S180 VanDerWaalsContact O-CB 3.27Å; K176-S180 WeakPolarHBondContact O-CB 3.18Å; K176-S180 PolarHBondContact O-N 3.41Å; K176-S180 VanDerWaalsContact O-N 3.08Å; K176-S180 PolarHBondContact O-OG 3.01Å |
| 177 | L | 80.3 | Confident | 79.2 | Confident | 39 Ų | 39 | 77.6 Ų | 77.6 | 20% | 0.204 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -68.8 | -37.8 | 179.4 | -72.8 | 165.6 | 0 | 0 | 0 | 113 | L169 Q173 A174 K175 Q183 | L169-L177 HydrophobicContact CD1-CD1 3.37Å; L169-L177 HydrophobicContact CD2-CD1 3.86Å; L169-L177 HydrophobicContact CG-CD1 4.27Å; Q173-L177 WeakPolarHBondContact O-CG 3.41Å; Q173-L177 PolarHBondContact O-N 3.39Å; A174-L177 PolarHBondContact O-N 3.38Å; K175-L177 VanDerWaalsContact C-N 3.34Å; K175-L177 PolarHBondContact O-N 2.89Å; L177-Q183 HydrophobicContact CD2-CG 3.85Å |
| 178 | V | 80.2 | Confident | 78.8 | Confident | 1 Ų | 1 | 74.3 Ų | 74.3 | 1% | 0.006 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -70.8 | -34.7 | 176.3 | 167.6 | 0 | 0 | 0 | 0 | 111.6 | L150 L158 I159 V162 A174 K175 | L150-V178 HydrophobicContact CD1-CG1 3.71Å; L150-V178 VanDerWaalsContact CD1-O 3.31Å; L150-V178 WeakPolarHBondContact CD1-O 3.4Å; L158-V178 HydrophobicContact CD2-CB 4.38Å; L158-V178 HydrophobicContact CD2-CG1 3.62Å; L158-V178 HydrophobicContact CD2-CG2 3.9Å; L158-V178 HydrophobicContact CG-CG2 4.44Å; I159-V178 HydrophobicContact CG1-CB 4.16Å; I159-V178 HydrophobicContact CG1-CG1 4.34Å; I159-V178 HydrophobicContact CG1-CG2 4Å; V162-V178 HydrophobicContact CB-CG2 4.45Å; V162-V178 HydrophobicContact CG2-CG2 3.96Å; A174-V178 WeakPolarHBondContact O-CG2 3.4Å; A174-V178 PolarHBondContact O-N 2.89Å; K175-V178 PolarHBondContact O-N 3.37Å |
| 179 | E | 82.9 | Confident | 78.5 | Confident | 126 Ų | 126 | 70.8 Ų | 70.8 | 59% | 0.589 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -84.3 | -14.5 | -179.1 | -65.7 | -171.4 | 139.4 | 0 | 0 | 114.3 | K155 K175 K176 L181 | K155-E179 IonicContact NZ-OE1 2.76Å; K175-E179 WeakPolarHBondContact O-CG 3.25Å; K175-E179 PolarHBondContact O-N 3.36Å; K176-E179 PolarHBondContact O-N 3.45Å; E179-L181 VanDerWaalsContact C-N 3.35Å; E179-L181 PolarHBondContact O-N 2.94Å |
| 180 | S | 78.6 | Confident | 78.6 | Confident | 66 Ų | 66 | 71.3 Ų | 71.3 | 46% | 0.462 | 37% | 0.374 | S | S | . | . | S | Bend | trans | -92.9 | 48.5 | -177.6 | -56.1 | 0 | 0 | 0 | 0 | 112.9 | K176 Q183 | K176-S180 VanDerWaalsContact O-CB 3.27Å; K176-S180 WeakPolarHBondContact O-CB 3.18Å; K176-S180 PolarHBondContact O-N 3.41Å; K176-S180 VanDerWaalsContact O-N 3.08Å; K176-S180 PolarHBondContact O-OG 3.01Å; S180-Q183 WeakPolarHBondContact O-CB 3.38Å |
| 181 | L | 72.2 | Confident | 78 | Confident | 48 Ų | 48 | 70.7 Ų | 70.7 | 25% | 0.251 | 37% | 0.366 | S | S | . | . | S | Bend | trans | -68.1 | 144.3 | 178.9 | -61.6 | -176.1 | 0 | 0 | 0 | 112.3 | L147 T148 L150 E179 | L147-L181 HydrophobicContact CB-CD2 4Å; L147-L181 HydrophobicContact CD2-CD2 3.63Å; L147-L181 HydrophobicContact CG-CD2 3.68Å; L147-L181 WeakPolarHBondContact O-CD2 3.33Å; T148-L181 WeakPolarHBondContact O-CD1 3.4Å; L150-L181 HydrophobicContact CB-CD1 4.03Å; L150-L181 HydrophobicContact CD1-CD1 4.44Å; L150-L181 HydrophobicContact CD2-CD1 3.17Å; L150-L181 HydrophobicContact CD2-CG 4.13Å; L150-L181 HydrophobicContact CG-CD1 4.01Å; E179-L181 VanDerWaalsContact C-N 3.35Å; E179-L181 PolarHBondContact O-N 2.94Å |
| 182 | P | 76.2 | Confident | 77.8 | Confident | 107 Ų | 107 | 71.9 Ų | 71.9 | 70% | 0.695 | 37% | 0.373 | S | S | * | . | S | Bend | cis | -83 | 130.1 | -5.6 | 30.4 | -30.9 | 0 | 0 | 0 | 112.5 | ||
| 183 | Q | 77.8 | Confident | 77.5 | Confident | 72 Ų | 72 | 73 Ų | 73 | 34% | 0.336 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.4 | 141.3 | -175.7 | -177.4 | 61.9 | 46.1 | 0 | 0 | 112.6 | L147 L177 S180 | L147-Q183 PolarHBondContact N-O 3.39Å; L147-Q183 PolarHBondContact O-N 3.33Å; L177-Q183 HydrophobicContact CD2-CG 3.85Å; S180-Q183 WeakPolarHBondContact O-CB 3.38Å |
| 184 | E | 80.4 | Confident | 77 | Confident | 91 Ų | 91 | 68.1 Ų | 68.1 | 43% | 0.425 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.8 | 122.3 | 172.5 | -67.5 | 175.4 | -173 | 0 | 0 | 110.7 | T144 K146 | T144-E184 HydrophobicContact CG2-CB 4.28Å; T144-E184 HydrophobicContact CG2-CG 3.71Å; K146-E184 HydrophobicContact CD-CG 4.13Å; K146-E184 VanDerWaalsContact CE-CG 3.42Å; K146-E184 WeakPolarHBondContact CE-OE1 3.4Å; K146-E184 HydrophobicContact CG-CG 3.58Å; K146-E184 IonicContact NZ-OE1 2.67Å; K146-E184 PolarHBondContact NZ-OE1 3.21Å |
| 185 | I | 75.9 | Confident | 76.9 | Confident | 12 Ų | 12 | 74.2 Ų | 74.2 | 6% | 0.062 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.2 | -44.4 | 179.4 | -59.5 | -69.3 | 0 | 0 | 0 | 109.6 | V145 L147 V162 I166 L201 | V145-I185 PolarHBondContact O-N 3.02Å; L147-I185 HydrophobicContact CB-CD1 4.05Å; L147-I185 HydrophobicContact CB-CG1 3.8Å; L147-I185 HydrophobicContact CD2-CD1 4.25Å; V162-I185 HydrophobicContact CG1-CD1 4.47Å; V162-I185 HydrophobicContact CG2-CD1 4.26Å; I166-I185 HydrophobicContact CD1-CG2 3.74Å; I166-I185 WeakPolarHBondContact CD1-O 3.18Å; I166-I185 HydrophobicContact CG1-CG2 4.25Å; I185-L201 HydrophobicContact CG2-CD1 4.19Å |
| 186 | R | 68.7 | Low | 76.8 | Confident | 98 Ų | 98 | 76 Ų | 76 | 37% | 0.37 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.1 | 126.9 | 176.2 | -80.6 | -71.9 | -167.5 | 147.1 | 2.9 | 109.3 | V145 C165 I166 V189 L197 | V145-R186 PolarHBondContact N-O 3.12Å; C165-R186 PolarHBondContact O-NE 3.35Å; C165-R186 PolarHBondContact O-NH2 3.07Å; I166-R186 HydrophobicContact CG1-CG 4.23Å; R186-V189 HydrophobicContact CB-CG1 3.96Å; R186-L197 HydrophobicContact CB-CD1 4.33Å; R186-L197 HydrophobicContact CG-CD1 4.22Å |
| 187 | A | 72.1 | Confident | 76.6 | Confident | 50 Ų | 50 | 71 Ų | 71 | 41% | 0.413 | 37% | 0.366 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.2 | 149.6 | 171 | 0 | 0 | 0 | 0 | 0 | 110.2 | T144 | T144-A187 HydrophobicContact CG2-CB 4.39Å |
| 188 | N | 67.5 | Low | 76.6 | Confident | 104 Ų | 104 | 72.5 Ų | 72.5 | 56% | 0.556 | 37% | 0.371 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 60.1 | 45.4 | 174.5 | -55.9 | -55.5 | 0 | 0 | 0 | 115 | Q142 F143 | Q142-N188 HydrophobicContact CB-CB 4.43Å; Q142-N188 HydrophobicContact CG-CB 4.34Å; Q142-N188 PolarHBondContact OE1-OD1 3.35Å; F143-N188 PolarHBondContact O-N 3.46Å |
| 189 | V | 72 | Confident | 76.7 | Confident | 10 Ų | 10 | 75.2 Ų | 75.2 | 6% | 0.061 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.2 | 147.1 | 170.7 | -71.3 | 0 | 0 | 0 | 0 | 111.2 | F143 V145 R186 E193 A194 L197 | F143-V189 HydrophobicContact CB-CG2 4.47Å; F143-V189 PolarHBondContact N-O 3.35Å; F143-V189 WeakPolarHBondContact O-CG2 3.31Å; F143-V189 PolarHBondContact O-N 3.28Å; V145-V189 HydrophobicContact CG2-CG2 3.57Å; R186-V189 HydrophobicContact CB-CG1 3.96Å; V189-E193 HydrophobicContact CB-CB 4.2Å; V189-A194 HydrophobicContact CG2-CB 3.73Å; V189-L197 HydrophobicContact CG1-CD1 4.04Å; V189-L197 HydrophobicContact CG2-CD1 4.45Å |
| 190 | S | 80.7 | Confident | 76.7 | Confident | 50 Ų | 50 | 70.5 Ų | 70.5 | 35% | 0.35 | 38% | 0.376 | S | S | . | . | trans | -66.2 | 158.4 | 174.5 | 60.3 | 0 | 0 | 0 | 0 | 110.7 | D192 E193 A194 | S190-D192 VanDerWaalsContact C-N 3.27Å; S190-D192 PolarHBondContact O-N 3.26Å; S190-E193 PolarHBondContact O-N 2.97Å; S190-E193 WeakPolarHBondContact OG-CG 3.42Å; S190-A194 WeakPolarHBondContact O-CB 3.21Å; S190-A194 PolarHBondContact O-N 2.94Å | ||
| 191 | K | 72.7 | Confident | 76.9 | Confident | 91 Ų | 91 | 67.4 Ų | 67.4 | 40% | 0.396 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -50.1 | -46.5 | -178.6 | -73.1 | 175 | -178.8 | 175.3 | 0 | 112.5 | F143 E193 A194 E195 | F143-K191 HydrophobicContact CD2-CG 3.75Å; F143-K191 HydrophobicContact CE2-CB 4.29Å; F143-K191 HydrophobicContact CE2-CD 3.9Å; F143-K191 VanDerWaalsContact CE2-CE 3.49Å; F143-K191 HydrophobicContact CE2-CG 3.09Å; F143-K191 HydrophobicContact CZ-CD 4.24Å; F143-K191 HydrophobicContact CZ-CG 3.76Å; K191-E193 VanDerWaalsContact C-N 3.35Å; K191-E193 PolarHBondContact O-N 2.93Å; K191-A194 PolarHBondContact O-N 3.48Å; K191-E195 WeakPolarHBondContact O-CG 3.43Å; K191-E195 PolarHBondContact O-N 3.41Å; K191-E195 VanDerWaalsContact O-N 3.08Å |
| 192 | D | 77.8 | Confident | 77.4 | Confident | 111 Ų | 111 | 69.4 Ų | 69.4 | 59% | 0.594 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -68.2 | -32.8 | -178.4 | -55 | -65.9 | 0 | 0 | 0 | 113.1 | S190 K196 | S190-D192 VanDerWaalsContact C-N 3.27Å; S190-D192 PolarHBondContact O-N 3.26Å; D192-K196 WeakPolarHBondContact O-CD 3.49Å; D192-K196 WeakPolarHBondContact O-CG 3.47Å; D192-K196 PolarHBondContact O-N 3.02Å |
| 193 | E | 74.6 | Confident | 77.7 | Confident | 109 Ų | 109 | 68.3 Ų | 68.3 | 51% | 0.509 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -79.4 | -37.2 | 176.4 | -69.8 | -168.3 | 168.7 | 0 | 0 | 111.6 | V189 S190 K191 E195 K196 L197 | V189-E193 HydrophobicContact CB-CB 4.2Å; S190-E193 PolarHBondContact O-N 2.97Å; S190-E193 WeakPolarHBondContact OG-CG 3.42Å; K191-E193 VanDerWaalsContact C-N 3.35Å; K191-E193 PolarHBondContact O-N 2.93Å; E193-E195 PolarHBondContact O-N 3.45Å; E193-K196 PolarHBondContact O-N 3.12Å; E193-L197 VanDerWaalsContact O-CB 3.32Å; E193-L197 WeakPolarHBondContact O-CB 3.43Å; E193-L197 WeakPolarHBondContact O-CG 3.34Å; E193-L197 PolarHBondContact O-N 2.96Å |
| 194 | A | 75.2 | Confident | 77.7 | Confident | 1 Ų | 1 | 65.3 Ų | 65.3 | 1% | 0.008 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | F143 V145 V189 S190 K191 L197 K198 L210 | F143-A194 HydrophobicContact CB-CB 3.75Å; F143-A194 HydrophobicContact CG-CB 4.24Å; V145-A194 HydrophobicContact CG2-CB 4.43Å; V189-A194 HydrophobicContact CG2-CB 3.73Å; S190-A194 WeakPolarHBondContact O-CB 3.21Å; S190-A194 PolarHBondContact O-N 2.94Å; K191-A194 PolarHBondContact O-N 3.48Å; A194-L197 PolarHBondContact O-N 3.34Å; A194-K198 VanDerWaalsContact O-CB 3.27Å; A194-K198 WeakPolarHBondContact O-CB 3.35Å; A194-K198 PolarHBondContact O-N 3.03Å; A194-L210 HydrophobicContact CB-CD1 4.5Å; A194-L210 HydrophobicContact CB-CD2 3.96Å |
| 195 | E | 80.1 | Confident | 77.4 | Confident | 128 Ų | 128 | 61.3 Ų | 61.3 | 60% | 0.598 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -68.6 | -40 | 177.4 | -71 | -174.9 | 170.1 | 0 | 0 | 112.5 | K191 E193 K198 A199 | K191-E195 WeakPolarHBondContact O-CG 3.43Å; K191-E195 PolarHBondContact O-N 3.41Å; K191-E195 VanDerWaalsContact O-N 3.08Å; E193-E195 PolarHBondContact O-N 3.45Å; E195-K198 PolarHBondContact O-N 2.97Å; E195-A199 WeakPolarHBondContact O-CB 3.26Å; E195-A199 PolarHBondContact O-N 3.14Å |
| 196 | K | 82 | Confident | 77.6 | Confident | 150 Ų | 150 | 61 Ų | 61 | 65% | 0.652 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -64.1 | -41.8 | 174.7 | -74.1 | 171.1 | -172 | 169.6 | 0 | 112 | D192 E193 A199 A200 | D192-K196 WeakPolarHBondContact O-CD 3.49Å; D192-K196 WeakPolarHBondContact O-CG 3.47Å; D192-K196 PolarHBondContact O-N 3.02Å; E193-K196 PolarHBondContact O-N 3.12Å; K196-A199 PolarHBondContact O-N 3.49Å; K196-A200 WeakPolarHBondContact O-CB 3.44Å; K196-A200 PolarHBondContact O-N 3.44Å |
| 197 | L | 80.6 | Confident | 78 | Confident | 28 Ų | 28 | 59.1 Ų | 59.1 | 15% | 0.147 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -67.9 | -41.9 | 177 | -72.8 | 172.2 | 0 | 0 | 0 | 111.4 | V145 C165 R186 V189 E193 A194 A200 L201 | V145-L197 HydrophobicContact CG2-CD1 4.4Å; C165-L197 HydrophobicContact CB-CD2 3.76Å; R186-L197 HydrophobicContact CB-CD1 4.33Å; R186-L197 HydrophobicContact CG-CD1 4.22Å; V189-L197 HydrophobicContact CG1-CD1 4.04Å; V189-L197 HydrophobicContact CG2-CD1 4.45Å; E193-L197 VanDerWaalsContact O-CB 3.32Å; E193-L197 WeakPolarHBondContact O-CB 3.43Å; E193-L197 WeakPolarHBondContact O-CG 3.34Å; E193-L197 PolarHBondContact O-N 2.96Å; A194-L197 PolarHBondContact O-N 3.34Å; L197-A200 PolarHBondContact O-N 2.95Å; L197-L201 WeakPolarHBondContact O-CB 3.35Å; L197-L201 WeakPolarHBondContact O-CD1 3.25Å; L197-L201 WeakPolarHBondContact O-CG 3.48Å; L197-L201 PolarHBondContact O-N 3.48Å |
| 198 | K | 79.6 | Confident | 78.4 | Confident | 70 Ų | 70 | 57 Ų | 57 | 30% | 0.304 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -57.7 | -50.2 | 173.1 | 179.2 | 178.8 | 178.1 | -176.4 | 0 | 110.9 | A194 E195 A200 L201 E202 V208 L210 | A194-K198 VanDerWaalsContact O-CB 3.27Å; A194-K198 WeakPolarHBondContact O-CB 3.35Å; A194-K198 PolarHBondContact O-N 3.03Å; E195-K198 PolarHBondContact O-N 2.97Å; K198-A200 PolarHBondContact O-N 3.37Å; K198-L201 PolarHBondContact O-N 2.96Å; K198-E202 WeakPolarHBondContact CE-OE1 3.4Å; K198-E202 HydrophobicContact CG-CG 4.32Å; K198-E202 WeakPolarHBondContact CG-OE1 3.3Å; K198-E202 IonicContact NZ-OE1 3.92Å; K198-E202 VanDerWaalsContact O-CB 3.32Å; K198-E202 WeakPolarHBondContact O-CB 3.45Å; K198-E202 VanDerWaalsContact O-CG 3.3Å; K198-E202 WeakPolarHBondContact O-CG 3.5Å; K198-E202 PolarHBondContact O-N 3.34Å; K198-V208 HydrophobicContact CB-CG1 4.22Å; K198-V208 HydrophobicContact CG-CB 4.18Å; K198-V208 HydrophobicContact CG-CG1 4.19Å; K198-L210 HydrophobicContact CD-CD1 3.97Å; K198-L210 HydrophobicContact CD-CG 4.18Å |
| 199 | A | 82.5 | Confident | 78.9 | Confident | 57 Ų | 57 | 55 Ų | 55 | 47% | 0.471 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.8 | -42 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | E195 K196 A203 | E195-A199 WeakPolarHBondContact O-CB 3.26Å; E195-A199 PolarHBondContact O-N 3.14Å; K196-A199 PolarHBondContact O-N 3.49Å; A199-A203 VanDerWaalsContact O-CB 3.23Å; A199-A203 WeakPolarHBondContact O-CB 3.43Å; A199-A203 PolarHBondContact O-N 2.96Å |
| 200 | A | 83.2 | Confident | 79 | Confident | 28 Ų | 28 | 57 Ų | 57 | 23% | 0.231 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.3 | -41.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | E161 K196 L197 K198 A204 | E161-A200 HydrophobicContact CG-CB 4.42Å; K196-A200 WeakPolarHBondContact O-CB 3.44Å; K196-A200 PolarHBondContact O-N 3.44Å; L197-A200 PolarHBondContact O-N 2.95Å; K198-A200 PolarHBondContact O-N 3.37Å; A200-A204 WeakPolarHBondContact O-CB 3.39Å; A200-A204 PolarHBondContact O-N 2.94Å; A200-A204 VanDerWaalsContact O-N 3.14Å |
| 201 | L | 82.8 | Confident | 78.5 | Confident | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -75 | -35.2 | 180 | -67.8 | 170.2 | 0 | 0 | 0 | 112.4 | V145 L158 V162 I185 L197 K198 A204 G205 G206 V208 | V145-L201 HydrophobicContact CG1-CD1 4.02Å; L158-L201 HydrophobicContact CD1-CD2 4.45Å; L158-L201 WeakPolarHBondContact CD1-O 3.41Å; V162-L201 HydrophobicContact CG2-CD2 3.8Å; I185-L201 HydrophobicContact CG2-CD1 4.19Å; L197-L201 WeakPolarHBondContact O-CB 3.35Å; L197-L201 WeakPolarHBondContact O-CD1 3.25Å; L197-L201 WeakPolarHBondContact O-CG 3.48Å; L197-L201 PolarHBondContact O-N 3.48Å; K198-L201 PolarHBondContact O-N 2.96Å; L201-A204 CarbonylContact O-C 3.59Å; L201-A204 PolarHBondContact O-N 3.47Å; L201-G205 PolarHBondContact O-N 3.01Å; L201-G206 PolarHBondContact O-N 3.43Å; L201-V208 HydrophobicContact CB-CG2 3.6Å; L201-V208 HydrophobicContact CD1-CG2 3.8Å; L201-V208 HydrophobicContact CG-CG2 4.35Å |
| 202 | E | 82.5 | Confident | 78.8 | Confident | 91 Ų | 91 | 58.2 Ų | 58.2 | 43% | 0.425 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -67.7 | -41 | 172.7 | -74.4 | 178.7 | 174.1 | 0 | 0 | 112 | K198 A204 G205 G206 | K198-E202 WeakPolarHBondContact CE-OE1 3.4Å; K198-E202 HydrophobicContact CG-CG 4.32Å; K198-E202 WeakPolarHBondContact CG-OE1 3.3Å; K198-E202 IonicContact NZ-OE1 3.92Å; K198-E202 VanDerWaalsContact O-CB 3.32Å; K198-E202 WeakPolarHBondContact O-CB 3.45Å; K198-E202 VanDerWaalsContact O-CG 3.3Å; K198-E202 WeakPolarHBondContact O-CG 3.5Å; K198-E202 PolarHBondContact O-N 3.34Å; E202-A204 PolarHBondContact O-N 2.95Å; E202-G205 PolarHBondContact O-N 3.3Å; E202-G205 VanDerWaalsContact O-N 3.08Å; E202-G206 VanDerWaalsContact CA-O 3.26Å; E202-G206 WeakPolarHBondContact CA-O 3.31Å; E202-G206 WeakPolarHBondContact CG-O 3.41Å |
| 203 | A | 82.9 | Confident | 78.8 | Confident | 83 Ų | 83 | 55.4 Ų | 55.4 | 69% | 0.686 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -63.9 | -27 | 173 | 0 | 0 | 0 | 0 | 0 | 112.8 | A199 | A199-A203 VanDerWaalsContact O-CB 3.23Å; A199-A203 WeakPolarHBondContact O-CB 3.43Å; A199-A203 PolarHBondContact O-N 2.96Å |
| 204 | A | 78.4 | Confident | 79.1 | Confident | 10 Ų | 10 | 52.4 Ų | 52.4 | 8% | 0.083 | 29% | 0.293 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90 | 3.2 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | E154 L158 E161 A200 L201 E202 | E154-A204 WeakPolarHBondContact CB-O 3.34Å; L158-A204 HydrophobicContact CD1-CB 3.9Å; E161-A204 HydrophobicContact CB-CB 4.03Å; E161-A204 HydrophobicContact CG-CB 4.33Å; A200-A204 WeakPolarHBondContact O-CB 3.39Å; A200-A204 PolarHBondContact O-N 2.94Å; A200-A204 VanDerWaalsContact O-N 3.14Å; L201-A204 CarbonylContact O-C 3.59Å; L201-A204 PolarHBondContact O-N 3.47Å; E202-A204 PolarHBondContact O-N 2.95Å |
| 205 | G | 73.5 | Confident | 79.3 | Confident | 7 Ų | 7 | 55.5 Ų | 55.5 | 7% | 0.072 | 31% | 0.309 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 97.2 | 18.2 | 169.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | K151 E154 L201 E202 | K151-G205 WeakPolarHBondContact CB-O 3.48Å; K151-G205 PolarHBondContact N-O 3.08Å; E154-G205 WeakPolarHBondContact OE2-CA 3.24Å; L201-G205 PolarHBondContact O-N 3.01Å; E202-G205 PolarHBondContact O-N 3.3Å; E202-G205 VanDerWaalsContact O-N 3.08Å |
| 206 | G | 81.3 | Confident | 79.2 | Confident | 4 Ų | 4 | 50.9 Ų | 50.9 | 4% | 0.041 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 143.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.9 | E149 L201 E202 | E149-G206 CarbonylContact O-C 3.52Å; E149-G206 WeakPolarHBondContact O-CA 3.45Å; L201-G206 PolarHBondContact O-N 3.43Å; E202-G206 VanDerWaalsContact CA-O 3.26Å; E202-G206 WeakPolarHBondContact CA-O 3.31Å; E202-G206 WeakPolarHBondContact CG-O 3.41Å |
| 207 | T | 77.1 | Confident | 79.1 | Confident | 60 Ų | 60 | 44.3 Ų | 44.3 | 37% | 0.368 | 27% | 0.267 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.4 | 122.8 | 172.7 | -51.5 | 0 | 0 | 0 | 0 | 109.1 | T148 E149 | T148-T207 PolarHBondContact N-O 2.98Å; T148-T207 PolarHBondContact OG1-O 3.18Å; E149-T207 PolarHBondContact O-N 3.2Å |
| 208 | V | 78.6 | Confident | 78.9 | Confident | 5 Ų | 5 | 45.5 Ų | 45.5 | 3% | 0.03 | 28% | 0.276 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.8 | 129.1 | -175.5 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | V145 K146 L147 K198 L201 L210 | V145-V208 HydrophobicContact CB-CG1 4.5Å; V145-V208 HydrophobicContact CG1-CG1 3.35Å; K146-V208 CarbonylContact O-C 3.57Å; K146-V208 VanDerWaalsContact O-CA 3.31Å; K146-V208 WeakPolarHBondContact O-CA 3.21Å; L147-V208 HydrophobicContact CD1-CG2 3.79Å; K198-V208 HydrophobicContact CB-CG1 4.22Å; K198-V208 HydrophobicContact CG-CB 4.18Å; K198-V208 HydrophobicContact CG-CG1 4.19Å; L201-V208 HydrophobicContact CB-CG2 3.6Å; L201-V208 HydrophobicContact CD1-CG2 3.8Å; L201-V208 HydrophobicContact CG-CG2 4.35Å; V208-L210 HydrophobicContact CG1-CD2 4.5Å |
| 209 | V | 78.1 | Confident | 78.9 | Confident | 62 Ų | 62 | 43.6 Ų | 43.6 | 38% | 0.376 | 27% | 0.274 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 134.3 | 174 | -178.9 | 0 | 0 | 0 | 0 | 108.8 | K146 T148 E211 | K146-V209 PolarHBondContact N-O 3Å; K146-V209 PolarHBondContact O-N 3.48Å; T148-V209 HydrophobicContact CG2-CB 4.14Å; T148-V209 HydrophobicContact CG2-CG2 3.65Å; V209-E211 HydrophobicContact CG1-CG 4.31Å |
| 210 | L | 75.1 | Confident | 78.6 | Confident | 51 Ų | 51 | 42.5 Ų | 42.5 | 27% | 0.267 | 26% | 0.257 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 123.1 | 176 | -60.7 | 176.5 | 0 | 0 | 0 | 108.5 | F143 V145 A194 K198 V208 | F143-L210 HydrophobicContact CD1-CB 4.24Å; V145-L210 HydrophobicContact CG2-CD2 3.86Å; A194-L210 HydrophobicContact CB-CD1 4.5Å; A194-L210 HydrophobicContact CB-CD2 3.96Å; K198-L210 HydrophobicContact CD-CD1 3.97Å; K198-L210 HydrophobicContact CD-CG 4.18Å; V208-L210 HydrophobicContact CG1-CD2 4.5Å |
| 211 | E | 69.8 | Low | 78.2 | Confident | 109 Ų | 109 | 43.8 Ų | 43.8 | 51% | 0.509 | 26% | 0.26 | S | S | . | . | trans | -122.7 | 0 | 177 | -70.7 | -170.6 | 158.2 | 0 | 0 | 113.8 | K140 F143 T144 K146 V209 | K140-E211 PolarHBondContact NZ-OXT 3.19Å; F143-E211 CarbonylContact C-O 3.57Å; F143-E211 WeakPolarHBondContact CA-O 3.35Å; T144-E211 PolarHBondContact N-O 3.26Å; T144-E211 PolarHBondContact O-N 3.25Å; T144-E211 VanDerWaalsContact O-N 3.11Å; K146-E211 WeakPolarHBondContact CD-OE2 3.13Å; K146-E211 WeakPolarHBondContact CE-OE2 3.46Å; K146-E211 IonicContact NZ-OE2 3.09Å; K146-E211 PolarHBondContact NZ-OE2 3.25Å; V209-E211 HydrophobicContact CG1-CG 4.31Å |
Retrieved 211 of 211 residues in 43.9 ms
(Link to these results)