| 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 | 36.7 | Very low | 37.1 | Very low | 233 Ų | 233 | 136.2 Ų | 136.2 | 100% | 1.148 | 84% | 0.843 | S | S | * | * | 0 | 128.6 | 0 | -75.3 | 172.6 | 171.6 | 0 | 0 | 108.1 | |||||
| 2 | T | 40 | Very low | 36.9 | Very low | 130 Ų | 130 | 142.7 Ų | 142.7 | 80% | 0.798 | 85% | 0.851 | S | S | * | * | trans | 53.6 | 104.8 | 151 | 59.1 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 3 | T | 36.4 | Very low | 36.8 | Very low | 138 Ų | 138 | 139.4 Ų | 139.4 | 85% | 0.847 | 84% | 0.839 | S | S | * | * | trans | 6 | 135 | 130.8 | 56 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 4 | A | 40.9 | Very low | 37 | Very low | 99 Ų | 99 | 137.9 Ų | 137.9 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | trans | -165 | 113 | 135.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 5 | K | 37.9 | Very low | 36.9 | Very low | 209 Ų | 209 | 139 Ų | 139 | 91% | 0.909 | 82% | 0.823 | S | S | * | * | 101 | 106.9 | 77.3 | -166.7 | 163.3 | -176.2 | 168.9 | 0 | 111.9 | |||||
| 6 | E | 37.4 | Very low | 37 | Very low | 166 Ų | 166 | 140.3 Ų | 140.3 | 78% | 0.776 | 82% | 0.818 | S | S | * | * | trans | -28.7 | 170.5 | 162.2 | -84.4 | -94.6 | 129 | 0 | 0 | 118.2 | ||||
| 7 | P | 46.6 | Very low | 37.4 | Very low | 111 Ų | 111 | 141.1 Ų | 141.1 | 72% | 0.721 | 81% | 0.812 | S | S | * | * | cis | -148.2 | 170.6 | 27.8 | 40.7 | -19.3 | 0 | 0 | 0 | 120.4 | ||||
| 8 | S | 32.9 | Very low | 37.5 | Very low | 103 Ų | 103 | 144 Ų | 144 | 72% | 0.72 | 82% | 0.817 | S | S | * | * | trans | 72.6 | 114 | 132.9 | 165.1 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 9 | A | 36.7 | Very low | 37.8 | Very low | 98 Ų | 98 | 144.5 Ų | 144.5 | 81% | 0.81 | 81% | 0.812 | S | S | * | * | -167 | 118.4 | 106.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 10 | S | 32.3 | Very low | 37.7 | Very low | 134 Ų | 134 | 145.6 Ų | 145.6 | 94% | 0.937 | 81% | 0.81 | S | S | * | * | trans | -22.6 | 136.4 | 166.2 | -161.1 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 11 | G | 30.6 | Very low | 38.1 | Very low | 77 Ų | 77 | 145.2 Ų | 145.2 | 79% | 0.794 | 81% | 0.806 | S | S | * | * | trans | 172.4 | 74.2 | 162.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 12 | K | 33.9 | Very low | 38 | Very low | 214 Ų | 214 | 141.3 Ų | 141.3 | 93% | 0.93 | 80% | 0.795 | S | S | * | * | trans | -127.8 | 145.5 | 170 | -97.8 | -175.9 | -177.4 | 177.1 | 0 | 112 | ||||
| 13 | S | 36.2 | Very low | 38.5 | Very low | 100 Ų | 100 | 139 Ų | 139 | 70% | 0.699 | 80% | 0.797 | S | S | * | * | trans | -97.2 | 157.1 | -165.8 | 53.2 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 14 | V | 40.1 | Very low | 38.9 | Very low | 118 Ų | 118 | 137.7 Ų | 137.7 | 72% | 0.715 | 79% | 0.793 | S | S | * | * | trans | 75.3 | 126 | 151.3 | -151.2 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 15 | Q | 35 | Very low | 39 | Very low | 155 Ų | 155 | 139.8 Ų | 139.8 | 72% | 0.724 | 79% | 0.791 | S | S | * | * | 152.4 | 105 | 120.3 | -76.3 | -84.8 | -27.4 | 0 | 0 | 111.3 | |||||
| 16 | Q | 39.2 | Very low | 40 | Very low | 159 Ų | 159 | 134.7 Ų | 134.7 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | 49.1 | 119.5 | 124 | -150.5 | 142.6 | -8.8 | 0 | 0 | 122 | |||||
| 17 | Q | 42.8 | Very low | 40.9 | Very low | 154 Ų | 154 | 131.7 Ų | 131.7 | 72% | 0.72 | 77% | 0.774 | S | S | * | * | trans | 98.6 | 106.9 | 134 | -159.1 | 162.9 | -5.8 | 0 | 0 | 120.2 | ||||
| 18 | E | 40.2 | Very low | 41.4 | Very low | 194 Ų | 194 | 134.3 Ų | 134.3 | 91% | 0.907 | 78% | 0.777 | S | S | * | * | trans | -142.9 | 129.6 | 138 | -120.9 | -175.7 | 117.8 | 0 | 0 | 109.5 | ||||
| 19 | Q | 42.8 | Very low | 42.8 | Very low | 154 Ų | 154 | 138.7 Ų | 138.7 | 72% | 0.72 | 78% | 0.778 | S | S | * | * | trans | -77.1 | 146.1 | 164.6 | -82 | 166.8 | -50.6 | 0 | 0 | 108.3 | ||||
| 20 | E | 35.9 | Very low | 44.5 | Very low | 165 Ų | 165 | 139.5 Ų | 139.5 | 77% | 0.771 | 77% | 0.768 | S | S | * | * | 170.3 | 114.4 | 125.1 | -80.4 | -93.6 | 113.5 | 0 | 0 | 111.1 | |||||
| 21 | L | 44.7 | Very low | 46.6 | Very low | 139 Ų | 139 | 142.5 Ų | 142.5 | 73% | 0.728 | 76% | 0.759 | S | S | * | * | trans | 44.5 | 107 | 142.8 | -73.3 | 71.8 | 0 | 0 | 0 | 121.3 | ||||
| 22 | V | 36.2 | Very low | 49 | Very low | 151 Ų | 151 | 147.4 Ų | 147.4 | 92% | 0.915 | 76% | 0.758 | S | S | * | * | -154.1 | 134.5 | 108.5 | 177.1 | 0 | 0 | 0 | 0 | 107.2 | S24 | V22-S24 PolarHBondContact O-N 3.45Š| |||
| 23 | G | 49.2 | Very low | 51.4 | Low | 81 Ų | 81 | 139 Ų | 139 | 84% | 0.835 | 73% | 0.732 | S | S | * | * | trans | -56.4 | 128.6 | -165.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 24 | S | 45.2 | Very low | 53.8 | Low | 110 Ų | 110 | 139.4 Ų | 139.4 | 77% | 0.769 | 73% | 0.726 | S | S | * | * | trans | -117.7 | 119.6 | 146 | 67.5 | 0 | 0 | 0 | 0 | 106.8 | V22 | V22-S24 PolarHBondContact O-N 3.45Š| ||
| 25 | N | 44.1 | Very low | 56 | Low | 143 Ų | 143 | 136.4 Ų | 136.4 | 77% | 0.765 | 71% | 0.714 | S | S | * | * | trans | -17.4 | 134.8 | 166.3 | -131.3 | -84.5 | 0 | 0 | 0 | 112.9 | ||||
| 26 | P | 58.1 | Low | 58.6 | Low | 103 Ų | 103 | 134.1 Ų | 134.1 | 67% | 0.669 | 71% | 0.705 | S | S | * | * | trans | -48 | 124.4 | 173 | 22.2 | -32 | 0 | 0 | 0 | 106.5 | Q28 | P26-Q28 PolarHBondContact O-N 3.21Š| ||
| 27 | P | 55.6 | Low | 61 | Low | 103 Ų | 103 | 128.9 Ų | 128.9 | 67% | 0.669 | 69% | 0.689 | S | S | * | * | trans | -51.5 | 117 | -178.3 | 20.1 | -30.5 | 0 | 0 | 0 | 104.3 | R29 | P27-R29 WeakPolarHBondContact O-CA 3.45Å; P27-R29 PolarHBondContact O-N 3.44Å | ||
| 28 | Q | 57.8 | Low | 63.3 | Low | 165 Ų | 165 | 126.5 Ų | 126.5 | 77% | 0.771 | 68% | 0.681 | S | S | * | * | trans | -59.7 | 86.2 | -178.7 | -176.3 | -179.1 | 9.3 | 0 | 0 | 104.2 | P26 N30 | P26-Q28 PolarHBondContact O-N 3.21Å; Q28-N30 VanDerWaalsContact C-N 3.3Å; Q28-N30 VanDerWaalsContact O-CG 3.32Å; Q28-N30 PolarHBondContact O-N 3.45Å; Q28-N30 PolarHBondContact O-ND2 2.89Å; Q28-N30 PolarHBondContact O-OD1 3.03Å | ||
| 29 | R | 61.4 | Low | 65.8 | Low | 196 Ų | 196 | 122.7 Ų | 122.7 | 74% | 0.74 | 67% | 0.666 | S | S | * | * | trans | -64.6 | 108.5 | -173.8 | -97.5 | -176.3 | 134.6 | 120.2 | -3.9 | 101 | P27 W31 | P27-R29 WeakPolarHBondContact O-CA 3.45Å; P27-R29 PolarHBondContact O-N 3.44Å; R29-W31 PolarHBondContact O-N 3.24Å | ||
| 30 | N | 72.2 | Confident | 68.3 | Low | 114 Ų | 114 | 118.9 Ų | 118.9 | 61% | 0.61 | 65% | 0.653 | S | S | * | * | trans | -67.5 | 75.6 | -176.2 | -63.2 | -68 | 0 | 0 | 0 | 106.6 | Q28 K32 G33 I34 | Q28-N30 VanDerWaalsContact C-N 3.3Å; Q28-N30 VanDerWaalsContact O-CG 3.32Å; Q28-N30 PolarHBondContact O-N 3.45Å; Q28-N30 PolarHBondContact O-ND2 2.89Å; Q28-N30 PolarHBondContact O-OD1 3.03Å; N30-K32 PolarHBondContact O-N 3.06Å; N30-G33 CarbonylContact O-C 3.5Å; N30-G33 WeakPolarHBondContact O-CA 3.45Å; N30-G33 PolarHBondContact O-N 3.45Å; N30-I34 PolarHBondContact O-N 2.8Å | ||
| 31 | W | 78.3 | Confident | 71.1 | Confident | 198 Ų | 198 | 115.7 Ų | 115.7 | 75% | 0.75 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -61 | -29 | -180 | -66.9 | -13.6 | 0 | 0 | 0 | 109.8 | R29 I34 A35 | R29-W31 PolarHBondContact O-N 3.24Å; W31-I34 WeakPolarHBondContact O-CG2 3.49Å; W31-A35 WeakPolarHBondContact O-CB 3.39Å; W31-A35 PolarHBondContact O-N 2.8Å |
| 32 | K | 80.3 | Confident | 73.3 | Confident | 179 Ų | 179 | 115 Ų | 115 | 78% | 0.778 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -63.5 | -45.9 | 167.3 | -76.7 | 175.7 | 169.2 | 175 | 0 | 112 | N30 A35 I36 | N30-K32 PolarHBondContact O-N 3.06Å; K32-A35 PolarHBondContact O-N 3.24Å; K32-I36 VanDerWaalsContact O-CD1 3.28Å; K32-I36 WeakPolarHBondContact O-CD1 3.48Å; K32-I36 WeakPolarHBondContact O-CG1 3.36Å; K32-I36 PolarHBondContact O-N 2.56Å |
| 33 | G | 84.5 | Confident | 76.2 | Confident | 37 Ų | 37 | 111.5 Ų | 111.5 | 38% | 0.381 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -66.5 | -42.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | N30 I36 A37 | N30-G33 CarbonylContact O-C 3.5Å; N30-G33 WeakPolarHBondContact O-CA 3.45Å; N30-G33 PolarHBondContact O-N 3.45Å; G33-I36 PolarHBondContact O-N 2.9Å; G33-A37 WeakPolarHBondContact O-CB 3.13Å; G33-A37 PolarHBondContact O-N 2.95Å |
| 34 | I | 86.4 | Confident | 78.4 | Confident | 109 Ų | 109 | 112 Ų | 112 | 56% | 0.559 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.1 | -38.9 | 176.9 | -155.2 | 78.6 | 0 | 0 | 0 | 111 | N30 W31 A37 L38 | N30-I34 PolarHBondContact O-N 2.8Å; W31-I34 WeakPolarHBondContact O-CG2 3.49Å; I34-A37 PolarHBondContact O-N 3.26Å; I34-L38 WeakPolarHBondContact O-CB 3.3Å; I34-L38 VanDerWaalsContact O-CG 3.25Å; I34-L38 WeakPolarHBondContact O-CG 3.28Å; I34-L38 PolarHBondContact O-N 3.07Å |
| 35 | A | 86.1 | Confident | 80.7 | Confident | 56 Ų | 56 | 109.8 Ų | 109.8 | 46% | 0.463 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -65.8 | -41.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | W31 K32 L38 L39 | W31-A35 WeakPolarHBondContact O-CB 3.39Å; W31-A35 PolarHBondContact O-N 2.8Å; K32-A35 PolarHBondContact O-N 3.24Å; A35-L38 PolarHBondContact O-N 3.3Å; A35-L39 WeakPolarHBondContact O-CB 3.29Å; A35-L39 PolarHBondContact O-N 3.44Å |
| 36 | I | 90.3 | Very high | 83 | Confident | 107 Ų | 107 | 105.8 Ų | 105.8 | 55% | 0.549 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -65.8 | -44 | 176.9 | -66.5 | 160.8 | 0 | 0 | 0 | 110.5 | K32 G33 L38 L39 V40 | K32-I36 VanDerWaalsContact O-CD1 3.28Å; K32-I36 WeakPolarHBondContact O-CD1 3.48Å; K32-I36 WeakPolarHBondContact O-CG1 3.36Å; K32-I36 PolarHBondContact O-N 2.56Å; G33-I36 PolarHBondContact O-N 2.9Å; I36-L38 VanDerWaalsContact C-N 3.34Å; I36-L38 PolarHBondContact O-N 3.33Å; I36-L39 PolarHBondContact O-N 3.26Å; I36-V40 WeakPolarHBondContact O-CG2 3.16Å; I36-V40 PolarHBondContact O-N 3.01Å; I36-V40 VanDerWaalsContact O-N 3.07Å |
| 37 | A | 89.6 | Confident | 84.6 | Confident | 49 Ų | 49 | 106.2 Ų | 106.2 | 41% | 0.405 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.6 | -43.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | G33 I34 V40 I41 | G33-A37 WeakPolarHBondContact O-CB 3.13Å; G33-A37 PolarHBondContact O-N 2.95Å; I34-A37 PolarHBondContact O-N 3.26Å; A37-V40 PolarHBondContact O-N 2.99Å; A37-I41 WeakPolarHBondContact O-CD1 3.19Å; A37-I41 VanDerWaalsContact O-CG1 3.29Å; A37-I41 WeakPolarHBondContact O-CG1 3.4Å; A37-I41 PolarHBondContact O-N 3.42Å; A37-I41 VanDerWaalsContact O-N 3.15Å |
| 38 | L | 90.6 | Very high | 86.4 | Confident | 103 Ų | 103 | 106 Ų | 106 | 54% | 0.539 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -65 | -40.2 | 177.1 | -71.7 | 174.3 | 0 | 0 | 0 | 112.5 | I34 A35 I36 I41 L42 | I34-L38 WeakPolarHBondContact O-CB 3.3Å; I34-L38 VanDerWaalsContact O-CG 3.25Å; I34-L38 WeakPolarHBondContact O-CG 3.28Å; I34-L38 PolarHBondContact O-N 3.07Å; A35-L38 PolarHBondContact O-N 3.3Å; I36-L38 VanDerWaalsContact C-N 3.34Å; I36-L38 PolarHBondContact O-N 3.33Å; L38-I41 PolarHBondContact O-N 3.04Å; L38-L42 WeakPolarHBondContact O-CG 3.19Å; L38-L42 PolarHBondContact O-N 2.84Å; L38-L42 VanDerWaalsContact O-N 3.12Å |
| 39 | L | 91.6 | Very high | 87.9 | Confident | 115 Ų | 115 | 102.1 Ų | 102.1 | 60% | 0.602 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -60.6 | -46.8 | 176.6 | -172.1 | 92.8 | 0 | 0 | 0 | 111.3 | A35 I36 I41 L42 V43 | A35-L39 WeakPolarHBondContact O-CB 3.29Å; A35-L39 PolarHBondContact O-N 3.44Å; I36-L39 PolarHBondContact O-N 3.26Å; L39-I41 VanDerWaalsContact C-N 3.35Å; L39-I41 PolarHBondContact O-N 3.45Å; L39-L42 PolarHBondContact O-N 3.23Å; L39-V43 WeakPolarHBondContact O-CG2 3.33Å; L39-V43 PolarHBondContact O-N 3.31Å; L39-V43 VanDerWaalsContact O-N 3.1Å |
| 40 | V | 95.6 | Very high | 89.2 | Confident | 74 Ų | 74 | 96.3 Ų | 96.3 | 45% | 0.448 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.4 | -41.3 | -178 | 173.9 | 0 | 0 | 0 | 0 | 111.1 | I36 A37 L42 V43 I44 | I36-V40 WeakPolarHBondContact O-CG2 3.16Å; I36-V40 PolarHBondContact O-N 3.01Å; I36-V40 VanDerWaalsContact O-N 3.07Å; A37-V40 PolarHBondContact O-N 2.99Å; V40-L42 PolarHBondContact O-N 3.42Å; V40-V43 PolarHBondContact O-N 3.01Å; V40-I44 HydrophobicContact CG1-CD1 3.83Å; V40-I44 HydrophobicContact CG1-CG1 4.49Å; V40-I44 WeakPolarHBondContact O-CG1 3.32Å; V40-I44 PolarHBondContact O-N 3.32Å |
| 41 | I | 94.6 | Very high | 90 | Very high | 97 Ų | 97 | 93.5 Ų | 93.5 | 50% | 0.497 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61 | -45.1 | 176 | -67.3 | 163.9 | 0 | 0 | 0 | 110.8 | A37 L38 L39 V43 I44 C45 | A37-I41 WeakPolarHBondContact O-CD1 3.19Å; A37-I41 VanDerWaalsContact O-CG1 3.29Å; A37-I41 WeakPolarHBondContact O-CG1 3.4Å; A37-I41 PolarHBondContact O-N 3.42Å; A37-I41 VanDerWaalsContact O-N 3.15Å; L38-I41 PolarHBondContact O-N 3.04Å; L39-I41 VanDerWaalsContact C-N 3.35Å; L39-I41 PolarHBondContact O-N 3.45Å; I41-V43 VanDerWaalsContact C-N 3.32Å; I41-V43 PolarHBondContact O-N 2.91Å; I41-I44 PolarHBondContact O-N 3.1Å; I41-C45 VanDerWaalsContact O-CB 3.32Å; I41-C45 WeakPolarHBondContact O-CB 3.36Å; I41-C45 PolarHBondContact O-N 3.07Å; I41-C45 PolarHBondContact O-SG 2.88Å |
| 42 | L | 92.7 | Very high | 90.5 | Very high | 125 Ų | 125 | 87.9 Ų | 87.9 | 65% | 0.654 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.2 | -39.8 | 178.6 | -73.5 | 177.6 | 0 | 0 | 0 | 112.7 | L38 L39 V40 S46 | L38-L42 WeakPolarHBondContact O-CG 3.19Å; L38-L42 PolarHBondContact O-N 2.84Å; L38-L42 VanDerWaalsContact O-N 3.12Å; L39-L42 PolarHBondContact O-N 3.23Å; V40-L42 PolarHBondContact O-N 3.42Å; L42-S46 WeakPolarHBondContact O-CB 3.28Å; L42-S46 PolarHBondContact O-N 3.26Å; L42-S46 PolarHBondContact O-OG 2.64Å |
| 43 | V | 95.3 | Very high | 90.5 | Very high | 77 Ų | 77 | 84.4 Ų | 84.4 | 47% | 0.467 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -66.4 | -44.4 | 177.3 | 173.8 | 0 | 0 | 0 | 0 | 111.2 | L39 V40 I41 S46 L47 | L39-V43 WeakPolarHBondContact O-CG2 3.33Å; L39-V43 PolarHBondContact O-N 3.31Å; L39-V43 VanDerWaalsContact O-N 3.1Å; V40-V43 PolarHBondContact O-N 3.01Å; I41-V43 VanDerWaalsContact C-N 3.32Å; I41-V43 PolarHBondContact O-N 2.91Å; V43-S46 PolarHBondContact O-N 3.42Å; V43-S46 PolarHBondContact O-OG 3.06Å; V43-L47 HydrophobicContact CG1-CD1 4.24Å; V43-L47 VanDerWaalsContact O-CG 3.28Å; V43-L47 WeakPolarHBondContact O-CG 3.25Å; V43-L47 PolarHBondContact O-N 3.4Å |
| 44 | I | 96.2 | Very high | 90 | Very high | 91 Ų | 91 | 88.8 Ų | 88.8 | 47% | 0.467 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -66.9 | -43.4 | 178.6 | -65.5 | 169.4 | 0 | 0 | 0 | 110.4 | V40 I41 S46 L47 I48 | V40-I44 HydrophobicContact CG1-CD1 3.83Å; V40-I44 HydrophobicContact CG1-CG1 4.49Å; V40-I44 WeakPolarHBondContact O-CG1 3.32Å; V40-I44 PolarHBondContact O-N 3.32Å; I41-I44 PolarHBondContact O-N 3.1Å; I44-S46 VanDerWaalsContact C-N 3.33Å; I44-S46 PolarHBondContact O-N 2.87Å; I44-L47 PolarHBondContact O-N 3.27Å; I44-I48 HydrophobicContact CG2-CD1 3.86Å; I44-I48 HydrophobicContact CG2-CG1 4.42Å; I44-I48 VanDerWaalsContact O-CG1 3.3Å; I44-I48 WeakPolarHBondContact O-CG1 3.46Å; I44-I48 PolarHBondContact O-N 3.12Å |
| 45 | C | 93.7 | Very high | 89.6 | Confident | 65 Ų | 65 | 90.1 Ų | 90.1 | 44% | 0.439 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.7 | -41.3 | 176.7 | -73.5 | 0 | 0 | 0 | 0 | 112.1 | I41 I48 V49 | I41-C45 VanDerWaalsContact O-CB 3.32Å; I41-C45 WeakPolarHBondContact O-CB 3.36Å; I41-C45 PolarHBondContact O-N 3.07Å; I41-C45 PolarHBondContact O-SG 2.88Å; C45-I48 PolarHBondContact O-N 3.47Å; C45-V49 WeakPolarHBondContact O-CG2 3.39Å; C45-V49 PolarHBondContact O-N 3.43Å |
| 46 | S | 92.9 | Very high | 89 | Confident | 59 Ų | 59 | 91.9 Ų | 91.9 | 41% | 0.413 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | 176.8 | 72.3 | 0 | 0 | 0 | 0 | 111.5 | L42 V43 I44 I48 V49 T50 | L42-S46 WeakPolarHBondContact O-CB 3.28Å; L42-S46 PolarHBondContact O-N 3.26Å; L42-S46 PolarHBondContact O-OG 2.64Å; V43-S46 PolarHBondContact O-N 3.42Å; V43-S46 PolarHBondContact O-OG 3.06Å; I44-S46 VanDerWaalsContact C-N 3.33Å; I44-S46 PolarHBondContact O-N 2.87Å; S46-I48 VanDerWaalsContact C-N 3.33Å; S46-I48 PolarHBondContact O-N 3.46Å; S46-V49 PolarHBondContact O-N 2.97Å; S46-T50 WeakPolarHBondContact O-CB 3.45Å; S46-T50 PolarHBondContact O-N 3.41Å; S46-T50 PolarHBondContact O-OG1 3.48Å; S46-T50 VanDerWaalsContact O-OG1 3.04Å |
| 47 | L | 90.9 | Very high | 87.6 | Confident | 112 Ų | 112 | 89.2 Ų | 89.2 | 59% | 0.586 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.5 | -40 | 175.6 | -70.4 | 173.9 | 0 | 0 | 0 | 112.3 | V43 I44 S51 | V43-L47 HydrophobicContact CG1-CD1 4.24Å; V43-L47 VanDerWaalsContact O-CG 3.28Å; V43-L47 WeakPolarHBondContact O-CG 3.25Å; V43-L47 PolarHBondContact O-N 3.4Å; I44-L47 PolarHBondContact O-N 3.27Å; L47-S51 WeakPolarHBondContact O-CB 3.12Å; L47-S51 PolarHBondContact O-N 3.45Å |
| 48 | I | 93.9 | Very high | 86.2 | Confident | 97 Ų | 97 | 90.3 Ų | 90.3 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.7 | -48.7 | 175.4 | -66 | 165.3 | 0 | 0 | 0 | 110.3 | I44 C45 S46 S51 V52 | I44-I48 HydrophobicContact CG2-CD1 3.86Å; I44-I48 HydrophobicContact CG2-CG1 4.42Å; I44-I48 VanDerWaalsContact O-CG1 3.3Å; I44-I48 WeakPolarHBondContact O-CG1 3.46Å; I44-I48 PolarHBondContact O-N 3.12Å; C45-I48 PolarHBondContact O-N 3.47Å; S46-I48 VanDerWaalsContact C-N 3.33Å; S46-I48 PolarHBondContact O-N 3.46Å; I48-S51 PolarHBondContact O-N 3.24Å; I48-V52 HydrophobicContact CG2-CG2 4.38Å; I48-V52 VanDerWaalsContact O-CG2 3.28Å; I48-V52 WeakPolarHBondContact O-CG2 3.46Å; I48-V52 PolarHBondContact O-N 3.15Å |
| 49 | V | 90.2 | Very high | 84.6 | Confident | 84 Ų | 84 | 91.4 Ų | 91.4 | 51% | 0.509 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.8 | -47 | -179.7 | 172.6 | 0 | 0 | 0 | 0 | 111.2 | C45 S46 S51 V52 I53 | C45-V49 WeakPolarHBondContact O-CG2 3.39Å; C45-V49 PolarHBondContact O-N 3.43Å; S46-V49 PolarHBondContact O-N 2.97Å; V49-S51 VanDerWaalsContact C-N 3.32Å; V49-S51 PolarHBondContact O-N 2.83Å; V49-V52 PolarHBondContact O-N 2.83Å; V49-I53 HydrophobicContact CG1-CD1 3.75Å; V49-I53 VanDerWaalsContact O-CG1 3.28Å; V49-I53 WeakPolarHBondContact O-CG1 3.28Å; V49-I53 PolarHBondContact O-N 2.84Å |
| 50 | T | 87.3 | Confident | 82.7 | Confident | 75 Ų | 75 | 90.5 Ų | 90.5 | 46% | 0.46 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.8 | -41 | 175.5 | -58.5 | 0 | 0 | 0 | 0 | 111 | S46 V52 I53 L54 | S46-T50 WeakPolarHBondContact O-CB 3.45Å; S46-T50 PolarHBondContact O-N 3.41Å; S46-T50 PolarHBondContact O-OG1 3.48Å; S46-T50 VanDerWaalsContact O-OG1 3.04Å; T50-V52 PolarHBondContact O-N 2.97Å; T50-I53 PolarHBondContact O-N 2.78Å; T50-L54 HydrophobicContact CG2-CD1 3.83Å; T50-L54 HydrophobicContact CG2-CG 4.23Å; T50-L54 WeakPolarHBondContact O-CB 3.39Å; T50-L54 VanDerWaalsContact O-CG 3.25Å; T50-L54 WeakPolarHBondContact O-CG 3.33Å; T50-L54 PolarHBondContact O-N 3.41Å |
| 51 | S | 89 | Confident | 80.5 | Confident | 55 Ų | 55 | 93 Ų | 93 | 39% | 0.385 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.4 | -39.1 | 175.5 | -173.3 | 0 | 0 | 0 | 0 | 112.1 | L47 I48 V49 L54 L55 | L47-S51 WeakPolarHBondContact O-CB 3.12Å; L47-S51 PolarHBondContact O-N 3.45Å; I48-S51 PolarHBondContact O-N 3.24Å; V49-S51 VanDerWaalsContact C-N 3.32Å; V49-S51 PolarHBondContact O-N 2.83Å; S51-L54 PolarHBondContact O-N 3.34Å; S51-L55 WeakPolarHBondContact O-CB 3.14Å; S51-L55 WeakPolarHBondContact O-CD1 3.09Å; S51-L55 WeakPolarHBondContact O-CG 3.45Å; S51-L55 PolarHBondContact O-N 3.49Å; S51-L55 WeakPolarHBondContact OG-CD1 3.21Å |
| 52 | V | 88.9 | Confident | 78.5 | Confident | 80 Ų | 80 | 91.6 Ų | 91.6 | 49% | 0.485 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.9 | -38.6 | 176.8 | 170.3 | 0 | 0 | 0 | 0 | 111.1 | I48 V49 T50 T56 | I48-V52 HydrophobicContact CG2-CG2 4.38Å; I48-V52 VanDerWaalsContact O-CG2 3.28Å; I48-V52 WeakPolarHBondContact O-CG2 3.46Å; I48-V52 PolarHBondContact O-N 3.15Å; V49-V52 PolarHBondContact O-N 2.83Å; T50-V52 PolarHBondContact O-N 2.97Å; V52-T56 WeakPolarHBondContact O-CA 3.47Å; V52-T56 WeakPolarHBondContact O-CB 3.25Å; V52-T56 PolarHBondContact O-N 3.27Å; V52-T56 PolarHBondContact O-OG1 3.01Å |
| 53 | I | 80.3 | Confident | 76.6 | Confident | 106 Ų | 106 | 89.8 Ų | 89.8 | 54% | 0.544 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -72.6 | -32.2 | 176.6 | -64.2 | 166.7 | 0 | 0 | 0 | 111.7 | V49 T50 T56 | V49-I53 HydrophobicContact CG1-CD1 3.75Å; V49-I53 VanDerWaalsContact O-CG1 3.28Å; V49-I53 WeakPolarHBondContact O-CG1 3.28Å; V49-I53 PolarHBondContact O-N 2.84Å; T50-I53 PolarHBondContact O-N 2.78Å; I53-T56 CarbonylContact O-C 3.6Å; I53-T56 VanDerWaalsContact O-C 3.24Å |
| 54 | L | 74.6 | Confident | 74.5 | Confident | 128 Ų | 128 | 90.8 Ų | 90.8 | 67% | 0.67 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -78.7 | -34.9 | 174.8 | -72.4 | 175.4 | 0 | 0 | 0 | 112.6 | T50 S51 P57 | T50-L54 HydrophobicContact CG2-CD1 3.83Å; T50-L54 HydrophobicContact CG2-CG 4.23Å; T50-L54 WeakPolarHBondContact O-CB 3.39Å; T50-L54 VanDerWaalsContact O-CG 3.25Å; T50-L54 WeakPolarHBondContact O-CG 3.33Å; T50-L54 PolarHBondContact O-N 3.41Å; S51-L54 PolarHBondContact O-N 3.34Å; L54-P57 WeakPolarHBondContact O-CD 3.47Å |
| 55 | L | 78.5 | Confident | 72.5 | Confident | 137 Ų | 137 | 94.8 Ų | 94.8 | 72% | 0.717 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -80.8 | -23.8 | 176.8 | -71.6 | 170.6 | 0 | 0 | 0 | 112.6 | S51 P57 | S51-L55 WeakPolarHBondContact O-CB 3.14Å; S51-L55 WeakPolarHBondContact O-CD1 3.09Å; S51-L55 WeakPolarHBondContact O-CG 3.45Å; S51-L55 PolarHBondContact O-N 3.49Å; S51-L55 WeakPolarHBondContact OG-CD1 3.21Å; L55-P57 WeakPolarHBondContact O-CD 3.34Å |
| 56 | T | 73.6 | Confident | 70.8 | Confident | 93 Ų | 93 | 98.1 Ų | 98.1 | 57% | 0.571 | 55% | 0.55 | S | S | * | * | S | Bend | trans | -109.2 | 69.5 | 165.1 | -35.9 | 0 | 0 | 0 | 0 | 106.3 | V52 I53 A58 | V52-T56 WeakPolarHBondContact O-CA 3.47Å; V52-T56 WeakPolarHBondContact O-CB 3.25Å; V52-T56 PolarHBondContact O-N 3.27Å; V52-T56 PolarHBondContact O-OG1 3.01Å; I53-T56 CarbonylContact O-C 3.6Å; I53-T56 VanDerWaalsContact O-C 3.24Å; T56-A58 PolarHBondContact O-N 3.42Å |
| 57 | P | 61 | Low | 69.7 | Low | 52 Ų | 52 | 102.1 Ų | 102.1 | 34% | 0.338 | 56% | 0.56 | S | S | . | * | trans | -54.6 | 115.3 | 173.8 | 27.9 | -34.4 | 0 | 0 | 0 | 106 | L54 L55 E59 | L54-P57 WeakPolarHBondContact O-CD 3.47Å; L55-P57 WeakPolarHBondContact O-CD 3.34Å; P57-E59 HydrophobicContact CB-CG 3.92Å; P57-E59 WeakPolarHBondContact CB-OE1 3.28Å; P57-E59 HydrophobicContact CG-CG 4.29Å; P57-E59 WeakPolarHBondContact CG-OE1 3.2Å; P57-E59 PolarHBondContact O-N 2.83Å | ||
| 58 | A | 59.4 | Low | 69 | Low | 71 Ų | 71 | 105.7 Ų | 105.7 | 59% | 0.587 | 57% | 0.571 | S | S | * | * | trans | -72.6 | 67.4 | 174.6 | 0 | 0 | 0 | 0 | 0 | 107.3 | T56 D60 | T56-A58 PolarHBondContact O-N 3.42Å; A58-D60 PolarHBondContact O-N 3.37Å; A58-D60 VanDerWaalsContact O-N 3.11Å | ||
| 59 | E | 56.4 | Low | 68.2 | Low | 127 Ų | 127 | 105.7 Ų | 105.7 | 59% | 0.593 | 58% | 0.575 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.3 | -7.5 | 174.7 | -75.1 | 144.9 | 176.9 | 0 | 0 | 111 | P57 S62 | P57-E59 HydrophobicContact CB-CG 3.92Å; P57-E59 WeakPolarHBondContact CB-OE1 3.28Å; P57-E59 HydrophobicContact CG-CG 4.29Å; P57-E59 WeakPolarHBondContact CG-OE1 3.2Å; P57-E59 PolarHBondContact O-N 2.83Å; E59-S62 PolarHBondContact O-OG 2.94Å |
| 60 | D | 51.3 | Low | 67.7 | Low | 96 Ų | 96 | 104.3 Ų | 104.3 | 51% | 0.513 | 57% | 0.567 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -109.6 | -17.8 | -160.5 | -40.9 | -22.2 | 0 | 0 | 0 | 113.6 | A58 S62 L63 S64 | A58-D60 PolarHBondContact O-N 3.37Å; A58-D60 VanDerWaalsContact O-N 3.11Å; D60-S62 PolarHBondContact O-N 3.26Å; D60-L63 WeakPolarHBondContact O-CA 3.36Å; D60-L63 WeakPolarHBondContact O-CB 3.48Å; D60-L63 PolarHBondContact O-N 2.95Å; D60-S64 PolarHBondContact O-N 3.04Å; D60-S64 VanDerWaalsContact O-N 3.14Å; D60-S64 PolarHBondContact O-OG 3.43Å |
| 61 | N | 49.9 | Very low | 67.3 | Low | 127 Ų | 127 | 105.1 Ų | 105.1 | 68% | 0.679 | 57% | 0.572 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.6 | -13.3 | 177.2 | -87 | -20.6 | 0 | 0 | 0 | 112.9 | ||
| 62 | S | 52 | Low | 66.8 | Low | 66 Ų | 66 | 108.5 Ų | 108.5 | 46% | 0.462 | 58% | 0.582 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -80.2 | -26.4 | 164.6 | 78.9 | 0 | 0 | 0 | 0 | 112.5 | E59 D60 Q65 K66 | E59-S62 PolarHBondContact O-OG 2.94Å; D60-S62 PolarHBondContact O-N 3.26Å; S62-Q65 PolarHBondContact O-N 2.97Å; S62-K66 PolarHBondContact O-N 2.86Å |
| 63 | L | 53 | Low | 66.3 | Low | 87 Ų | 87 | 105.2 Ų | 105.2 | 46% | 0.455 | 56% | 0.561 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -75.2 | -29.6 | 177.6 | -58.9 | -178.6 | 0 | 0 | 0 | 111.8 | D60 Q65 K66 | D60-L63 WeakPolarHBondContact O-CA 3.36Å; D60-L63 WeakPolarHBondContact O-CB 3.48Å; D60-L63 PolarHBondContact O-N 2.95Å; L63-Q65 PolarHBondContact O-N 3.45Å; L63-K66 HydrophobicContact CD2-CD 3.61Å; L63-K66 PolarHBondContact O-N 2.81Å; L63-K66 VanDerWaalsContact O-N 3.08Å |
| 64 | S | 51.6 | Low | 66.1 | Low | 98 Ų | 98 | 105.4 Ų | 105.4 | 69% | 0.685 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -64 | -22.9 | 172 | -56.9 | 0 | 0 | 0 | 0 | 113.2 | D60 | D60-S64 PolarHBondContact O-N 3.04Å; D60-S64 VanDerWaalsContact O-N 3.14Å; D60-S64 PolarHBondContact O-OG 3.43Å |
| 65 | Q | 54.2 | Low | 66.3 | Low | 176 Ų | 176 | 107.7 Ų | 107.7 | 82% | 0.822 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -97.3 | -10 | 171.3 | -75.6 | -174.6 | -4.1 | 0 | 0 | 113.6 | S62 L63 K67 | S62-Q65 PolarHBondContact O-N 2.97Å; L63-Q65 PolarHBondContact O-N 3.45Å; Q65-K67 PolarHBondContact O-N 3.23Å |
| 66 | K | 59 | Low | 66.2 | Low | 134 Ų | 134 | 102.9 Ų | 102.9 | 58% | 0.583 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -72.3 | 114.7 | 169.5 | -74.1 | -175.7 | -167.7 | 169 | 0 | 107.8 | S62 L63 K68 | S62-K66 PolarHBondContact O-N 2.86Å; L63-K66 HydrophobicContact CD2-CD 3.61Å; L63-K66 PolarHBondContact O-N 2.81Å; L63-K66 VanDerWaalsContact O-N 3.08Å; K66-K68 PolarHBondContact O-N 2.74Å; K66-K68 VanDerWaalsContact O-N 3.1Å |
| 67 | K | 69.1 | Low | 66.2 | Low | 143 Ų | 143 | 106.8 Ų | 106.8 | 62% | 0.622 | 56% | 0.557 | S | S | * | * | trans | -42.2 | 118.6 | 173 | -175.9 | -171.1 | 173.7 | -155.3 | 0 | 108.8 | Q65 V69 D73 | Q65-K67 PolarHBondContact O-N 3.23Å; K67-V69 PolarHBondContact O-N 3.22Å; K67-D73 IonicContact NZ-OD1 3.91Å; K67-D73 PolarHBondContact NZ-OD1 3.14Å | ||
| 68 | K | 75.3 | Confident | 66.7 | Low | 188 Ų | 188 | 111.3 Ų | 111.3 | 82% | 0.817 | 58% | 0.579 | S | S | * | * | trans | -58.3 | 132.1 | 172.1 | -67.1 | -179.5 | 179.9 | 179.2 | 0 | 107.5 | K66 T70 | K66-K68 PolarHBondContact O-N 2.74Å; K66-K68 VanDerWaalsContact O-N 3.1Å; K68-T70 WeakPolarHBondContact O-CG2 3.36Å; K68-T70 PolarHBondContact O-N 3.45Å | ||
| 69 | V | 77.3 | Confident | 67.3 | Low | 97 Ų | 97 | 112.9 Ų | 112.9 | 59% | 0.588 | 57% | 0.572 | S | S | * | * | trans | -58.7 | 113.5 | 177.8 | -179.9 | 0 | 0 | 0 | 0 | 107.8 | K67 D73 L74 | K67-V69 PolarHBondContact O-N 3.22Å; V69-D73 HydrophobicContact CG1-CB 4.08Å; V69-L74 HydrophobicContact CG1-CD2 4.22Å | ||
| 70 | T | 79.6 | Confident | 68.2 | Low | 54 Ų | 54 | 114.6 Ų | 114.6 | 33% | 0.331 | 58% | 0.578 | S | S | . | * | trans | -96.1 | 169.1 | 176.8 | 69.8 | 0 | 0 | 0 | 0 | 110.1 | K68 E72 D73 L74 | K68-T70 WeakPolarHBondContact O-CG2 3.36Å; K68-T70 PolarHBondContact O-N 3.45Å; T70-E72 WeakPolarHBondContact CB-OE2 3.43Å; T70-E72 PolarHBondContact O-N 3.34Å; T70-E72 PolarHBondContact OG1-OE2 3.25Å; T70-D73 WeakPolarHBondContact O-CB 3.12Å; T70-D73 PolarHBondContact O-N 3.18Å; T70-D73 VanDerWaalsContact O-N 3.08Å; T70-L74 PolarHBondContact O-N 2.96Å | ||
| 71 | V | 80.2 | Confident | 69.3 | Low | 92 Ų | 92 | 117.6 Ų | 117.6 | 56% | 0.558 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -64.9 | -30.9 | -178.2 | -155.6 | 0 | 0 | 0 | 0 | 110.8 | D73 L74 F75 | V71-D73 VanDerWaalsContact C-N 3.28Å; V71-D73 PolarHBondContact O-N 3.11Å; V71-L74 HydrophobicContact CG1-CD1 4.46Å; V71-L74 WeakPolarHBondContact O-CB 3.41Å; V71-L74 PolarHBondContact O-N 3.38Å; V71-F75 HydrophobicContact CG1-CE2 4.32Å; V71-F75 VanDerWaalsContact O-CD2 3.26Å; V71-F75 WeakPolarHBondContact O-CD2 3.13Å |
| 72 | E | 78.1 | Confident | 70.6 | Confident | 127 Ų | 127 | 114.9 Ų | 114.9 | 59% | 0.593 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -68 | -30.6 | 176.3 | -55.6 | 70.8 | -148 | 0 | 0 | 111.6 | T70 L74 F75 S76 | T70-E72 WeakPolarHBondContact CB-OE2 3.43Å; T70-E72 PolarHBondContact O-N 3.34Å; T70-E72 PolarHBondContact OG1-OE2 3.25Å; E72-L74 VanDerWaalsContact C-N 3.3Å; E72-L74 PolarHBondContact O-N 3.31Å; E72-F75 PolarHBondContact O-N 3.4Å; E72-S76 PolarHBondContact O-N 3.31Å; E72-S76 VanDerWaalsContact O-N 3.09Å; E72-S76 PolarHBondContact O-OG 3.36Å |
| 73 | D | 77.1 | Confident | 71.9 | Confident | 11 Ų | 11 | 116.8 Ų | 116.8 | 6% | 0.059 | 58% | 0.58 | C | S | . | * | H | α-helix | trans | -64 | -37.3 | 175.6 | -134.4 | 39.2 | 0 | 0 | 0 | 110.6 | K67 V69 T70 V71 F75 S76 F79 | K67-D73 IonicContact NZ-OD1 3.91Å; K67-D73 PolarHBondContact NZ-OD1 3.14Å; V69-D73 HydrophobicContact CG1-CB 4.08Å; T70-D73 WeakPolarHBondContact O-CB 3.12Å; T70-D73 PolarHBondContact O-N 3.18Å; T70-D73 VanDerWaalsContact O-N 3.08Å; V71-D73 VanDerWaalsContact C-N 3.28Å; V71-D73 PolarHBondContact O-N 3.11Å; D73-F75 PolarHBondContact O-N 3.08Å; D73-S76 WeakPolarHBondContact O-CB 3.05Å; D73-S76 PolarHBondContact O-N 2.97Å; D73-S76 VanDerWaalsContact O-N 3.08Å; D73-F79 HydrophobicContact CB-CD2 4.23Å; D73-F79 HydrophobicContact CB-CE2 4.11Å; D73-F79 WeakPolarHBondContact O-CB 3.49Å; D73-F79 WeakPolarHBondContact O-CD2 3.19Å; D73-F79 WeakPolarHBondContact O-CG 3.35Å; D73-F79 WeakPolarHBondContact OD1-CE2 2.97Å; D73-F79 WeakPolarHBondContact OD2-CE2 3.42Å; D73-F79 WeakPolarHBondContact OD2-CZ 3.33Å |
| 74 | L | 77.8 | Confident | 72.9 | Confident | 109 Ų | 109 | 115.1 Ų | 115.1 | 57% | 0.571 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -64.2 | -26.3 | 178.2 | -60.6 | 176.2 | 0 | 0 | 0 | 113.5 | V69 T70 V71 E72 | V69-L74 HydrophobicContact CG1-CD2 4.22Å; T70-L74 PolarHBondContact O-N 2.96Å; V71-L74 HydrophobicContact CG1-CD1 4.46Å; V71-L74 WeakPolarHBondContact O-CB 3.41Å; V71-L74 PolarHBondContact O-N 3.38Å; E72-L74 VanDerWaalsContact C-N 3.3Å; E72-L74 PolarHBondContact O-N 3.31Å |
| 75 | F | 78.3 | Confident | 74.3 | Confident | 177 Ų | 177 | 115.3 Ų | 115.3 | 78% | 0.776 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.1 | -1.9 | 176.8 | -61 | -73.1 | 0 | 0 | 0 | 112.9 | V71 E72 D73 | V71-F75 HydrophobicContact CG1-CE2 4.32Å; V71-F75 VanDerWaalsContact O-CD2 3.26Å; V71-F75 WeakPolarHBondContact O-CD2 3.13Å; E72-F75 PolarHBondContact O-N 3.4Å; D73-F75 PolarHBondContact O-N 3.08Å |
| 76 | S | 76.3 | Confident | 75.8 | Confident | 36 Ų | 36 | 109.9 Ų | 109.9 | 25% | 0.252 | 55% | 0.55 | S | S | . | * | S | Bend | trans | -69.9 | 147.4 | 177 | -64.6 | 0 | 0 | 0 | 0 | 110.1 | E72 D73 D78 F79 K80 | E72-S76 PolarHBondContact O-N 3.31Å; E72-S76 VanDerWaalsContact O-N 3.09Å; E72-S76 PolarHBondContact O-OG 3.36Å; D73-S76 WeakPolarHBondContact O-CB 3.05Å; D73-S76 PolarHBondContact O-N 2.97Å; D73-S76 VanDerWaalsContact O-N 3.08Å; S76-D78 PolarHBondContact O-N 3.3Å; S76-D78 VanDerWaalsContact O-N 3.14Å; S76-F79 PolarHBondContact O-N 3.09Å; S76-F79 VanDerWaalsContact O-N 3.16Å; S76-K80 PolarHBondContact O-N 3.1Å |
| 77 | E | 72.8 | Confident | 77.1 | Confident | 175 Ų | 175 | 109 Ų | 109 | 82% | 0.818 | 55% | 0.546 | S | S | * | . | G | 310 helix | trans | -58.4 | -27.6 | 178.6 | -68.1 | -168.7 | 142.8 | 0 | 0 | 112.1 | F79 K80 | E77-F79 VanDerWaalsContact C-N 3.35Å; E77-F79 PolarHBondContact O-N 3.37Å; E77-K80 WeakPolarHBondContact O-CB 3.26Å; E77-K80 PolarHBondContact O-N 3.08Å |
| 78 | D | 71.6 | Confident | 78 | Confident | 147 Ų | 147 | 109.6 Ų | 109.6 | 79% | 0.786 | 55% | 0.545 | S | S | * | . | G | 310 helix | trans | -65.4 | -32.4 | 179.3 | -59.1 | -34.6 | 0 | 0 | 0 | 113.7 | S76 | S76-D78 PolarHBondContact O-N 3.3Å; S76-D78 VanDerWaalsContact O-N 3.14Å |
| 79 | F | 71.9 | Confident | 78.4 | Confident | 104 Ų | 104 | 103.2 Ų | 103.2 | 46% | 0.456 | 52% | 0.519 | S | S | . | . | G | 310 helix | trans | -100.2 | -1.7 | 179.1 | -71.1 | -88.3 | 0 | 0 | 0 | 113.1 | D73 S76 E77 I81 | D73-F79 HydrophobicContact CB-CD2 4.23Å; D73-F79 HydrophobicContact CB-CE2 4.11Å; D73-F79 WeakPolarHBondContact O-CB 3.49Å; D73-F79 WeakPolarHBondContact O-CD2 3.19Å; D73-F79 WeakPolarHBondContact O-CG 3.35Å; D73-F79 WeakPolarHBondContact OD1-CE2 2.97Å; D73-F79 WeakPolarHBondContact OD2-CE2 3.42Å; D73-F79 WeakPolarHBondContact OD2-CZ 3.33Å; S76-F79 PolarHBondContact O-N 3.09Å; S76-F79 VanDerWaalsContact O-N 3.16Å; E77-F79 VanDerWaalsContact C-N 3.35Å; E77-F79 PolarHBondContact O-N 3.37Å; F79-I81 PolarHBondContact O-N 3.3Å; F79-I81 VanDerWaalsContact O-N 3.07Å |
| 80 | K | 75.1 | Confident | 78.8 | Confident | 162 Ų | 162 | 101.2 Ų | 101.2 | 70% | 0.704 | 51% | 0.509 | S | S | * | . | S | Bend | trans | -71.6 | 107.6 | 174.4 | -168.8 | 176.7 | -178.8 | -179.6 | 0 | 108.3 | S76 E77 H82 | S76-K80 PolarHBondContact O-N 3.1Å; E77-K80 WeakPolarHBondContact O-CB 3.26Å; E77-K80 PolarHBondContact O-N 3.08Å; K80-H82 PolarHBondContact O-N 3.5Å |
| 81 | I | 76 | Confident | 79.2 | Confident | 160 Ų | 160 | 106.3 Ų | 106.3 | 82% | 0.821 | 54% | 0.535 | S | S | * | . | trans | -55.8 | 114.5 | 175.8 | -59.6 | 173 | 0 | 0 | 0 | 107.9 | F79 D83 | F79-I81 PolarHBondContact O-N 3.3Å; F79-I81 VanDerWaalsContact O-N 3.07Å; I81-D83 PolarHBondContact O-N 3.15Å | ||
| 82 | H | 77.1 | Confident | 79.6 | Confident | 69 Ų | 69 | 104.4 Ų | 104.4 | 32% | 0.319 | 52% | 0.523 | S | S | . | . | trans | -79.7 | 110.2 | 173.2 | -179.3 | -88.6 | 0 | 0 | 0 | 107.9 | K80 P84 R97 E98 Q99 | K80-H82 PolarHBondContact O-N 3.5Å; H82-P84 VanDerWaalsContact O-CD 3.29Å; H82-P84 WeakPolarHBondContact O-CD 3.21Å; H82-R97 PolarHBondContact CE1-O 3.09Å; H82-E98 PolarHBondContact NE2-O 3.04Å; H82-Q99 HydrophobicContact CB-CG 4.36Å; H82-Q99 VanDerWaalsContact CD2-CA 3.48Å; H82-Q99 WeakPolarHBondContact CD2-CA 3.39Å; H82-Q99 VanDerWaalsContact NE2-CA 3.34Å; H82-Q99 WeakPolarHBondContact NE2-CA 3.34Å; H82-Q99 PolarHBondContact NE2-N 3.36Å | ||
| 83 | D | 77.8 | Confident | 80.2 | Confident | 106 Ų | 106 | 99.8 Ų | 99.8 | 57% | 0.567 | 50% | 0.502 | S | S | * | . | trans | -91.4 | 109.3 | 168.7 | -168.2 | -15.8 | 0 | 0 | 0 | 108.1 | I81 E85 | I81-D83 PolarHBondContact O-N 3.15Å; D83-E85 PolarHBondContact O-N 3.14Å; D83-E85 VanDerWaalsContact O-N 3.16Å; D83-E85 PolarHBondContact OD1-N 2.86Å | ||
| 84 | P | 75.6 | Confident | 80.9 | Confident | 53 Ų | 53 | 101.4 Ų | 101.4 | 34% | 0.344 | 51% | 0.508 | S | S | . | . | trans | -69.4 | -3.5 | 179.2 | 26.3 | -32.6 | 0 | 0 | 0 | 113.5 | H82 A86 R97 | H82-P84 VanDerWaalsContact O-CD 3.29Å; H82-P84 WeakPolarHBondContact O-CD 3.21Å; P84-A86 PolarHBondContact O-N 3.19Å; P84-R97 PolarHBondContact O-N 2.77Å | ||
| 85 | E | 80.2 | Confident | 81.5 | Confident | 101 Ų | 101 | 96.7 Ų | 96.7 | 47% | 0.472 | 48% | 0.484 | S | S | . | . | trans | 44.6 | 43.8 | 177.8 | -67.7 | -176.8 | 158.1 | 0 | 0 | 112.2 | D83 K87 Y130 | D83-E85 PolarHBondContact O-N 3.14Å; D83-E85 VanDerWaalsContact O-N 3.16Å; D83-E85 PolarHBondContact OD1-N 2.86Å; E85-K87 PolarHBondContact O-N 3.21Å; E85-Y130 WeakPolarHBondContact OE2-CE1 3.23Å | ||
| 86 | A | 85.8 | Confident | 82.1 | Confident | 63 Ų | 63 | 90.8 Ų | 90.8 | 52% | 0.521 | 46% | 0.457 | S | S | . | . | trans | -66.9 | 125.6 | -171.6 | 0 | 0 | 0 | 0 | 0 | 111.1 | P84 I95 | P84-A86 PolarHBondContact O-N 3.19Å; A86-I95 CarbonylContact C-O 3.57Å; A86-I95 VanDerWaalsContact CA-O 3.23Å; A86-I95 WeakPolarHBondContact CA-O 3.29Å | ||
| 87 | K | 85.5 | Confident | 82.6 | Confident | 114 Ų | 114 | 92.9 Ų | 92.9 | 50% | 0.496 | 46% | 0.459 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128 | 123.4 | -177.5 | -174.5 | -178.9 | 178.6 | -175.4 | 0 | 110.6 | E85 F94 I95 E131 | E85-K87 PolarHBondContact O-N 3.21Å; K87-F94 CarbonylContact O-C 3.49Å; K87-F94 WeakPolarHBondContact O-CA 3.49Å; K87-I95 PolarHBondContact N-O 3.36Å; K87-I95 PolarHBondContact O-N 2.87Å; K87-E131 IonicContact NZ-OE1 2.87Å |
| 88 | W | 88.5 | Confident | 83.3 | Confident | 156 Ų | 156 | 87.3 Ų | 87.3 | 59% | 0.591 | 43% | 0.433 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -70.1 | 131.6 | 171.1 | -64.8 | 93 | 0 | 0 | 0 | 110.4 | F94 V108 | W88-F94 HydrophobicContact CD2-CB 3.86Å; W88-F94 HydrophobicContact CE3-CB 3.77Å; W88-F94 HydrophobicContact CE3-CD1 4.3Å; W88-F94 HydrophobicContact CG-CB 4.3Å; W88-F94 AromaticContact CH2-CD1 3.79Å; W88-F94 HydrophobicContact CH2-CD1 3.79Å; W88-F94 HydrophobicContact CH2-CE1 4.45Å; W88-F94 HydrophobicContact CZ2-CD1 4.24Å; W88-F94 HydrophobicContact CZ3-CB 4.18Å; W88-F94 AromaticContact CZ3-CD1 3.83Å; W88-F94 HydrophobicContact CZ3-CD1 3.83Å; W88-F94 HydrophobicContact CZ3-CG 4.47Å; W88-V108 HydrophobicContact CH2-CG2 4.2Å; W88-V108 HydrophobicContact CZ3-CG2 4.23Å |
| 89 | I | 84.7 | Confident | 83.8 | Confident | 55 Ų | 55 | 88 Ų | 88 | 28% | 0.282 | 43% | 0.432 | S | S | . | . | S | Bend | trans | -98.7 | -40.6 | 168.7 | -50.8 | 179.8 | 0 | 0 | 0 | 109.7 | E93 I95 L105 R136 | I89-E93 PolarHBondContact N-O 3.24Å; I89-I95 HydrophobicContact CD1-CD1 3.21Å; I89-I95 HydrophobicContact CD1-CG1 3.58Å; I89-I95 HydrophobicContact CG1-CD1 3.61Å; I89-I95 HydrophobicContact CG1-CG1 3.94Å; I89-L105 HydrophobicContact CD1-CD1 3.71Å; I89-R136 HydrophobicContact CD1-CG 4.17Å |
| 90 | S | 84.6 | Confident | 84.1 | Confident | 54 Ų | 54 | 91.3 Ų | 91.3 | 38% | 0.378 | 45% | 0.445 | S | S | . | . | S | Bend | trans | -138.8 | 171.9 | -175.7 | -56.7 | 0 | 0 | 0 | 0 | 109.1 | T92 E93 | S90-T92 PolarHBondContact O-N 3.49Å; S90-E93 PolarHBondContact N-O 3.29Å; S90-E93 PolarHBondContact O-N 3.07Å; S90-E93 VanDerWaalsContact O-O 3.11Å |
| 91 | D | 88.4 | Confident | 84.5 | Confident | 162 Ų | 162 | 84 Ų | 84 | 87% | 0.866 | 42% | 0.416 | S | S | * | . | S | Bend | trans | -64.6 | -22.9 | 180 | -57.5 | -33.2 | 0 | 0 | 0 | 113.2 | ||
| 92 | T | 88.8 | Confident | 85.1 | Confident | 52 Ų | 52 | 77.2 Ų | 77.2 | 32% | 0.319 | 38% | 0.382 | S | S | . | . | S | Bend | trans | -110.6 | -10.8 | -177.8 | 55.9 | 0 | 0 | 0 | 0 | 113.7 | S90 V108 E109 | S90-T92 PolarHBondContact O-N 3.49Å; T92-V108 PolarHBondContact O-N 3.4Å; T92-E109 HydrophobicContact CG2-CB 4.47Å |
| 93 | E | 90.8 | Very high | 85.7 | Confident | 29 Ų | 29 | 74 Ų | 74 | 14% | 0.136 | 37% | 0.367 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.8 | 131.1 | -172.1 | -62.8 | -174.3 | 165.7 | 0 | 0 | 112.3 | I89 S90 L105 W106 N107 R136 | I89-E93 PolarHBondContact N-O 3.24Å; S90-E93 PolarHBondContact N-O 3.29Å; S90-E93 PolarHBondContact O-N 3.07Å; S90-E93 VanDerWaalsContact O-O 3.11Å; E93-L105 HydrophobicContact CB-CD1 4.05Å; E93-W106 VanDerWaalsContact CA-O 3.28Å; E93-W106 WeakPolarHBondContact CA-O 3.44Å; E93-N107 HydrophobicContact CG-CB 4.04Å; E93-N107 WeakPolarHBondContact CG-ND2 3.48Å; E93-N107 PolarHBondContact OE1-ND2 3.16Å; E93-R136 IonicContact OE1-NH1 3.8Å; E93-R136 IonicContact OE2-NH1 2.8Å; E93-R136 PolarHBondContact OE2-NH1 3.28Å |
| 94 | F | 90.9 | Very high | 86.4 | Confident | 46 Ų | 46 | 71.8 Ų | 71.8 | 20% | 0.202 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.5 | 148.9 | 173.3 | 69 | -94.1 | 0 | 0 | 0 | 111.7 | K87 W88 Y96 W106 V108 | K87-F94 CarbonylContact O-C 3.49Å; K87-F94 WeakPolarHBondContact O-CA 3.49Å; W88-F94 HydrophobicContact CD2-CB 3.86Å; W88-F94 HydrophobicContact CE3-CB 3.77Å; W88-F94 HydrophobicContact CE3-CD1 4.3Å; W88-F94 HydrophobicContact CG-CB 4.3Å; W88-F94 AromaticContact CH2-CD1 3.79Å; W88-F94 HydrophobicContact CH2-CD1 3.79Å; W88-F94 HydrophobicContact CH2-CE1 4.45Å; W88-F94 HydrophobicContact CZ2-CD1 4.24Å; W88-F94 HydrophobicContact CZ3-CB 4.18Å; W88-F94 AromaticContact CZ3-CD1 3.83Å; W88-F94 HydrophobicContact CZ3-CD1 3.83Å; W88-F94 HydrophobicContact CZ3-CG 4.47Å; F94-Y96 HydrophobicContact CD2-CD1 4.13Å; F94-Y96 AromaticContact CE2-CD1 3.65Å; F94-Y96 HydrophobicContact CE2-CD1 3.65Å; F94-Y96 HydrophobicContact CE2-CE1 4.43Å; F94-Y96 HydrophobicContact CE2-CG 4.11Å; F94-W106 HydrophobicContact CD1-CB 4.25Å; F94-W106 HydrophobicContact CD2-CB 4.27Å; F94-W106 HydrophobicContact CE1-CB 3.84Å; F94-W106 AromaticContact CE1-CD1 3.34Å; F94-W106 AromaticContact CE1-CG 3.81Å; F94-W106 HydrophobicContact CE1-CG 3.81Å; F94-W106 HydrophobicContact CE2-CB 3.83Å; F94-W106 HydrophobicContact CE2-CG 4.36Å; F94-W106 HydrophobicContact CG-CB 4.46Å; F94-W106 HydrophobicContact CZ-CB 3.6Å; F94-W106 AromaticContact CZ-CD1 3.6Å; F94-W106 AromaticContact CZ-CG 3.66Å; F94-W106 HydrophobicContact CZ-CG 3.66Å; F94-W106 PolarHBondContact N-O 3.48Å; F94-W106 PolarHBondContact O-N 3.08Å; F94-V108 HydrophobicContact CD1-CG2 3.82Å; F94-V108 HydrophobicContact CE1-CG2 3.65Å |
| 95 | I | 90.6 | Very high | 87.1 | Confident | 10 Ų | 10 | 69.7 Ų | 69.7 | 5% | 0.051 | 34% | 0.337 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94 | 141.8 | 171.7 | -65.4 | 162.7 | 0 | 0 | 0 | 108.4 | A86 K87 I89 V103 R104 L105 L116 I132 | A86-I95 CarbonylContact C-O 3.57Å; A86-I95 VanDerWaalsContact CA-O 3.23Å; A86-I95 WeakPolarHBondContact CA-O 3.29Å; K87-I95 PolarHBondContact N-O 3.36Å; K87-I95 PolarHBondContact O-N 2.87Å; I89-I95 HydrophobicContact CD1-CD1 3.21Å; I89-I95 HydrophobicContact CD1-CG1 3.58Å; I89-I95 HydrophobicContact CG1-CD1 3.61Å; I89-I95 HydrophobicContact CG1-CG1 3.94Å; I95-V103 HydrophobicContact CG2-CG1 3.28Å; I95-R104 CarbonylContact C-O 3.57Å; I95-R104 VanDerWaalsContact CA-O 3.31Å; I95-R104 WeakPolarHBondContact CA-O 3.28Å; I95-L105 HydrophobicContact CG1-CD1 3.79Å; I95-L116 HydrophobicContact CD1-CD1 4.01Å; I95-L116 HydrophobicContact CG1-CD1 3.91Å; I95-I132 HydrophobicContact CD1-CB 3.98Å; I95-I132 HydrophobicContact CD1-CD1 3.69Å; I95-I132 HydrophobicContact CD1-CG1 4.45Å; I95-I132 HydrophobicContact CD1-CG2 3.95Å; I95-I132 HydrophobicContact CG1-CD1 4.46Å; I95-I132 HydrophobicContact CG2-CD1 3.93Å |
| 96 | Y | 90.5 | Very high | 87.7 | Confident | 53 Ų | 53 | 68.4 Ų | 68.4 | 21% | 0.208 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.8 | 155.7 | 169.8 | 71.1 | -75.8 | 0 | 0 | 0 | 110.7 | F94 R104 W106 | F94-Y96 HydrophobicContact CD2-CD1 4.13Å; F94-Y96 AromaticContact CE2-CD1 3.65Å; F94-Y96 HydrophobicContact CE2-CD1 3.65Å; F94-Y96 HydrophobicContact CE2-CE1 4.43Å; F94-Y96 HydrophobicContact CE2-CG 4.11Å; Y96-R104 HydrophobicContact CD1-CB 4.3Å; Y96-R104 HydrophobicContact CE1-CB 3.65Å; Y96-R104 PolarHBondContact N-O 3.35Å; Y96-R104 PolarHBondContact O-N 3.47Å; Y96-R104 WeakPolarHBondContact OH-CD 3.48Å; Y96-W106 HydrophobicContact CD1-CB 4.19Å; Y96-W106 HydrophobicContact CE1-CB 3.91Å; Y96-W106 HydrophobicContact CE1-CE3 4.42Å |
| 97 | R | 88.2 | Confident | 88.1 | Confident | 80 Ų | 80 | 66.4 Ų | 66.4 | 30% | 0.302 | 31% | 0.308 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 135.4 | 172.6 | -167.7 | 176.1 | -178.5 | -164 | -2.6 | 109.8 | H82 P84 V103 | H82-R97 PolarHBondContact CE1-O 3.09Å; P84-R97 PolarHBondContact O-N 2.77Å; R97-V103 HydrophobicContact CG-CG2 4.37Å |
| 98 | E | 87 | Confident | 88.4 | Confident | 57 Ų | 57 | 64.1 Ų | 64.1 | 27% | 0.266 | 30% | 0.304 | S | S | . | . | trans | -85.8 | 162.3 | 174.7 | -166.9 | 173.3 | -178.6 | 0 | 0 | 110.7 | H82 K100 G101 T102 R104 | H82-E98 PolarHBondContact NE2-O 3.04Å; E98-K100 PolarHBondContact O-N 3.38Å; E98-G101 WeakPolarHBondContact O-CA 3.31Å; E98-G101 PolarHBondContact O-N 2.88Å; E98-T102 WeakPolarHBondContact CB-O 3.48Å; E98-T102 PolarHBondContact N-O 2.71Å; E98-R104 IonicContact OE2-CZ 3.8Å; E98-R104 IonicContact OE2-NE 2.98Å; E98-R104 PolarHBondContact OE2-NE 3.38Å; E98-R104 IonicContact OE2-NH2 3.7Å | ||
| 99 | Q | 81.6 | Confident | 88.6 | Confident | 163 Ų | 163 | 63.9 Ų | 63.9 | 76% | 0.762 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.4 | -35.5 | 176.3 | -69.1 | -177.3 | -9.3 | 0 | 0 | 112.9 | H82 G101 | H82-Q99 HydrophobicContact CB-CG 4.36Å; H82-Q99 VanDerWaalsContact CD2-CA 3.48Å; H82-Q99 WeakPolarHBondContact CD2-CA 3.39Å; H82-Q99 VanDerWaalsContact NE2-CA 3.34Å; H82-Q99 WeakPolarHBondContact NE2-CA 3.34Å; H82-Q99 PolarHBondContact NE2-N 3.36Å; Q99-G101 PolarHBondContact O-N 2.84Å; Q99-G101 VanDerWaalsContact O-N 3.11Å |
| 100 | K | 79.4 | Confident | 89 | Confident | 172 Ų | 172 | 65 Ų | 65 | 75% | 0.748 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.6 | 4.6 | 175.7 | -60.6 | 179.3 | -178.8 | 175.2 | 0 | 113.7 | E98 T102 | E98-K100 PolarHBondContact O-N 3.38Å; K100-T102 VanDerWaalsContact C-N 3.28Å; K100-T102 PolarHBondContact O-N 3.31Å |
| 101 | G | 82.4 | Confident | 89.4 | Confident | 9 Ų | 9 | 67.7 Ų | 67.7 | 9% | 0.093 | 33% | 0.329 | C | S | . | . | S | Bend | trans | 82.7 | -6.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115 | E98 Q99 I122 | E98-G101 WeakPolarHBondContact O-CA 3.31Å; E98-G101 PolarHBondContact O-N 2.88Å; Q99-G101 PolarHBondContact O-N 2.84Å; Q99-G101 VanDerWaalsContact O-N 3.11Å; G101-I122 WeakPolarHBondContact O-CD1 3.48Å |
| 102 | T | 89.4 | Confident | 89.5 | Confident | 18 Ų | 18 | 63.7 Ų | 63.7 | 11% | 0.11 | 31% | 0.311 | C | S | . | . | trans | -67.9 | 136.6 | 176.6 | -60.7 | 0 | 0 | 0 | 0 | 111.2 | E98 K100 R104 V115 I117 G119 | E98-T102 WeakPolarHBondContact CB-O 3.48Å; E98-T102 PolarHBondContact N-O 2.71Å; K100-T102 VanDerWaalsContact C-N 3.28Å; K100-T102 PolarHBondContact O-N 3.31Å; T102-R104 HydrophobicContact CG2-CG 4.15Å; T102-V115 HydrophobicContact CG2-CG1 3.8Å; T102-I117 WeakPolarHBondContact CG2-O 3.44Å; T102-G119 PolarHBondContact OG1-N 3.06Å; T102-G119 VanDerWaalsContact OG1-N 3.17Å | ||
| 103 | V | 90.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 63.6 Ų | 63.6 | 0% | 0 | 31% | 0.312 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101 | 124.4 | 176.4 | -176.2 | 0 | 0 | 0 | 0 | 109.4 | I95 R97 L116 I117 I122 Y130 I132 | I95-V103 HydrophobicContact CG2-CG1 3.28Å; R97-V103 HydrophobicContact CG-CG2 4.37Å; V103-L116 PolarHBondContact O-N 3.03Å; V103-I117 HydrophobicContact CB-CB 4.02Å; V103-I117 HydrophobicContact CB-CD1 4.39Å; V103-I117 HydrophobicContact CB-CG1 4.46Å; V103-I117 HydrophobicContact CG2-CB 4.31Å; V103-I117 HydrophobicContact CG2-CD1 4.43Å; V103-I117 PolarHBondContact N-O 3.19Å; V103-I117 PolarHBondContact O-N 3.16Å; V103-I117 VanDerWaalsContact O-N 3.16Å; V103-I122 HydrophobicContact CG2-CD1 3.77Å; V103-Y130 HydrophobicContact CB-CE2 4.46Å; V103-Y130 HydrophobicContact CG1-CE2 3.87Å; V103-Y130 HydrophobicContact CG2-CD2 4.26Å; V103-Y130 HydrophobicContact CG2-CE1 4.29Å; V103-Y130 HydrophobicContact CG2-CE2 3.74Å; V103-I132 HydrophobicContact CG1-CD1 3.71Å |
| 104 | R | 91 | Very high | 89.5 | Confident | 61 Ų | 61 | 65.6 Ų | 65.6 | 23% | 0.23 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.9 | 146 | -176.4 | -68.8 | 177.3 | 178.9 | -88 | -4 | 110.7 | I95 Y96 E98 T102 T114 V115 | I95-R104 CarbonylContact C-O 3.57Å; I95-R104 VanDerWaalsContact CA-O 3.31Å; I95-R104 WeakPolarHBondContact CA-O 3.28Å; Y96-R104 HydrophobicContact CD1-CB 4.3Å; Y96-R104 HydrophobicContact CE1-CB 3.65Å; Y96-R104 PolarHBondContact N-O 3.35Å; Y96-R104 PolarHBondContact O-N 3.47Å; Y96-R104 WeakPolarHBondContact OH-CD 3.48Å; E98-R104 IonicContact OE2-CZ 3.8Å; E98-R104 IonicContact OE2-NE 2.98Å; E98-R104 PolarHBondContact OE2-NE 3.38Å; E98-R104 IonicContact OE2-NH2 3.7Å; T102-R104 HydrophobicContact CG2-CG 4.15Å; R104-T114 WeakPolarHBondContact CA-O 3.46Å; R104-V115 HydrophobicContact CG-CG2 4.35Å |
| 105 | L | 91.1 | Very high | 89.5 | Confident | 9 Ų | 9 | 67.1 Ų | 67.1 | 5% | 0.047 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.4 | 125.7 | 166.4 | -178.8 | 69.3 | 0 | 0 | 0 | 107.9 | I89 E93 I95 S113 T114 L116 | I89-L105 HydrophobicContact CD1-CD1 3.71Å; E93-L105 HydrophobicContact CB-CD1 4.05Å; I95-L105 HydrophobicContact CG1-CD1 3.79Å; L105-S113 CarbonylContact O-C 3.24Å; L105-S113 VanDerWaalsContact O-CA 3.26Å; L105-S113 WeakPolarHBondContact O-CA 3.24Å; L105-T114 WeakPolarHBondContact CB-OG1 3.18Å; L105-T114 PolarHBondContact N-O 2.97Å; L105-T114 PolarHBondContact O-N 3.32Å; L105-L116 HydrophobicContact CB-CD1 3.92Å; L105-L116 HydrophobicContact CB-CD2 4.37Å; L105-L116 HydrophobicContact CB-CG 3.99Å |
| 106 | W | 92.7 | Very high | 89.3 | Confident | 73 Ų | 73 | 68.1 Ų | 68.1 | 28% | 0.277 | 34% | 0.344 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.2 | 126.4 | 174.9 | -172.3 | -91.2 | 0 | 0 | 0 | 109.5 | E93 F94 Y96 N111 | E93-W106 VanDerWaalsContact CA-O 3.28Å; E93-W106 WeakPolarHBondContact CA-O 3.44Å; F94-W106 HydrophobicContact CD1-CB 4.25Å; F94-W106 HydrophobicContact CD2-CB 4.27Å; F94-W106 HydrophobicContact CE1-CB 3.84Å; F94-W106 AromaticContact CE1-CD1 3.34Å; F94-W106 AromaticContact CE1-CG 3.81Å; F94-W106 HydrophobicContact CE1-CG 3.81Å; F94-W106 HydrophobicContact CE2-CB 3.83Å; F94-W106 HydrophobicContact CE2-CG 4.36Å; F94-W106 HydrophobicContact CG-CB 4.46Å; F94-W106 HydrophobicContact CZ-CB 3.6Å; F94-W106 AromaticContact CZ-CD1 3.6Å; F94-W106 AromaticContact CZ-CG 3.66Å; F94-W106 HydrophobicContact CZ-CG 3.66Å; F94-W106 PolarHBondContact N-O 3.48Å; F94-W106 PolarHBondContact O-N 3.08Å; Y96-W106 HydrophobicContact CD1-CB 4.19Å; Y96-W106 HydrophobicContact CE1-CB 3.91Å; Y96-W106 HydrophobicContact CE1-CE3 4.42Å; W106-N111 HydrophobicContact CZ2-CB 4.33Å |
| 107 | N | 93.3 | Very high | 89.2 | Confident | 21 Ų | 21 | 65.6 Ų | 65.6 | 11% | 0.112 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 118.4 | 167.9 | -171.9 | -48.8 | 0 | 0 | 0 | 108.9 | E93 E109 T110 N111 T112 | E93-N107 HydrophobicContact CG-CB 4.04Å; E93-N107 WeakPolarHBondContact CG-ND2 3.48Å; E93-N107 PolarHBondContact OE1-ND2 3.16Å; N107-E109 PolarHBondContact OD1-N 3.22Å; N107-T110 WeakPolarHBondContact CB-OG1 3.28Å; N107-T110 PolarHBondContact OD1-N 3.3Å; N107-T110 VanDerWaalsContact OD1-N 3.14Å; N107-T110 PolarHBondContact OD1-OG1 3.14Å; N107-N111 VanDerWaalsContact O-CA 3.24Å; N107-N111 WeakPolarHBondContact O-CA 3.26Å; N107-N111 PolarHBondContact O-N 3.03Å; N107-T112 PolarHBondContact N-O 3.32Å; N107-T112 PolarHBondContact O-N 3.43Å |
| 108 | V | 92.9 | Very high | 89.1 | Confident | 66 Ų | 66 | 64.7 Ų | 64.7 | 40% | 0.4 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.4 | -31.4 | -175.2 | -178.5 | 0 | 0 | 0 | 0 | 111.7 | W88 T92 F94 | W88-V108 HydrophobicContact CH2-CG2 4.2Å; W88-V108 HydrophobicContact CZ3-CG2 4.23Å; T92-V108 PolarHBondContact O-N 3.4Å; F94-V108 HydrophobicContact CD1-CG2 3.82Å; F94-V108 HydrophobicContact CE1-CG2 3.65Å |
| 109 | E | 92.5 | Very high | 88.9 | Confident | 151 Ų | 151 | 62.3 Ų | 62.3 | 71% | 0.706 | 33% | 0.325 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.3 | -44.8 | -176.5 | -173.7 | 172.9 | -158.8 | 0 | 0 | 111.3 | T92 N107 | T92-E109 HydrophobicContact CG2-CB 4.47Å; N107-E109 PolarHBondContact OD1-N 3.22Å |
| 110 | T | 92.1 | Very high | 89.1 | Confident | 78 Ų | 78 | 61.5 Ų | 61.5 | 48% | 0.479 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.9 | -8.3 | -178.8 | 58.5 | 0 | 0 | 0 | 0 | 113.5 | N107 T112 | N107-T110 WeakPolarHBondContact CB-OG1 3.28Å; N107-T110 PolarHBondContact OD1-N 3.3Å; N107-T110 VanDerWaalsContact OD1-N 3.14Å; N107-T110 PolarHBondContact OD1-OG1 3.14Å; T110-T112 PolarHBondContact O-N 3.15Å; T110-T112 PolarHBondContact OG1-OG1 3.21Å |
| 111 | N | 92.8 | Very high | 88.9 | Confident | 112 Ų | 112 | 54.8 Ų | 54.8 | 60% | 0.599 | 29% | 0.289 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.2 | 28.4 | -170.9 | -68.8 | -58.2 | 0 | 0 | 0 | 113.7 | W106 N107 | W106-N111 HydrophobicContact CZ2-CB 4.33Å; N107-N111 VanDerWaalsContact O-CA 3.24Å; N107-N111 WeakPolarHBondContact O-CA 3.26Å; N107-N111 PolarHBondContact O-N 3.03Å |
| 112 | T | 91.6 | Very high | 88.9 | Confident | 78 Ų | 78 | 54.8 Ų | 54.8 | 48% | 0.479 | 29% | 0.287 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 132.8 | 178.8 | 56.1 | 0 | 0 | 0 | 0 | 111 | N107 T110 | N107-T112 PolarHBondContact N-O 3.32Å; N107-T112 PolarHBondContact O-N 3.43Å; T110-T112 PolarHBondContact O-N 3.15Å; T110-T112 PolarHBondContact OG1-OG1 3.21Å |
| 113 | S | 90.8 | Very high | 88.6 | Confident | 50 Ų | 50 | 61.3 Ų | 61.3 | 35% | 0.35 | 32% | 0.316 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.9 | 133 | 172.7 | 81.6 | 0 | 0 | 0 | 0 | 111.4 | L105 | L105-S113 CarbonylContact O-C 3.24Å; L105-S113 VanDerWaalsContact O-CA 3.26Å; L105-S113 WeakPolarHBondContact O-CA 3.24Å |
| 114 | T | 89.4 | Confident | 88 | Confident | 71 Ų | 71 | 65.6 Ų | 65.6 | 44% | 0.436 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.2 | 137 | 172.6 | 60.1 | 0 | 0 | 0 | 0 | 110.8 | R104 L105 L116 | R104-T114 WeakPolarHBondContact CA-O 3.46Å; L105-T114 WeakPolarHBondContact CB-OG1 3.18Å; L105-T114 PolarHBondContact N-O 2.97Å; L105-T114 PolarHBondContact O-N 3.32Å; T114-L116 PolarHBondContact O-N 3.4Å |
| 115 | V | 89.6 | Confident | 87.2 | Confident | 77 Ų | 77 | 66 Ų | 66 | 47% | 0.467 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 121.2 | 177.8 | -179.4 | 0 | 0 | 0 | 0 | 109.4 | T102 R104 | T102-V115 HydrophobicContact CG2-CG1 3.8Å; R104-V115 HydrophobicContact CG-CG2 4.35Å |
| 116 | L | 86.9 | Confident | 86.6 | Confident | 31 Ų | 31 | 75.6 Ų | 75.6 | 16% | 0.162 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94 | -49.3 | 175.9 | -64.7 | -179.2 | 0 | 0 | 0 | 111.2 | I95 V103 L105 T114 I132 | I95-L116 HydrophobicContact CD1-CD1 4.01Å; I95-L116 HydrophobicContact CG1-CD1 3.91Å; V103-L116 PolarHBondContact O-N 3.03Å; L105-L116 HydrophobicContact CB-CD1 3.92Å; L105-L116 HydrophobicContact CB-CD2 4.37Å; L105-L116 HydrophobicContact CB-CG 3.99Å; T114-L116 PolarHBondContact O-N 3.4Å; L116-I132 HydrophobicContact CD1-CD1 3.95Å; L116-I132 HydrophobicContact CD1-CG2 4.4Å |
| 117 | I | 87.6 | Confident | 85.8 | Confident | 1 Ų | 1 | 72.9 Ų | 72.9 | 1% | 0.005 | 38% | 0.382 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.8 | 126.2 | -177.5 | -51.9 | 165.9 | 0 | 0 | 0 | 108.5 | T102 V103 K121 I122 Y130 I132 A139 F141 L192 | T102-I117 WeakPolarHBondContact CG2-O 3.44Å; V103-I117 HydrophobicContact CB-CB 4.02Å; V103-I117 HydrophobicContact CB-CD1 4.39Å; V103-I117 HydrophobicContact CB-CG1 4.46Å; V103-I117 HydrophobicContact CG2-CB 4.31Å; V103-I117 HydrophobicContact CG2-CD1 4.43Å; V103-I117 PolarHBondContact N-O 3.19Å; V103-I117 PolarHBondContact O-N 3.16Å; V103-I117 VanDerWaalsContact O-N 3.16Å; I117-K121 HydrophobicContact CG2-CB 4.5Å; I117-I122 HydrophobicContact CG2-CD1 3.92Å; I117-I122 HydrophobicContact CG2-CG1 3.74Å; I117-Y130 HydrophobicContact CD1-CD2 4.25Å; I117-I132 HydrophobicContact CD1-CD1 4Å; I117-I132 HydrophobicContact CD1-CG1 4.01Å; I117-A139 HydrophobicContact CD1-CB 3.8Å; I117-A139 HydrophobicContact CG1-CB 4.38Å; I117-F141 HydrophobicContact CD1-CE1 4.07Å; I117-F141 HydrophobicContact CD1-CZ 3.77Å; I117-F141 HydrophobicContact CG1-CZ 4.28Å; I117-F141 HydrophobicContact CG2-CE1 4.13Å; I117-F141 HydrophobicContact CG2-CZ 3.82Å; I117-L192 HydrophobicContact CG1-CD2 4.5Å |
| 118 | E | 86.1 | Confident | 84.9 | Confident | 61 Ų | 61 | 76.6 Ų | 76.6 | 29% | 0.285 | 40% | 0.4 | S | S | . | . | trans | -78.4 | 136.1 | 176.6 | -165.2 | 173.7 | -177.6 | 0 | 0 | 110.8 | K120 K121 | E118-K120 HydrophobicContact CG-CB 4.49Å; E118-K120 PolarHBondContact O-N 3.01Å; E118-K120 VanDerWaalsContact O-N 3.14Å; E118-K121 HydrophobicContact CB-CD 4.3Å; E118-K121 HydrophobicContact CB-CG 4.49Å; E118-K121 WeakPolarHBondContact O-CB 3.35Å; E118-K121 PolarHBondContact O-N 2.92Å | ||
| 119 | G | 84.4 | Confident | 84.2 | Confident | 7 Ų | 7 | 81.9 Ų | 81.9 | 7% | 0.072 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -55.3 | -35.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | T102 K121 I122 E123 | T102-G119 PolarHBondContact OG1-N 3.06Å; T102-G119 VanDerWaalsContact OG1-N 3.17Å; G119-K121 PolarHBondContact O-N 2.8Å; G119-K121 VanDerWaalsContact O-N 3.16Å; G119-I122 PolarHBondContact O-N 2.77Å; G119-I122 VanDerWaalsContact O-N 3.11Å; G119-E123 PolarHBondContact O-N 3.16Å |
| 120 | K | 84.1 | Confident | 83.6 | Confident | 146 Ų | 146 | 76.5 Ų | 76.5 | 64% | 0.635 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -55.9 | -31.7 | 175.6 | -65.5 | -179.7 | 180 | 173.7 | 0 | 113.4 | E118 S124 | E118-K120 HydrophobicContact CG-CB 4.49Å; E118-K120 PolarHBondContact O-N 3.01Å; E118-K120 VanDerWaalsContact O-N 3.14Å; K120-S124 VanDerWaalsContact O-CB 3.3Å; K120-S124 WeakPolarHBondContact O-CB 3.41Å; K120-S124 PolarHBondContact O-N 2.8Å; K120-S124 PolarHBondContact O-OG 2.85Å |
| 121 | K | 76.8 | Confident | 83.2 | Confident | 30 Ų | 30 | 77.8 Ų | 77.8 | 13% | 0.13 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -75.2 | -40.1 | 179.5 | -66.9 | 171.3 | 176.5 | 160.5 | 0 | 111.6 | I117 E118 G119 E123 S124 L125 L195 | I117-K121 HydrophobicContact CG2-CB 4.5Å; E118-K121 HydrophobicContact CB-CD 4.3Å; E118-K121 HydrophobicContact CB-CG 4.49Å; E118-K121 WeakPolarHBondContact O-CB 3.35Å; E118-K121 PolarHBondContact O-N 2.92Å; G119-K121 PolarHBondContact O-N 2.8Å; G119-K121 VanDerWaalsContact O-N 3.16Å; K121-E123 VanDerWaalsContact C-N 3.27Å; K121-E123 PolarHBondContact O-N 3.01Å; K121-S124 WeakPolarHBondContact CA-OG 3.04Å; K121-S124 PolarHBondContact O-N 2.77Å; K121-S124 PolarHBondContact O-OG 3.31Å; K121-S124 VanDerWaalsContact O-OG 3.12Å; K121-L125 WeakPolarHBondContact O-CB 3.05Å; K121-L125 WeakPolarHBondContact O-CD1 3.33Å; K121-L125 PolarHBondContact O-N 2.88Å; K121-L195 HydrophobicContact CD-CB 4.18Å; K121-L195 HydrophobicContact CD-CD2 4.34Å; K121-L195 WeakPolarHBondContact CE-O 3.46Å; K121-L195 VanDerWaalsContact NZ-C 3.3Å; K121-L195 PolarHBondContact NZ-O 2.72Å |
| 122 | I | 82.1 | Confident | 82.7 | Confident | 10 Ų | 10 | 73.4 Ų | 73.4 | 5% | 0.051 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -65.2 | -40 | 177.4 | -61.5 | -178.8 | 0 | 0 | 0 | 109.7 | G101 V103 I117 G119 R126 A127 F141 | G101-I122 WeakPolarHBondContact O-CD1 3.48Å; V103-I122 HydrophobicContact CG2-CD1 3.77Å; I117-I122 HydrophobicContact CG2-CD1 3.92Å; I117-I122 HydrophobicContact CG2-CG1 3.74Å; G119-I122 PolarHBondContact O-N 2.77Å; G119-I122 VanDerWaalsContact O-N 3.11Å; I122-R126 PolarHBondContact O-N 2.93Å; I122-R126 VanDerWaalsContact O-N 3.16Å; I122-A127 HydrophobicContact CG2-CB 4.33Å; I122-A127 PolarHBondContact O-N 2.95Å; I122-A127 VanDerWaalsContact O-N 3.09Å; I122-F141 HydrophobicContact CG1-CE1 4Å |
| 123 | E | 83.6 | Confident | 82 | Confident | 154 Ų | 154 | 71.2 Ų | 71.2 | 72% | 0.72 | 35% | 0.351 | S | S | * | . | H | α-helix | trans | -67.7 | -46.2 | 176.4 | -171.7 | 173.8 | -159.5 | 0 | 0 | 112.3 | G119 K121 L125 R126 | G119-E123 PolarHBondContact O-N 3.16Å; K121-E123 VanDerWaalsContact C-N 3.27Å; K121-E123 PolarHBondContact O-N 3.01Å; E123-L125 PolarHBondContact O-N 3.11Å; E123-R126 PolarHBondContact O-N 3.27Å |
| 124 | S | 75.8 | Confident | 81.4 | Confident | 90 Ų | 90 | 74.2 Ų | 74.2 | 63% | 0.629 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -65.7 | -36.7 | -179.4 | 67.8 | 0 | 0 | 0 | 0 | 113.1 | K120 K121 R126 | K120-S124 VanDerWaalsContact O-CB 3.3Å; K120-S124 WeakPolarHBondContact O-CB 3.41Å; K120-S124 PolarHBondContact O-N 2.8Å; K120-S124 PolarHBondContact O-OG 2.85Å; K121-S124 WeakPolarHBondContact CA-OG 3.04Å; K121-S124 PolarHBondContact O-N 2.77Å; K121-S124 PolarHBondContact O-OG 3.31Å; K121-S124 VanDerWaalsContact O-OG 3.12Å; S124-R126 VanDerWaalsContact C-N 3.27Å; S124-R126 PolarHBondContact O-N 3.41Å |
| 125 | L | 75.5 | Confident | 80.7 | Confident | 71 Ų | 71 | 74.6 Ų | 74.6 | 37% | 0.372 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.6 | -6.2 | 173.8 | -79.9 | 92.1 | 0 | 0 | 0 | 113.4 | K121 E123 A127 | K121-L125 WeakPolarHBondContact O-CB 3.05Å; K121-L125 WeakPolarHBondContact O-CD1 3.33Å; K121-L125 PolarHBondContact O-N 2.88Å; E123-L125 PolarHBondContact O-N 3.11Å; L125-A127 HydrophobicContact CB-CB 4.47Å; L125-A127 PolarHBondContact O-N 3.32Å; L125-A127 VanDerWaalsContact O-N 3.16Å |
| 126 | R | 78.3 | Confident | 80.1 | Confident | 210 Ų | 210 | 76.2 Ų | 76.2 | 79% | 0.792 | 37% | 0.367 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 46.6 | 40.6 | -171 | -62.4 | -177.5 | 175.3 | 177 | -1.2 | 112.2 | I122 E123 S124 I128 | I122-R126 PolarHBondContact O-N 2.93Å; I122-R126 VanDerWaalsContact O-N 3.16Å; E123-R126 PolarHBondContact O-N 3.27Å; S124-R126 VanDerWaalsContact C-N 3.27Å; S124-R126 PolarHBondContact O-N 3.41Å; R126-I128 PolarHBondContact O-N 3.4Å |
| 127 | A | 76.1 | Confident | 79.7 | Confident | 16 Ų | 16 | 80.3 Ų | 80.3 | 13% | 0.132 | 39% | 0.385 | C | S | . | . | trans | -71.9 | 128.8 | -176.6 | 0 | 0 | 0 | 0 | 0 | 110.2 | I122 L125 F141 | I122-A127 HydrophobicContact CG2-CB 4.33Å; I122-A127 PolarHBondContact O-N 2.95Å; I122-A127 VanDerWaalsContact O-N 3.09Å; L125-A127 HydrophobicContact CB-CB 4.47Å; L125-A127 PolarHBondContact O-N 3.32Å; L125-A127 VanDerWaalsContact O-N 3.16Å; A127-F141 HydrophobicContact CB-CB 4.02Å; A127-F141 HydrophobicContact CB-CD1 3.8Å; A127-F141 HydrophobicContact CB-CG 4.32Å | ||
| 128 | I | 74.5 | Confident | 79.3 | Confident | 98 Ų | 98 | 84.8 Ų | 84.8 | 50% | 0.503 | 40% | 0.403 | S | S | . | . | S | Bend | trans | -86.6 | -32.7 | -178.8 | -61.9 | 167.5 | 0 | 0 | 0 | 110.6 | R126 S142 V145 | R126-I128 PolarHBondContact O-N 3.4Å; I128-S142 PolarHBondContact N-O 2.93Å; I128-V145 HydrophobicContact CB-CG2 4.35Å; I128-V145 HydrophobicContact CD1-CB 3.73Å; I128-V145 HydrophobicContact CD1-CG2 4.01Å |
| 129 | R | 77.7 | Confident | 79.2 | Confident | 178 Ų | 178 | 82 Ų | 82 | 67% | 0.672 | 39% | 0.39 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -140.5 | 155.3 | 175.1 | -50.8 | -176.5 | 171 | -177.6 | -5 | 110.1 | S142 | R129-S142 VanDerWaalsContact CB-OG 3.28Å; R129-S142 WeakPolarHBondContact CB-OG 3.34Å; R129-S142 PolarHBondContact N-OG 3.35Å; R129-S142 PolarHBondContact O-N 3.5Å; R129-S142 PolarHBondContact O-OG 2.82Å |
| 130 | Y | 80.1 | Confident | 79.1 | Confident | 38 Ų | 38 | 85.4 Ų | 85.4 | 15% | 0.149 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.5 | 150.5 | 173.5 | 67.3 | -79.4 | 0 | 0 | 0 | 109.8 | E85 V103 I117 I132 L140 | E85-Y130 WeakPolarHBondContact OE2-CE1 3.23Å; V103-Y130 HydrophobicContact CB-CE2 4.46Å; V103-Y130 HydrophobicContact CG1-CE2 3.87Å; V103-Y130 HydrophobicContact CG2-CD2 4.26Å; V103-Y130 HydrophobicContact CG2-CE1 4.29Å; V103-Y130 HydrophobicContact CG2-CE2 3.74Å; I117-Y130 HydrophobicContact CD1-CD2 4.25Å; Y130-I132 HydrophobicContact CD2-CD1 4.19Å; Y130-I132 HydrophobicContact CD2-CG1 4.33Å; Y130-I132 HydrophobicContact CE2-CD1 4.13Å; Y130-L140 CarbonylContact C-O 3.51Å; Y130-L140 WeakPolarHBondContact CA-O 3.23Å |
| 131 | E | 82.8 | Confident | 79.1 | Confident | 105 Ų | 105 | 79.5 Ų | 79.5 | 49% | 0.491 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.1 | 134.9 | 170.4 | -174.8 | 166.4 | -160.1 | 0 | 0 | 108.8 | K87 A139 L140 | K87-E131 IonicContact NZ-OE1 2.87Å; E131-A139 CarbonylContact O-C 3.57Å; E131-A139 WeakPolarHBondContact O-CA 3.42Å; E131-L140 HydrophobicContact CB-CB 4.4Å; E131-L140 PolarHBondContact N-O 3.45Å; E131-L140 PolarHBondContact O-N 3.09Å |
| 132 | I | 82.1 | Confident | 79.2 | Confident | 20 Ų | 20 | 80 Ų | 80 | 10% | 0.103 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | 135.5 | -178.9 | -67.5 | 158.8 | 0 | 0 | 0 | 108.4 | I95 V103 L116 I117 Y130 A139 | I95-I132 HydrophobicContact CD1-CB 3.98Å; I95-I132 HydrophobicContact CD1-CD1 3.69Å; I95-I132 HydrophobicContact CD1-CG1 4.45Å; I95-I132 HydrophobicContact CD1-CG2 3.95Å; I95-I132 HydrophobicContact CG1-CD1 4.46Å; I95-I132 HydrophobicContact CG2-CD1 3.93Å; V103-I132 HydrophobicContact CG1-CD1 3.71Å; L116-I132 HydrophobicContact CD1-CD1 3.95Å; L116-I132 HydrophobicContact CD1-CG2 4.4Å; I117-I132 HydrophobicContact CD1-CD1 4Å; I117-I132 HydrophobicContact CD1-CG1 4.01Å; Y130-I132 HydrophobicContact CD2-CD1 4.19Å; Y130-I132 HydrophobicContact CD2-CG1 4.33Å; Y130-I132 HydrophobicContact CE2-CD1 4.13Å; I132-A139 HydrophobicContact CG1-CB 4.43Å |
| 133 | S | 77.6 | Confident | 79.1 | Confident | 32 Ų | 32 | 84.4 Ų | 84.4 | 22% | 0.224 | 40% | 0.404 | C | S | . | . | trans | -63.6 | 146.4 | 177.4 | -179.2 | 0 | 0 | 0 | 0 | 111.3 | D135 R136 Y138 | S133-D135 WeakPolarHBondContact CB-OD1 3.43Å; S133-D135 PolarHBondContact O-N 3.19Å; S133-D135 PolarHBondContact OG-OD1 3.09Å; S133-D135 PolarHBondContact OG-OD2 3.14Å; S133-R136 PolarHBondContact O-N 3.01Å; S133-Y138 WeakPolarHBondContact CB-O 3.36Å; S133-Y138 PolarHBondContact N-O 3.16Å | ||
| 134 | P | 77.7 | Confident | 78.8 | Confident | 112 Ų | 112 | 83.6 Ų | 83.6 | 73% | 0.727 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.9 | -29.7 | 177.3 | -24.6 | 34.4 | 0 | 0 | 0 | 114.1 | R136 | P134-R136 VanDerWaalsContact C-N 3.25Å; P134-R136 PolarHBondContact O-N 3.28Å |
| 135 | D | 75.8 | Confident | 78.7 | Confident | 80 Ų | 80 | 82.6 Ų | 82.6 | 43% | 0.428 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -76.7 | -9.2 | 176.8 | 60.1 | 12.2 | 0 | 0 | 0 | 113.8 | S133 E137 | S133-D135 WeakPolarHBondContact CB-OD1 3.43Å; S133-D135 PolarHBondContact O-N 3.19Å; S133-D135 PolarHBondContact OG-OD1 3.09Å; S133-D135 PolarHBondContact OG-OD2 3.14Å; D135-E137 HydrophobicContact CB-CG 4.42Å; D135-E137 PolarHBondContact O-N 3.22Å; D135-E137 PolarHBondContact OD1-N 2.93Å |
| 136 | R | 76.9 | Confident | 78.8 | Confident | 111 Ų | 111 | 86.9 Ų | 86.9 | 42% | 0.419 | 41% | 0.413 | S | S | . | . | S | Bend | trans | 62 | 23 | -176.8 | -49.5 | 167.8 | -69.9 | -161.5 | 1.3 | 113.5 | I89 E93 S133 P134 L192 | I89-R136 HydrophobicContact CD1-CG 4.17Å; E93-R136 IonicContact OE1-NH1 3.8Å; E93-R136 IonicContact OE2-NH1 2.8Å; E93-R136 PolarHBondContact OE2-NH1 3.28Å; S133-R136 PolarHBondContact O-N 3.01Å; P134-R136 VanDerWaalsContact C-N 3.25Å; P134-R136 PolarHBondContact O-N 3.28Å; R136-L192 WeakPolarHBondContact O-CD1 2.95Å |
| 137 | E | 78.3 | Confident | 78.1 | Confident | 117 Ų | 117 | 83 Ų | 83 | 55% | 0.547 | 42% | 0.415 | S | S | . | . | S | Bend | trans | -101.8 | -22.2 | 179 | -63.6 | -161.8 | 138.9 | 0 | 0 | 113.3 | D135 L192 | D135-E137 HydrophobicContact CB-CG 4.42Å; D135-E137 PolarHBondContact O-N 3.22Å; D135-E137 PolarHBondContact OD1-N 2.93Å; E137-L192 VanDerWaalsContact O-CG 3.23Å; E137-L192 WeakPolarHBondContact O-CG 3.35Å; E137-L192 PolarHBondContact O-N 3.01Å |
| 138 | Y | 79.1 | Confident | 77.5 | Confident | 95 Ų | 95 | 89 Ų | 89 | 37% | 0.373 | 44% | 0.442 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129 | 146.4 | -175.4 | -62.1 | -84.1 | 0 | 0 | 0 | 111.8 | S133 P191 | S133-Y138 WeakPolarHBondContact CB-O 3.36Å; S133-Y138 PolarHBondContact N-O 3.16Å; Y138-P191 HydrophobicContact CE1-CB 4.26Å; Y138-P191 HydrophobicContact CE1-CG 4.14Å |
| 139 | A | 83.9 | Confident | 77 | Confident | 3 Ų | 3 | 93.8 Ų | 93.8 | 3% | 0.025 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 131.6 | 169.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | I117 E131 I132 F141 L192 | I117-A139 HydrophobicContact CD1-CB 3.8Å; I117-A139 HydrophobicContact CG1-CB 4.38Å; E131-A139 CarbonylContact O-C 3.57Å; E131-A139 WeakPolarHBondContact O-CA 3.42Å; I132-A139 HydrophobicContact CG1-CB 4.43Å; A139-F141 HydrophobicContact CB-CE2 3.76Å; A139-F141 HydrophobicContact CB-CZ 3.93Å; A139-L192 HydrophobicContact CB-CD2 4.13Å |
| 140 | L | 82.6 | Confident | 76 | Confident | 77 Ų | 77 | 94.3 Ų | 94.3 | 40% | 0.403 | 47% | 0.466 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.8 | 131.9 | 172.8 | -176.7 | 69.1 | 0 | 0 | 0 | 108.8 | Y130 E131 T187 | Y130-L140 CarbonylContact C-O 3.51Å; Y130-L140 WeakPolarHBondContact CA-O 3.23Å; E131-L140 HydrophobicContact CB-CB 4.4Å; E131-L140 PolarHBondContact N-O 3.45Å; E131-L140 PolarHBondContact O-N 3.09Å; L140-T187 HydrophobicContact CD1-CG2 4.3Å |
| 141 | F | 83.4 | Confident | 74.6 | Confident | 22 Ų | 22 | 98.6 Ų | 98.6 | 10% | 0.096 | 50% | 0.496 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 134.6 | 174.4 | -62.7 | -82.1 | 0 | 0 | 0 | 109.9 | I117 I122 A127 A139 | I117-F141 HydrophobicContact CD1-CE1 4.07Å; I117-F141 HydrophobicContact CD1-CZ 3.77Å; I117-F141 HydrophobicContact CG1-CZ 4.28Å; I117-F141 HydrophobicContact CG2-CE1 4.13Å; I117-F141 HydrophobicContact CG2-CZ 3.82Å; I122-F141 HydrophobicContact CG1-CE1 4Å; A127-F141 HydrophobicContact CB-CB 4.02Å; A127-F141 HydrophobicContact CB-CD1 3.8Å; A127-F141 HydrophobicContact CB-CG 4.32Å; A139-F141 HydrophobicContact CB-CE2 3.76Å; A139-F141 HydrophobicContact CB-CZ 3.93Å |
| 142 | S | 79.8 | Confident | 72.7 | Confident | 40 Ų | 40 | 103 Ų | 103 | 28% | 0.28 | 51% | 0.514 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.7 | 123.5 | 171.5 | 68.8 | 0 | 0 | 0 | 0 | 110.3 | I128 R129 | I128-S142 PolarHBondContact N-O 2.93Å; R129-S142 VanDerWaalsContact CB-OG 3.28Å; R129-S142 WeakPolarHBondContact CB-OG 3.34Å; R129-S142 PolarHBondContact N-OG 3.35Å; R129-S142 PolarHBondContact O-N 3.5Å; R129-S142 PolarHBondContact O-OG 2.82Å |
| 143 | Y | 80.6 | Confident | 71.1 | Confident | 104 Ų | 104 | 107.5 Ų | 107.5 | 41% | 0.408 | 55% | 0.547 | S | S | . | . | trans | -117.9 | 162.3 | 175.9 | 60.7 | -86 | 0 | 0 | 0 | 110.1 | V145 | Y143-V145 VanDerWaalsContact C-N 3.34Å; Y143-V145 PolarHBondContact O-N 2.8Å | ||
| 144 | N | 75.9 | Confident | 69.3 | Low | 136 Ų | 136 | 117.3 Ų | 117.3 | 73% | 0.727 | 58% | 0.579 | S | S | * | * | S | Bend | trans | 52.4 | 45 | 177.8 | -60.5 | -13.5 | 0 | 0 | 0 | 114.5 | E146 | N144-E146 PolarHBondContact O-N 2.83Š|
| 145 | V | 73.7 | Confident | 67.4 | Low | 70 Ų | 70 | 121 Ų | 121 | 42% | 0.424 | 58% | 0.584 | S | S | . | * | trans | -81.1 | 112.4 | 178.7 | -176.1 | 0 | 0 | 0 | 0 | 109.5 | I128 Y143 | I128-V145 HydrophobicContact CB-CG2 4.35Å; I128-V145 HydrophobicContact CD1-CB 3.73Å; I128-V145 HydrophobicContact CD1-CG2 4.01Å; Y143-V145 VanDerWaalsContact C-N 3.34Å; Y143-V145 PolarHBondContact O-N 2.8Å | ||
| 146 | E | 77.7 | Confident | 65.5 | Low | 161 Ų | 161 | 124.5 Ų | 124.5 | 75% | 0.752 | 60% | 0.601 | S | S | * | * | trans | -96.2 | 128.7 | 170.3 | -67.2 | -175.7 | 174.9 | 0 | 0 | 110.4 | N144 M148 | N144-E146 PolarHBondContact O-N 2.83Å; E146-M148 PolarHBondContact O-N 3.44Å; E146-M148 VanDerWaalsContact O-N 3.15Å | ||
| 147 | P | 64.9 | Low | 63.3 | Low | 129 Ų | 129 | 125 Ų | 125 | 84% | 0.838 | 62% | 0.617 | S | S | * | * | trans | -71.2 | 112.3 | -178.9 | 27.3 | -32.4 | 0 | 0 | 0 | 110.7 | ||||
| 148 | M | 61.5 | Low | 61.3 | Low | 141 Ų | 141 | 125.9 Ų | 125.9 | 70% | 0.695 | 63% | 0.625 | S | S | * | * | trans | -78.4 | 134.1 | 170.3 | -57.6 | -167.8 | -170.3 | 0 | 0 | 110.4 | E146 K150 L183 | E146-M148 PolarHBondContact O-N 3.44Å; E146-M148 VanDerWaalsContact O-N 3.15Å; M148-K150 PolarHBondContact O-N 2.98Å; M148-L183 HydrophobicContact CE-CD1 3.57Å | ||
| 149 | K | 64.8 | Low | 58.9 | Low | 198 Ų | 198 | 127 Ų | 127 | 86% | 0.861 | 64% | 0.643 | S | S | * | * | trans | -64.4 | 122.2 | 174.1 | -65.6 | -179.9 | -177.9 | 175.8 | 0 | 108.7 | V151 | K149-V151 PolarHBondContact O-N 3.45Š| ||
| 150 | K | 57.8 | Low | 56.7 | Low | 189 Ų | 189 | 136 Ų | 136 | 82% | 0.822 | 68% | 0.684 | S | S | * | * | trans | -61.8 | 105.8 | 174.9 | -67.3 | -174.3 | -179 | -177.9 | 0 | 109.1 | M148 K152 | M148-K150 PolarHBondContact O-N 2.98Å; K150-K152 PolarHBondContact O-N 2.86Å | ||
| 151 | V | 49.5 | Very low | 54.5 | Low | 129 Ų | 129 | 137.2 Ų | 137.2 | 78% | 0.782 | 70% | 0.699 | S | S | * | * | trans | -72.5 | 113.2 | 169.7 | 179.2 | 0 | 0 | 0 | 0 | 107.4 | K149 S153 | K149-V151 PolarHBondContact O-N 3.45Å; V151-S153 PolarHBondContact O-N 2.85Å | ||
| 152 | K | 43.8 | Very low | 51.8 | Low | 198 Ų | 198 | 145.3 Ų | 145.3 | 86% | 0.861 | 74% | 0.735 | S | S | * | * | trans | -62.5 | 104.6 | 169.9 | -78 | -177.4 | 178 | 178.2 | 0 | 107.7 | K150 R154 | K150-K152 PolarHBondContact O-N 2.86Å; K152-R154 PolarHBondContact O-N 2.93Å | ||
| 153 | S | 47.9 | Very low | 49.3 | Very low | 113 Ų | 113 | 148 Ų | 148 | 79% | 0.79 | 75% | 0.753 | S | S | * | * | trans | -61.8 | 107.7 | 170.3 | -63.4 | 0 | 0 | 0 | 0 | 107.7 | V151 K155 | V151-S153 PolarHBondContact O-N 2.85Å; S153-K155 PolarHBondContact O-N 3.47Å | ||
| 154 | R | 40.2 | Very low | 46.9 | Very low | 239 Ų | 239 | 149.3 Ų | 149.3 | 90% | 0.902 | 78% | 0.776 | S | S | * | * | trans | -63.2 | 121.6 | 165.7 | -73.5 | -175.2 | -173.7 | -174.9 | 2.2 | 106 | K152 L156 | K152-R154 PolarHBondContact O-N 2.93Å; R154-L156 PolarHBondContact O-N 2.96Å | ||
| 155 | K | 37.8 | Very low | 44.7 | Very low | 190 Ų | 190 | 149.1 Ų | 149.1 | 83% | 0.826 | 78% | 0.775 | S | S | * | * | trans | -59.4 | 100.7 | 176.9 | -167.2 | 169.3 | -175 | 178.5 | 0 | 107.9 | S153 T157 | S153-K155 PolarHBondContact O-N 3.47Å; K155-T157 PolarHBondContact O-N 2.99Å; K155-T157 PolarHBondContact O-OG1 2.58Å | ||
| 156 | L | 35.7 | Very low | 42.7 | Very low | 152 Ų | 152 | 151.3 Ų | 151.3 | 80% | 0.796 | 79% | 0.794 | S | S | * | * | trans | -67.8 | 104.8 | 172.3 | -163.2 | 76.4 | 0 | 0 | 0 | 106.2 | R154 L158 | R154-L156 PolarHBondContact O-N 2.96Å; L156-L158 HydrophobicContact CD2-CD2 4.42Å; L156-L158 PolarHBondContact O-N 3.2Å | ||
| 157 | T | 30.5 | Very low | 40.3 | Very low | 121 Ų | 121 | 152.3 Ų | 152.3 | 74% | 0.742 | 80% | 0.803 | S | S | * | * | trans | -83.1 | 98.8 | 178.9 | -48.9 | 0 | 0 | 0 | 0 | 105.5 | K155 | K155-T157 PolarHBondContact O-N 2.99Å; K155-T157 PolarHBondContact O-OG1 2.58Å | ||
| 158 | L | 36.4 | Very low | 38.4 | Very low | 137 Ų | 137 | 150.6 Ų | 150.6 | 72% | 0.717 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 127.9 | 172.4 | -72.9 | 166.5 | 0 | 0 | 0 | 108.1 | L156 H160 | L156-L158 HydrophobicContact CD2-CD2 4.42Å; L156-L158 PolarHBondContact O-N 3.2Å; L158-H160 PolarHBondContact O-N 3.01Å |
| 159 | P | 29.3 | Very low | 37.1 | Very low | 117 Ų | 117 | 150.7 Ų | 150.7 | 76% | 0.76 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 135.4 | 174 | 24.7 | -30.4 | 0 | 0 | 0 | 109.8 | ||
| 160 | H | 37.3 | Very low | 35.2 | Very low | 192 Ų | 192 | 146.6 Ų | 146.6 | 89% | 0.889 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 148.2 | 172.5 | -113.4 | 58 | 0 | 0 | 0 | 111.1 | L158 | L158-H160 PolarHBondContact O-N 3.01Š|
| 161 | S | 35.7 | Very low | 34.2 | Very low | 103 Ų | 103 | 146.4 Ų | 146.4 | 72% | 0.72 | 81% | 0.806 | S | S | * | * | trans | 86.2 | 111.4 | 175.6 | -159.2 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 162 | K | 26.8 | Very low | 33.2 | Very low | 193 Ų | 193 | 144.6 Ų | 144.6 | 84% | 0.839 | 81% | 0.805 | S | S | * | * | -154.8 | 158.3 | 55.7 | -69.3 | -175.9 | 179.8 | -173.4 | 0 | 112.8 | |||||
| 163 | S | 27.5 | Very low | 32.1 | Very low | 96 Ų | 96 | 141.7 Ų | 141.7 | 67% | 0.671 | 81% | 0.808 | S | S | * | * | trans | -33.2 | 131.3 | 172.1 | -161.3 | 0 | 0 | 0 | 0 | 115.7 | D165 | S163-D165 PolarHBondContact O-N 3.16Š| ||
| 164 | C | 29.3 | Very low | 30.9 | Very low | 132 Ų | 132 | 141.7 Ų | 141.7 | 89% | 0.892 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -80 | 67.3 | 165.8 | -74.2 | 0 | 0 | 0 | 0 | 109.9 | ||
| 165 | D | 30.6 | Very low | 30.7 | Very low | 131 Ų | 131 | 135.8 Ų | 135.8 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | trans | -133.6 | 131.5 | 160.8 | -79.6 | -50.4 | 0 | 0 | 0 | 107 | S163 | S163-D165 PolarHBondContact O-N 3.16Š| ||
| 166 | S | 30.9 | Very low | 30.1 | Very low | 116 Ų | 116 | 131.5 Ų | 131.5 | 81% | 0.811 | 80% | 0.801 | S | S | * | * | trans | 70.5 | 93.6 | -179.6 | 56.8 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 167 | L | 28.5 | Very low | 29.6 | Very low | 182 Ų | 182 | 130.7 Ų | 130.7 | 95% | 0.953 | 81% | 0.806 | S | S | * | * | -160.8 | 130.1 | 123.9 | -101.5 | 145.1 | 0 | 0 | 0 | 110.3 | |||||
| 168 | A | 25.4 | Very low | 29.4 | Very low | 94 Ų | 94 | 133.8 Ų | 133.8 | 78% | 0.777 | 81% | 0.812 | S | S | * | * | trans | -69.6 | 161.1 | -167.4 | 0 | 0 | 0 | 0 | 0 | 114 | S170 | A168-S170 PolarHBondContact O-N 2.98Š| ||
| 169 | V | 34.6 | Very low | 29.2 | Very low | 143 Ų | 143 | 136 Ų | 136 | 87% | 0.867 | 82% | 0.819 | S | S | * | * | trans | -43.7 | 121.5 | 162.3 | 174.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 170 | S | 24.8 | Very low | 29.1 | Very low | 111 Ų | 111 | 132.9 Ų | 132.9 | 78% | 0.776 | 81% | 0.807 | S | S | * | * | trans | -142.4 | 117.6 | 151.6 | -163.1 | 0 | 0 | 0 | 0 | 109.6 | A168 A172 | A168-S170 PolarHBondContact O-N 2.98Å; S170-A172 PolarHBondContact O-N 2.91Å | ||
| 171 | Q | 35.6 | Very low | 28.6 | Very low | 185 Ų | 185 | 129.6 Ų | 129.6 | 86% | 0.864 | 81% | 0.805 | S | S | * | * | trans | -55.2 | 121.2 | 160.9 | -79.4 | 160.7 | -53.4 | 0 | 0 | 109.3 | ||||
| 172 | A | 27.8 | Very low | 28.2 | Very low | 91 Ų | 91 | 133.4 Ų | 133.4 | 75% | 0.752 | 81% | 0.809 | S | S | * | * | trans | 172.9 | 104.5 | 142.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | S170 | S170-A172 PolarHBondContact O-N 2.91Š| ||
| 173 | C | 20.8 | Very low | 28.3 | Very low | 138 Ų | 138 | 129.9 Ų | 129.9 | 93% | 0.932 | 80% | 0.799 | S | S | * | * | trans | 168.8 | 105.4 | 138.3 | -95.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 174 | S | 23.6 | Very low | 28.2 | Very low | 113 Ų | 113 | 133.6 Ų | 133.6 | 79% | 0.79 | 81% | 0.805 | S | S | * | * | trans | -103.9 | 163.2 | 142.2 | -145.9 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 175 | P | 35.8 | Very low | 28.3 | Very low | 114 Ų | 114 | 133.7 Ų | 133.7 | 74% | 0.74 | 79% | 0.787 | S | S | * | * | S | Bend | cis | -136.6 | 111.6 | -10.8 | 29.8 | -7.9 | 0 | 0 | 0 | 111.7 | ||
| 176 | A | 26.2 | Very low | 28.4 | Very low | 101 Ų | 101 | 133 Ų | 133 | 84% | 0.835 | 78% | 0.782 | S | S | * | * | trans | -161.9 | 54.4 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 177 | C | 24.2 | Very low | 28.6 | Very low | 134 Ų | 134 | 129.3 Ų | 129.3 | 91% | 0.905 | 76% | 0.755 | S | S | * | * | trans | -108 | 109.6 | 163 | -85 | 0 | 0 | 0 | 0 | 108.7 | Q179 | C177-Q179 PolarHBondContact O-N 2.82Å; C177-Q179 VanDerWaalsContact O-N 3.14Å | ||
| 178 | H | 26.3 | Very low | 29 | Very low | 187 Ų | 187 | 125.6 Ų | 125.6 | 87% | 0.866 | 73% | 0.734 | S | S | * | * | trans | -28.4 | 111.5 | 169.9 | -92.2 | -103.6 | 0 | 0 | 0 | 113 | G180 | H178-G180 VanDerWaalsContact C-N 3.32Å; H178-G180 PolarHBondContact O-N 3.17Å | ||
| 179 | Q | 31.9 | Very low | 29.6 | Very low | 184 Ų | 184 | 124.4 Ų | 124.4 | 86% | 0.86 | 72% | 0.72 | S | S | * | * | trans | -3.7 | 82.9 | 132.7 | -139 | 142.4 | 0.1 | 0 | 0 | 113.6 | C177 C181 | C177-Q179 PolarHBondContact O-N 2.82Å; C177-Q179 VanDerWaalsContact O-N 3.14Å; Q179-C181 PolarHBondContact O-N 3.35Å | ||
| 180 | G | 27.5 | Very low | 29.9 | Very low | 50 Ų | 50 | 120.4 Ų | 120.4 | 52% | 0.515 | 69% | 0.693 | S | S | . | * | trans | -79.3 | 103.8 | 162.5 | 0 | 0 | 0 | 0 | 0 | 107.1 | H178 F182 | H178-G180 VanDerWaalsContact C-N 3.32Å; H178-G180 PolarHBondContact O-N 3.17Å; G180-F182 VanDerWaalsContact C-N 3.34Å; G180-F182 WeakPolarHBondContact O-CD2 3.1Å; G180-F182 PolarHBondContact O-N 3.06Å | ||
| 181 | C | 26 | Very low | 30.6 | Very low | 123 Ų | 123 | 116.6 Ų | 116.6 | 83% | 0.831 | 67% | 0.666 | S | S | * | * | trans | -59.1 | 96.7 | 169.5 | -65.5 | 0 | 0 | 0 | 0 | 108.9 | Q179 L183 | Q179-C181 PolarHBondContact O-N 3.35Å; C181-L183 PolarHBondContact O-N 3.48Å | ||
| 182 | F | 27.5 | Very low | 30.7 | Very low | 183 Ų | 183 | 109.3 Ų | 109.3 | 80% | 0.803 | 63% | 0.633 | S | S | * | * | trans | -79.1 | 108.4 | 165.4 | -68.9 | -80.9 | 0 | 0 | 0 | 107.4 | G180 H184 | G180-F182 VanDerWaalsContact C-N 3.34Å; G180-F182 WeakPolarHBondContact O-CD2 3.1Å; G180-F182 PolarHBondContact O-N 3.06Å; F182-H184 PolarHBondContact O-N 3.11Å; F182-H184 VanDerWaalsContact O-N 3.15Å | ||
| 183 | L | 28.8 | Very low | 31.3 | Very low | 120 Ų | 120 | 110.9 Ų | 110.9 | 63% | 0.628 | 63% | 0.625 | S | S | * | * | trans | -73.2 | 105.1 | 173 | -142.2 | 132.5 | 0 | 0 | 0 | 107.3 | M148 C181 Y185 | M148-L183 HydrophobicContact CE-CD1 3.57Å; C181-L183 PolarHBondContact O-N 3.48Å; L183-Y185 PolarHBondContact O-N 3.47Å | ||
| 184 | H | 26.6 | Very low | 32.3 | Very low | 173 Ų | 173 | 107 Ų | 107 | 80% | 0.801 | 60% | 0.598 | S | S | * | * | trans | -69.4 | 109.5 | 170.6 | -77.9 | -95.3 | 0 | 0 | 0 | 108.3 | F182 | F182-H184 PolarHBondContact O-N 3.11Å; F182-H184 VanDerWaalsContact O-N 3.15Å | ||
| 185 | Y | 30.1 | Very low | 33.4 | Very low | 135 Ų | 135 | 102.6 Ų | 102.6 | 53% | 0.529 | 57% | 0.566 | S | S | . | * | trans | -94.8 | 123.2 | 166.3 | 52.4 | -84.8 | 0 | 0 | 0 | 107.9 | L183 T187 | L183-Y185 PolarHBondContact O-N 3.47Å; Y185-T187 HydrophobicContact CD2-CG2 3.44Å; Y185-T187 VanDerWaalsContact CD2-CG2 3.44Å; Y185-T187 HydrophobicContact CE2-CG2 3.64Å; Y185-T187 PolarHBondContact O-N 3.16Å | ||
| 186 | I | 32.7 | Very low | 33.3 | Very low | 116 Ų | 116 | 106.8 Ų | 106.8 | 60% | 0.595 | 57% | 0.567 | S | S | * | * | trans | -81.5 | 102.3 | 173.1 | -61.2 | 174.5 | 0 | 0 | 0 | 106.3 | M188 | I186-M188 HydrophobicContact CG2-CG 4.21Š| ||
| 187 | T | 36.1 | Very low | 33.6 | Very low | 39 Ų | 39 | 107.4 Ų | 107.4 | 24% | 0.239 | 56% | 0.556 | C | S | . | * | trans | -82.2 | 114.1 | 170.1 | 53 | 0 | 0 | 0 | 0 | 109.2 | L140 Y185 G275 | L140-T187 HydrophobicContact CD1-CG2 4.3Å; Y185-T187 HydrophobicContact CD2-CG2 3.44Å; Y185-T187 VanDerWaalsContact CD2-CG2 3.44Å; Y185-T187 HydrophobicContact CE2-CG2 3.64Å; Y185-T187 PolarHBondContact O-N 3.16Å; T187-G275 PolarHBondContact OG1-O 3.35Å | ||
| 188 | M | 36.8 | Very low | 33.9 | Very low | 103 Ų | 103 | 108.9 Ų | 108.9 | 51% | 0.507 | 54% | 0.544 | S | S | . | . | trans | -98.7 | 111.8 | 166.2 | -65.4 | -118.3 | 96 | 0 | 0 | 108.4 | I186 | I186-M188 HydrophobicContact CG2-CG 4.21Š| ||
| 189 | S | 36.9 | Very low | 34.1 | Very low | 69 Ų | 69 | 103.1 Ų | 103.1 | 48% | 0.483 | 52% | 0.521 | S | S | . | . | trans | -87.7 | 108.9 | 168.7 | 51.5 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 190 | L | 41.9 | Very low | 33.9 | Very low | 59 Ų | 59 | 99.1 Ų | 99.1 | 31% | 0.309 | 51% | 0.514 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.5 | 133 | 176.8 | -76.4 | 142.5 | 0 | 0 | 0 | 109.7 | ||
| 191 | P | 38.5 | Very low | 34 | Very low | 31 Ų | 31 | 100.3 Ų | 100.3 | 20% | 0.201 | 52% | 0.519 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.2 | 138.3 | 169.7 | -17.1 | 29.2 | 0 | 0 | 0 | 110.7 | Y138 H193 C194 L195 | Y138-P191 HydrophobicContact CE1-CB 4.26Å; Y138-P191 HydrophobicContact CE1-CG 4.14Å; P191-H193 WeakPolarHBondContact CB-CE1 3.47Å; P191-H193 WeakPolarHBondContact CB-ND1 3.3Å; P191-H193 PolarHBondContact O-N 3.04Å; P191-C194 PolarHBondContact O-N 3.45Å; P191-C194 VanDerWaalsContact O-N 3.15Å; P191-L195 PolarHBondContact O-N 3.45Å |
| 192 | L | 38.3 | Very low | 34.2 | Very low | 33 Ų | 33 | 99.2 Ų | 99.2 | 17% | 0.173 | 51% | 0.508 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -60.9 | -27.9 | -177.9 | -72.9 | 172.3 | 0 | 0 | 0 | 113.6 | I117 R136 E137 A139 L195 | I117-L192 HydrophobicContact CG1-CD2 4.5Å; R136-L192 WeakPolarHBondContact O-CD1 2.95Å; E137-L192 VanDerWaalsContact O-CG 3.23Å; E137-L192 WeakPolarHBondContact O-CG 3.35Å; E137-L192 PolarHBondContact O-N 3.01Å; A139-L192 HydrophobicContact CB-CD2 4.13Å; L192-L195 HydrophobicContact CD2-CD1 4.11Å; L192-L195 WeakPolarHBondContact O-CB 3.39Å; L192-L195 PolarHBondContact O-N 3.49Å |
| 193 | H | 41.6 | Very low | 34.2 | Very low | 124 Ų | 124 | 98.1 Ų | 98.1 | 57% | 0.574 | 51% | 0.511 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.5 | -37.7 | 176.9 | 63 | -91.7 | 0 | 0 | 0 | 112.7 | P191 L195 R196 D197 | P191-H193 WeakPolarHBondContact CB-CE1 3.47Å; P191-H193 WeakPolarHBondContact CB-ND1 3.3Å; P191-H193 PolarHBondContact O-N 3.04Å; H193-L195 PolarHBondContact O-N 3.16Å; H193-R196 VanDerWaalsContact O-CB 3.23Å; H193-R196 WeakPolarHBondContact O-CB 3.49Å; H193-R196 PolarHBondContact O-N 3.44Å; H193-D197 PolarHBondContact O-N 3.04Å |
| 194 | C | 41.5 | Very low | 34.1 | Very low | 56 Ų | 56 | 94.9 Ų | 94.9 | 38% | 0.378 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.1 | -29.5 | 174.6 | -65.1 | 0 | 0 | 0 | 0 | 112.3 | P191 R196 Y198 | P191-C194 PolarHBondContact O-N 3.45Å; P191-C194 VanDerWaalsContact O-N 3.15Å; C194-R196 PolarHBondContact O-N 3.19Å; C194-Y198 PolarHBondContact O-N 3.12Å |
| 195 | L | 45.3 | Very low | 34 | Very low | 20 Ų | 20 | 98.3 Ų | 98.3 | 11% | 0.105 | 51% | 0.514 | C | S | . | . | H | α-helix | trans | -68.8 | -24.6 | 173.2 | -66.4 | 173.5 | 0 | 0 | 0 | 112 | K121 P191 L192 H193 | K121-L195 HydrophobicContact CD-CB 4.18Å; K121-L195 HydrophobicContact CD-CD2 4.34Å; K121-L195 WeakPolarHBondContact CE-O 3.46Å; K121-L195 VanDerWaalsContact NZ-C 3.3Å; K121-L195 PolarHBondContact NZ-O 2.72Å; P191-L195 PolarHBondContact O-N 3.45Å; L192-L195 HydrophobicContact CD2-CD1 4.11Å; L192-L195 WeakPolarHBondContact O-CB 3.39Å; L192-L195 PolarHBondContact O-N 3.49Å; H193-L195 PolarHBondContact O-N 3.16Å |
| 196 | R | 34.5 | Very low | 33.7 | Very low | 203 Ų | 203 | 97.3 Ų | 97.3 | 77% | 0.766 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -74.9 | -41.8 | -179 | -161.4 | 171.9 | -169.6 | 174.8 | 1.5 | 111.4 | H193 C194 | H193-R196 VanDerWaalsContact O-CB 3.23Å; H193-R196 WeakPolarHBondContact O-CB 3.49Å; H193-R196 PolarHBondContact O-N 3.44Å; C194-R196 PolarHBondContact O-N 3.19Å |
| 197 | D | 31.5 | Very low | 33.8 | Very low | 113 Ų | 113 | 98.7 Ų | 98.7 | 60% | 0.604 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -79.1 | -27.9 | -177.4 | -60.3 | -34 | 0 | 0 | 0 | 113 | H193 V199 S200 | H193-D197 PolarHBondContact O-N 3.04Å; D197-V199 PolarHBondContact O-N 3.36Å; D197-S200 PolarHBondContact O-N 3.5Å; D197-S200 VanDerWaalsContact O-N 3.08Å |
| 198 | Y | 30.6 | Very low | 33.3 | Very low | 166 Ų | 166 | 101 Ų | 101 | 65% | 0.651 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -59.7 | -31.8 | 174.9 | -167.8 | -97 | 0 | 0 | 0 | 112.8 | C194 S200 A201 V202 | C194-Y198 PolarHBondContact O-N 3.12Å; Y198-S200 VanDerWaalsContact C-N 3.33Å; Y198-A201 PolarHBondContact O-N 2.93Å; Y198-V202 HydrophobicContact CE1-CG2 4.48Å; Y198-V202 WeakPolarHBondContact O-CG2 3.21Å |
| 199 | V | 31.5 | Very low | 32.7 | Very low | 65 Ų | 65 | 103.9 Ų | 103.9 | 39% | 0.394 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -71.8 | -27.9 | 178.3 | 176.9 | 0 | 0 | 0 | 0 | 111.8 | D197 A201 | D197-V199 PolarHBondContact O-N 3.36Å; V199-A201 VanDerWaalsContact C-N 3.31Å; V199-A201 PolarHBondContact O-N 3.02Å |
| 200 | S | 28.3 | Very low | 32.1 | Very low | 100 Ų | 100 | 106.1 Ų | 106.1 | 70% | 0.699 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -74.6 | -22.4 | 179.9 | -155 | 0 | 0 | 0 | 0 | 112.9 | D197 Y198 | D197-S200 PolarHBondContact O-N 3.5Å; D197-S200 VanDerWaalsContact O-N 3.08Å; Y198-S200 VanDerWaalsContact C-N 3.33Å |
| 201 | A | 29 | Very low | 31.2 | Very low | 75 Ų | 75 | 107.9 Ų | 107.9 | 62% | 0.62 | 62% | 0.616 | S | S | * | * | G | 310 helix | trans | -82.7 | -13.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y198 V199 N203 | Y198-A201 PolarHBondContact O-N 2.93Å; V199-A201 VanDerWaalsContact C-N 3.31Å; V199-A201 PolarHBondContact O-N 3.02Å; A201-N203 VanDerWaalsContact C-N 3.3Å; A201-N203 PolarHBondContact O-N 3.2Å |
| 202 | V | 30.2 | Very low | 30.6 | Very low | 100 Ų | 100 | 112.1 Ų | 112.1 | 61% | 0.606 | 65% | 0.645 | S | S | * | * | G | 310 helix | trans | -87.7 | 8.2 | -173 | -178.8 | 0 | 0 | 0 | 0 | 113.3 | Y198 | Y198-V202 HydrophobicContact CE1-CG2 4.48Å; Y198-V202 WeakPolarHBondContact O-CG2 3.21Å |
| 203 | N | 28.4 | Very low | 29.8 | Very low | 161 Ų | 161 | 118.5 Ų | 118.5 | 86% | 0.861 | 67% | 0.674 | S | S | * | * | G | 310 helix | trans | -93.2 | 17 | 174.1 | -78.8 | -15.3 | 0 | 0 | 0 | 114.6 | A201 | A201-N203 VanDerWaalsContact C-N 3.3Å; A201-N203 PolarHBondContact O-N 3.2Å |
| 204 | G | 26.6 | Very low | 29.1 | Very low | 52 Ų | 52 | 118.9 Ų | 118.9 | 54% | 0.536 | 69% | 0.685 | S | S | . | * | S | Bend | trans | -152.6 | 115.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | S206 | G204-S206 PolarHBondContact O-N 2.94Š|
| 205 | Y | 23.7 | Very low | 28.4 | Very low | 244 Ų | 244 | 124.6 Ų | 124.6 | 96% | 0.957 | 71% | 0.706 | S | S | * | * | trans | -48 | 126.8 | -172.6 | -61 | -93.4 | 0 | 0 | 0 | 115.1 | ||||
| 206 | S | 22.8 | Very low | 27.6 | Very low | 115 Ų | 115 | 127.5 Ų | 127.5 | 80% | 0.804 | 74% | 0.74 | S | S | * | * | -167.8 | 119.9 | 125.5 | -159.6 | 0 | 0 | 0 | 0 | 111 | G204 | G204-S206 PolarHBondContact O-N 2.94Š| |||
| 207 | T | 36.7 | Very low | 27.4 | Very low | 145 Ų | 145 | 120.9 Ų | 120.9 | 89% | 0.89 | 74% | 0.736 | S | S | * | * | trans | -79.4 | 111.9 | 173.6 | 45.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 208 | A | 24.7 | Very low | 27.2 | Very low | 86 Ų | 86 | 120.8 Ų | 120.8 | 71% | 0.711 | 74% | 0.741 | S | S | * | * | trans | -154.1 | 98.4 | 157.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | P210 | A208-P210 WeakPolarHBondContact O-CD 3.47Š| ||
| 209 | L | 25 | Very low | 27.6 | Very low | 164 Ų | 164 | 118.9 Ų | 118.9 | 86% | 0.859 | 75% | 0.747 | S | S | * | * | trans | -70.2 | 124.6 | 161.4 | -75.2 | 162.3 | 0 | 0 | 0 | 107.4 | A211 | L209-A211 PolarHBondContact O-N 3.14Å; L209-A211 VanDerWaalsContact O-N 3.12Å | ||
| 210 | P | 24.2 | Very low | 27.7 | Very low | 116 Ų | 116 | 120.1 Ų | 120.1 | 75% | 0.753 | 76% | 0.758 | S | S | * | * | trans | -72 | 106.6 | 166 | 27.9 | -28.5 | 0 | 0 | 0 | 108 | A208 C212 | A208-P210 WeakPolarHBondContact O-CD 3.47Å; P210-C212 PolarHBondContact O-N 3.22Å | ||
| 211 | A | 22.8 | Very low | 28 | Very low | 97 Ų | 97 | 122.4 Ų | 122.4 | 80% | 0.802 | 76% | 0.762 | S | S | * | * | trans | -70.7 | 105.5 | 165.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | L209 H213 | L209-A211 PolarHBondContact O-N 3.14Å; L209-A211 VanDerWaalsContact O-N 3.12Å; A211-H213 PolarHBondContact O-N 3.09Å; A211-H213 VanDerWaalsContact O-N 3.09Å | ||
| 212 | C | 24.6 | Very low | 28.3 | Very low | 120 Ų | 120 | 123.6 Ų | 123.6 | 81% | 0.811 | 76% | 0.757 | S | S | * | * | trans | -71 | 102 | 168.3 | -67.8 | 0 | 0 | 0 | 0 | 108.9 | P210 | P210-C212 PolarHBondContact O-N 3.22Š| ||
| 213 | H | 22.3 | Very low | 28.4 | Very low | 166 Ų | 166 | 123.9 Ų | 123.9 | 77% | 0.769 | 76% | 0.761 | S | S | * | * | trans | -78.6 | 116.3 | 172.6 | -164.3 | -80.5 | 0 | 0 | 0 | 109.3 | A211 Q215 | A211-H213 PolarHBondContact O-N 3.09Å; A211-H213 VanDerWaalsContact O-N 3.09Å; H213-Q215 PolarHBondContact O-N 3.27Å | ||
| 214 | V | 27.5 | Very low | 28.9 | Very low | 132 Ų | 132 | 125.2 Ų | 125.2 | 80% | 0.8 | 75% | 0.754 | S | S | * | * | trans | -84.9 | 107.6 | 174.7 | -179.4 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 215 | Q | 25.3 | Very low | 29.2 | Very low | 176 Ų | 176 | 133.7 Ų | 133.7 | 82% | 0.822 | 77% | 0.77 | S | S | * | * | trans | -85.6 | 122.4 | 167.3 | -120.5 | 171.6 | 16.7 | 0 | 0 | 108.5 | H213 | H213-Q215 PolarHBondContact O-N 3.27Š| ||
| 216 | G | 29.8 | Very low | 29.5 | Very low | 81 Ų | 81 | 126.8 Ų | 126.8 | 84% | 0.835 | 76% | 0.755 | S | S | * | * | trans | -72.6 | 153.1 | -168 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 217 | G | 29.3 | Very low | 30.1 | Very low | 65 Ų | 65 | 131.4 Ų | 131.4 | 67% | 0.67 | 76% | 0.755 | S | S | * | * | trans | -153.3 | 146 | 162.3 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 218 | P | 28.8 | Very low | 29.8 | Very low | 110 Ų | 110 | 131.2 Ų | 131.2 | 71% | 0.714 | 75% | 0.748 | S | S | * | * | trans | -74.8 | 143.2 | -173.1 | 27.9 | -32 | 0 | 0 | 0 | 113.7 | S220 | P218-S220 PolarHBondContact O-N 3.46Š| ||
| 219 | V | 37.5 | Very low | 30.3 | Very low | 127 Ų | 127 | 134.4 Ų | 134.4 | 77% | 0.77 | 75% | 0.748 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.2 | 62.7 | 179.6 | -172.8 | 0 | 0 | 0 | 0 | 110.6 | I222 | V219-I222 HydrophobicContact CG1-CD1 4.07Š|
| 220 | S | 33.7 | Very low | 30.5 | Very low | 90 Ų | 90 | 134 Ų | 134 | 63% | 0.629 | 75% | 0.747 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126 | -10.1 | 173.3 | 46.6 | 0 | 0 | 0 | 0 | 114.1 | P218 | P218-S220 PolarHBondContact O-N 3.46Š|
| 221 | D | 34.3 | Very low | 30.8 | Very low | 148 Ų | 148 | 134.5 Ų | 134.5 | 79% | 0.791 | 75% | 0.752 | S | S | * | * | trans | -107.6 | 21.1 | -176.8 | -70.9 | -36.2 | 0 | 0 | 0 | 114.7 | P223 | D221-P223 WeakPolarHBondContact O-CD 3.23Š| ||
| 222 | I | 36.4 | Very low | 31.1 | Very low | 100 Ų | 100 | 140.6 Ų | 140.6 | 51% | 0.513 | 75% | 0.754 | S | S | . | * | trans | -87.2 | 117.3 | 172 | -53.4 | 177 | 0 | 0 | 0 | 108.5 | V219 W224 | V219-I222 HydrophobicContact CG1-CD1 4.07Å; I222-W224 PolarHBondContact O-N 2.91Å; I222-W224 VanDerWaalsContact O-N 3.09Å | ||
| 223 | P | 31.8 | Very low | 31.5 | Very low | 106 Ų | 106 | 145.9 Ų | 145.9 | 69% | 0.688 | 76% | 0.757 | S | S | * | * | trans | -77.2 | 100 | -175.7 | 29.7 | -31.7 | 0 | 0 | 0 | 110.9 | D221 R225 P226 | D221-P223 WeakPolarHBondContact O-CD 3.23Å; P223-R225 PolarHBondContact O-N 3.17Å; P223-P226 WeakPolarHBondContact O-CD 3.47Å | ||
| 224 | W | 38.3 | Very low | 31.7 | Very low | 189 Ų | 189 | 144.9 Ų | 144.9 | 72% | 0.716 | 76% | 0.762 | S | S | * | * | trans | -76 | 9.9 | -178.9 | -72.7 | 96.3 | 0 | 0 | 0 | 116 | I222 | I222-W224 PolarHBondContact O-N 2.91Å; I222-W224 VanDerWaalsContact O-N 3.09Å | ||
| 225 | R | 32.6 | Very low | 31.7 | Very low | 230 Ų | 230 | 144.4 Ų | 144.4 | 87% | 0.868 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.9 | -14.4 | -173.4 | -73.1 | -165.4 | -171.4 | -147.7 | 4.2 | 118.1 | P223 | P223-R225 PolarHBondContact O-N 3.17Š|
| 226 | P | 31.1 | Very low | 31.8 | Very low | 100 Ų | 100 | 139.9 Ų | 139.9 | 65% | 0.649 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | -11 | 176.1 | -15 | 31.1 | 0 | 0 | 0 | 115.7 | P223 | P223-P226 WeakPolarHBondContact O-CD 3.47Š|
| 227 | W | 35 | Very low | 31.7 | Very low | 212 Ų | 212 | 139.6 Ų | 139.6 | 80% | 0.803 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -99.1 | -9.3 | -166 | -92.8 | 76.8 | 0 | 0 | 0 | 116.2 | ||
| 228 | L | 30.4 | Very low | 31.7 | Very low | 141 Ų | 141 | 148.4 Ų | 148.4 | 74% | 0.738 | 77% | 0.773 | S | S | * | * | S | Bend | trans | -91.4 | -19.4 | -177.3 | -117.1 | 90.4 | 0 | 0 | 0 | 114.5 | ||
| 229 | E | 35 | Very low | 32.1 | Very low | 153 Ų | 153 | 149.9 Ų | 149.9 | 72% | 0.715 | 78% | 0.78 | S | S | * | * | G | 310 helix | trans | -80.6 | -18.4 | -174.4 | -102.1 | 65.6 | -149.5 | 0 | 0 | 114.6 | ||
| 230 | D | 29.2 | Very low | 31.6 | Very low | 156 Ų | 156 | 148.7 Ų | 148.7 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | G | 310 helix | trans | -86.6 | -10.6 | -175.2 | -117.8 | 1.6 | 0 | 0 | 0 | 114.3 | R232 | D230-R232 VanDerWaalsContact C-N 3.28Å; D230-R232 PolarHBondContact O-N 3.4Å |
| 231 | C | 31.5 | Very low | 31.4 | Very low | 126 Ų | 126 | 152.9 Ų | 152.9 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | G | 310 helix | trans | -81.1 | -0.5 | 175.8 | -82.7 | 0 | 0 | 0 | 0 | 114.1 | ||
| 232 | R | 29.2 | Very low | 31 | Very low | 224 Ų | 224 | 149.4 Ų | 149.4 | 85% | 0.845 | 80% | 0.798 | S | S | * | * | G | 310 helix | trans | -110.5 | 20 | -171.1 | -147.4 | -170.6 | 145 | 113.7 | -2.2 | 116 | D230 | D230-R232 VanDerWaalsContact C-N 3.28Å; D230-R232 PolarHBondContact O-N 3.4Å |
| 233 | R | 31.8 | Very low | 30.7 | Very low | 232 Ų | 232 | 151.4 Ų | 151.4 | 88% | 0.875 | 82% | 0.815 | S | S | * | * | trans | -148.9 | 95.8 | 166.6 | -71.6 | -169.2 | -166.7 | 144.1 | 4.9 | 113.8 | ||||
| 234 | V | 26.6 | Very low | 30.6 | Very low | 144 Ų | 144 | 157.5 Ų | 157.5 | 87% | 0.873 | 82% | 0.824 | S | S | * | * | trans | -138 | 111.8 | 145.3 | -175.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 235 | P | 28.4 | Very low | 30.1 | Very low | 122 Ų | 122 | 156 Ų | 156 | 79% | 0.792 | 83% | 0.83 | S | S | * | * | trans | -88.4 | 145.4 | 168.1 | 33 | -27.8 | 0 | 0 | 0 | 111.1 | ||||
| 236 | G | 27.4 | Very low | 29.7 | Very low | 81 Ų | 81 | 155.4 Ų | 155.4 | 84% | 0.835 | 83% | 0.827 | S | S | * | * | trans | 120.9 | 79.7 | 157.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 237 | G | 28.2 | Very low | 29.3 | Very low | 76 Ų | 76 | 156 Ų | 156 | 78% | 0.784 | 83% | 0.833 | S | S | * | * | trans | -79.9 | 150.7 | 160 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 238 | R | 27.4 | Very low | 28.9 | Very low | 249 Ų | 249 | 153 Ų | 153 | 94% | 0.94 | 83% | 0.828 | S | S | * | * | trans | -149.9 | 127.7 | 146 | -114.4 | -175.4 | -76.4 | -175.8 | -1.7 | 110.3 | ||||
| 239 | T | 39.2 | Very low | 28.5 | Very low | 141 Ų | 141 | 150.4 Ų | 150.4 | 87% | 0.865 | 83% | 0.827 | S | S | * | * | trans | -76.8 | 144.7 | -179.9 | 47.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 240 | A | 26.2 | Very low | 28 | Very low | 103 Ų | 103 | 149.2 Ų | 149.2 | 85% | 0.851 | 83% | 0.832 | S | S | * | * | trans | -144 | 124.7 | 155.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 241 | N | 30.3 | Very low | 27.8 | Very low | 178 Ų | 178 | 146.2 Ų | 146.2 | 95% | 0.952 | 83% | 0.829 | S | S | * | * | trans | -62.3 | 148.5 | 177.1 | -87.9 | -33.3 | 0 | 0 | 0 | 113.1 | ||||
| 242 | G | 25.5 | Very low | 27.7 | Very low | 74 Ų | 74 | 145 Ų | 145 | 76% | 0.763 | 83% | 0.828 | S | S | * | * | trans | 162.6 | 106.9 | 163.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 243 | T | 30 | Very low | 27.4 | Very low | 142 Ų | 142 | 141.7 Ų | 141.7 | 87% | 0.871 | 83% | 0.826 | S | S | * | * | trans | -26.5 | 141.3 | 171.5 | 40.5 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 244 | R | 29.6 | Very low | 27.4 | Very low | 234 Ų | 234 | 141.2 Ų | 141.2 | 88% | 0.883 | 82% | 0.824 | S | S | * | * | trans | 92.8 | 131.9 | 144.8 | -129.7 | -178.9 | -119.5 | -139 | -0.5 | 118.8 | ||||
| 245 | L | 26.6 | Very low | 27.4 | Very low | 159 Ų | 159 | 142.5 Ų | 142.5 | 83% | 0.832 | 82% | 0.821 | S | S | * | * | trans | 68.7 | 115.4 | 178.4 | -76.6 | 100.2 | 0 | 0 | 0 | 117.8 | ||||
| 246 | R | 24.3 | Very low | 27.4 | Very low | 217 Ų | 217 | 144.8 Ų | 144.8 | 82% | 0.819 | 82% | 0.821 | S | S | * | * | trans | -108.4 | 95.5 | 161 | -77.5 | -167.2 | -171.2 | -153.8 | 0.2 | 110.3 | H248 | R246-H248 WeakPolarHBondContact CD-NE2 3.49Š| ||
| 247 | S | 23.8 | Very low | 27.2 | Very low | 111 Ų | 111 | 146.2 Ų | 146.2 | 78% | 0.776 | 82% | 0.817 | S | S | * | * | trans | -69.8 | 120.8 | 148.3 | 51.3 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 248 | H | 25.4 | Very low | 27.1 | Very low | 151 Ų | 151 | 147.7 Ų | 147.7 | 70% | 0.699 | 81% | 0.812 | S | S | * | * | trans | -101.4 | 85.6 | 169.3 | -82.1 | -74.2 | 0 | 0 | 0 | 109.3 | R246 | R246-H248 WeakPolarHBondContact CD-NE2 3.49Š| ||
| 249 | A | 23.3 | Very low | 26.9 | Very low | 85 Ų | 85 | 142.9 Ų | 142.9 | 70% | 0.702 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 133 | 150.8 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||
| 250 | P | 24.9 | Very low | 26.2 | Very low | 129 Ų | 129 | 141.5 Ų | 141.5 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -79 | 121.8 | 162.7 | 5.5 | 10.4 | 0 | 0 | 0 | 109 | ||
| 251 | A | 24 | Very low | 26.3 | Very low | 93 Ų | 93 | 144.6 Ų | 144.6 | 77% | 0.769 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -62 | 137.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 252 | A | 28.9 | Very low | 26 | Very low | 100 Ų | 100 | 145.3 Ų | 145.3 | 83% | 0.826 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 130.5 | 168.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 253 | L | 24.4 | Very low | 26 | Very low | 154 Ų | 154 | 146.8 Ų | 146.8 | 81% | 0.806 | 79% | 0.786 | S | S | * | * | trans | -112.7 | 100.6 | 159.6 | -128.9 | 92.3 | 0 | 0 | 0 | 108 | Q255 | L253-Q255 PolarHBondContact O-N 3.49Š| ||
| 254 | R | 31.9 | Very low | 25.9 | Very low | 222 Ų | 222 | 143.6 Ų | 143.6 | 84% | 0.838 | 78% | 0.782 | S | S | * | * | trans | -64.4 | 122.8 | 161.9 | -93 | -179.5 | 171.9 | 164.1 | -2.7 | 108.2 | ||||
| 255 | Q | 26 | Very low | 26 | Very low | 172 Ų | 172 | 144 Ų | 144 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | -129.3 | 111.8 | 151 | -78.4 | -173.3 | -15 | 0 | 0 | 108.3 | L253 | L253-Q255 PolarHBondContact O-N 3.49Š| ||
| 256 | H | 28 | Very low | 25.9 | Very low | 170 Ų | 170 | 141.8 Ų | 141.8 | 79% | 0.787 | 78% | 0.78 | S | S | * | * | trans | -64.1 | 132.9 | 170 | -83.1 | -87.4 | 0 | 0 | 0 | 109.7 | ||||
| 257 | C | 22.9 | Very low | 26.2 | Very low | 110 Ų | 110 | 141.5 Ų | 141.5 | 74% | 0.743 | 79% | 0.788 | S | S | * | * | trans | -148 | 121.1 | 156.2 | -134.3 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 258 | P | 25.6 | Very low | 26.4 | Very low | 107 Ų | 107 | 139.5 Ų | 139.5 | 70% | 0.695 | 78% | 0.779 | S | S | * | * | trans | -84.4 | 119 | 176.7 | 32 | -27.5 | 0 | 0 | 0 | 109.2 | ||||
| 259 | L | 24.7 | Very low | 26.5 | Very low | 149 Ų | 149 | 138.3 Ų | 138.3 | 78% | 0.78 | 79% | 0.787 | S | S | * | * | trans | -100.2 | 102.6 | 163.7 | -83.8 | 160.6 | 0 | 0 | 0 | 107.3 | ||||
| 260 | S | 24.2 | Very low | 26.8 | Very low | 112 Ų | 112 | 142.2 Ų | 142.2 | 78% | 0.783 | 79% | 0.79 | S | S | * | * | trans | -79.9 | 127.9 | 172.3 | -179.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 261 | Y | 27.9 | Very low | 27 | Very low | 167 Ų | 167 | 142.5 Ų | 142.5 | 66% | 0.655 | 78% | 0.784 | S | S | * | * | trans | -130.1 | 122.6 | 162.5 | 57.6 | -89.6 | 0 | 0 | 0 | 109 | C263 | Y261-C263 PolarHBondContact O-N 3.15Š| ||
| 262 | E | 24.3 | Very low | 27.2 | Very low | 194 Ų | 194 | 143.6 Ų | 143.6 | 91% | 0.907 | 78% | 0.776 | S | S | * | * | trans | -75 | 116.6 | 175.3 | -78.2 | -175.6 | 118.6 | 0 | 0 | 109.7 | ||||
| 263 | C | 24.9 | Very low | 27.1 | Very low | 104 Ų | 104 | 144.2 Ų | 144.2 | 70% | 0.703 | 77% | 0.77 | S | S | * | * | trans | -94.3 | 111.6 | 164.8 | -163.2 | 0 | 0 | 0 | 0 | 107.7 | Y261 R265 | Y261-C263 PolarHBondContact O-N 3.15Å; C263-R265 PolarHBondContact O-N 3.43Å | ||
| 264 | G | 29.5 | Very low | 27.3 | Very low | 76 Ų | 76 | 142 Ų | 142 | 78% | 0.784 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.9 | 111.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 265 | R | 29.7 | Very low | 27.1 | Very low | 243 Ų | 243 | 133.2 Ų | 133.2 | 92% | 0.917 | 74% | 0.744 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 91.1 | 56 | 169.4 | -148.9 | 179.8 | -67.2 | -172.3 | -1 | 116.6 | C263 | C263-R265 PolarHBondContact O-N 3.43Š|
| 266 | C | 25.8 | Very low | 27.2 | Very low | 111 Ų | 111 | 132.9 Ų | 132.9 | 75% | 0.75 | 75% | 0.746 | S | S | * | * | trans | -151.8 | 111.9 | 146 | -84.1 | 0 | 0 | 0 | 0 | 109 | A268 | C266-A268 VanDerWaalsContact C-N 3.27Å; C266-A268 PolarHBondContact O-N 2.71Å | ||
| 267 | E | 29.2 | Very low | 27.2 | Very low | 211 Ų | 211 | 132 Ų | 132 | 99% | 0.986 | 74% | 0.744 | S | S | * | * | trans | -72.5 | 81.6 | 165.3 | -94.9 | 177.5 | 127.5 | 0 | 0 | 109.2 | ||||
| 268 | A | 28.1 | Very low | 27.3 | Very low | 70 Ų | 70 | 135.5 Ų | 135.5 | 58% | 0.579 | 75% | 0.749 | S | S | * | * | trans | -161.9 | 96.1 | 161.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | C266 H270 | C266-A268 VanDerWaalsContact C-N 3.27Å; C266-A268 PolarHBondContact O-N 2.71Å; A268-H270 PolarHBondContact O-N 3.33Å; A268-H270 VanDerWaalsContact O-N 3.1Å | ||
| 269 | S | 28.5 | Very low | 27.3 | Very low | 125 Ų | 125 | 134.7 Ų | 134.7 | 87% | 0.874 | 75% | 0.746 | S | S | * | * | trans | -73.5 | 94 | 179.3 | -44.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 270 | H | 29.5 | Very low | 27.2 | Very low | 167 Ų | 167 | 133.2 Ų | 133.2 | 77% | 0.773 | 75% | 0.748 | S | S | * | * | trans | -125.4 | 110.5 | 167.7 | -69.9 | -76 | 0 | 0 | 0 | 110.8 | A268 L272 | A268-H270 PolarHBondContact O-N 3.33Å; A268-H270 VanDerWaalsContact O-N 3.1Å; H270-L272 PolarHBondContact O-N 3.24Å | ||
| 271 | L | 29.1 | Very low | 27.2 | Very low | 135 Ų | 135 | 137.5 Ų | 137.5 | 71% | 0.707 | 75% | 0.748 | S | S | * | * | trans | -66 | 111.5 | -179.2 | -81.5 | 141.5 | 0 | 0 | 0 | 111.6 | ||||
| 272 | L | 28.1 | Very low | 27 | Very low | 116 Ų | 116 | 140.5 Ų | 140.5 | 61% | 0.607 | 76% | 0.759 | S | S | * | * | trans | -86.6 | 114.8 | 163.2 | -82.4 | 149.1 | 0 | 0 | 0 | 108.6 | H270 P274 | H270-L272 PolarHBondContact O-N 3.24Å; L272-P274 WeakPolarHBondContact O-CD 3.48Å | ||
| 273 | T | 27.8 | Very low | 27.1 | Very low | 113 Ų | 113 | 138.7 Ų | 138.7 | 69% | 0.693 | 75% | 0.75 | S | S | * | * | trans | -98.6 | 115.1 | 176.7 | -3.5 | 0 | 0 | 0 | 0 | 109.9 | G275 | T273-G275 PolarHBondContact O-N 3.34Š| ||
| 274 | P | 27.3 | Very low | 27.1 | Very low | 107 Ų | 107 | 141.5 Ų | 141.5 | 70% | 0.695 | 76% | 0.756 | S | S | * | * | trans | -76.2 | 113.4 | 170.5 | 28 | -29.9 | 0 | 0 | 0 | 109.8 | L272 | L272-P274 WeakPolarHBondContact O-CD 3.48Š| ||
| 275 | G | 29 | Very low | 27.2 | Very low | 39 Ų | 39 | 142.4 Ų | 142.4 | 40% | 0.402 | 75% | 0.751 | S | S | . | * | trans | -93.4 | 117.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111 | T187 T273 M277 | T187-G275 PolarHBondContact OG1-O 3.35Å; T273-G275 PolarHBondContact O-N 3.34Å; G275-M277 PolarHBondContact O-N 3.12Å | ||
| 276 | I | 28 | Very low | 27.1 | Very low | 165 Ų | 165 | 134.5 Ų | 134.5 | 85% | 0.846 | 75% | 0.745 | S | S | * | * | trans | -84.3 | 100.2 | 168.7 | -58.4 | 176.1 | 0 | 0 | 0 | 107.3 | ||||
| 277 | M | 26.7 | Very low | 27.3 | Very low | 151 Ų | 151 | 138.3 Ų | 138.3 | 74% | 0.744 | 75% | 0.752 | S | S | * | * | trans | -92.7 | 118.5 | 174.6 | -77.7 | -92.8 | -172.9 | 0 | 0 | 109.9 | G275 S279 | G275-M277 PolarHBondContact O-N 3.12Å; M277-S279 PolarHBondContact O-N 3.08Å | ||
| 278 | H | 25.1 | Very low | 27.3 | Very low | 184 Ų | 184 | 138.9 Ų | 138.9 | 85% | 0.852 | 75% | 0.745 | S | S | * | * | trans | -85 | 100.4 | 170.6 | -128 | -100.2 | 0 | 0 | 0 | 108.6 | ||||
| 279 | S | 26 | Very low | 27.3 | Very low | 90 Ų | 90 | 140.3 Ų | 140.3 | 63% | 0.629 | 76% | 0.757 | S | S | * | * | trans | -90.7 | 114.4 | 174.9 | -171.7 | 0 | 0 | 0 | 0 | 110.6 | M277 | M277-S279 PolarHBondContact O-N 3.08Š| ||
| 280 | S | 22.8 | Very low | 27.5 | Very low | 118 Ų | 118 | 140 Ų | 140 | 83% | 0.825 | 75% | 0.75 | S | S | * | * | trans | -96.6 | 106.5 | 169.3 | -166.7 | 0 | 0 | 0 | 0 | 108.7 | R282 | S280-R282 PolarHBondContact O-N 3.46Š| ||
| 281 | Y | 24.9 | Very low | 27.5 | Very low | 201 Ų | 201 | 145.1 Ų | 145.1 | 79% | 0.788 | 77% | 0.774 | S | S | * | * | trans | -86.3 | 111.2 | 178.5 | -144.2 | -94.2 | 0 | 0 | 0 | 109.9 | ||||
| 282 | R | 23.4 | Very low | 27.5 | Very low | 231 Ų | 231 | 145.7 Ų | 145.7 | 87% | 0.872 | 78% | 0.778 | S | S | * | * | trans | -93.5 | 107.9 | 167.5 | -150.9 | -176.7 | -154.3 | -152.2 | 6.6 | 108 | S280 I284 | S280-R282 PolarHBondContact O-N 3.46Å; R282-I284 PolarHBondContact O-N 3.1Å; R282-I284 VanDerWaalsContact O-N 3.09Å | ||
| 283 | Q | 24.9 | Very low | 27.4 | Very low | 156 Ų | 156 | 147.2 Ų | 147.2 | 73% | 0.729 | 79% | 0.787 | S | S | * | * | trans | -66.7 | 107.9 | 177 | -160.3 | -175.1 | -19.7 | 0 | 0 | 109.1 | S285 | Q283-S285 PolarHBondContact O-N 3.38Š| ||
| 284 | I | 25.6 | Very low | 27.4 | Very low | 162 Ų | 162 | 149.1 Ų | 149.1 | 83% | 0.831 | 79% | 0.792 | S | S | * | * | trans | -75.3 | 103.9 | 170.1 | -57.6 | 174.2 | 0 | 0 | 0 | 106.3 | R282 G286 | R282-I284 PolarHBondContact O-N 3.1Å; R282-I284 VanDerWaalsContact O-N 3.09Å; I284-G286 PolarHBondContact O-N 3.49Å | ||
| 285 | S | 30.8 | Very low | 27.4 | Very low | 96 Ų | 96 | 151.6 Ų | 151.6 | 67% | 0.671 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -66 | 119.4 | 171.1 | 53.8 | 0 | 0 | 0 | 0 | 109.1 | Q283 Q287 | Q283-S285 PolarHBondContact O-N 3.38Å; S285-Q287 PolarHBondContact O-N 3.43Å |
| 286 | G | 29.5 | Very low | 27.3 | Very low | 77 Ų | 77 | 158.6 Ų | 158.6 | 79% | 0.794 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 120.4 | 173 | 0 | 0 | 0 | 0 | 0 | 111.1 | I284 R288 | I284-G286 PolarHBondContact O-N 3.49Å; G286-R288 PolarHBondContact O-N 3.41Å |
| 287 | Q | 29.1 | Very low | 27.3 | Very low | 191 Ų | 191 | 158.2 Ų | 158.2 | 89% | 0.893 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 117.3 | 162 | -79.4 | -170.1 | -29.2 | 0 | 0 | 107.9 | S285 A289 | S285-Q287 PolarHBondContact O-N 3.43Å; Q287-A289 PolarHBondContact O-N 2.98Å |
| 288 | R | 29.1 | Very low | 27.3 | Very low | 222 Ų | 222 | 158.7 Ų | 158.7 | 84% | 0.838 | 83% | 0.826 | S | S | * | * | trans | -64.4 | 109.5 | 162.9 | -178.5 | -178.6 | -69 | 176.6 | -3.9 | 106.9 | G286 T290 | G286-R288 PolarHBondContact O-N 3.41Å; R288-T290 PolarHBondContact O-N 3.05Å | ||
| 289 | A | 28.4 | Very low | 27.5 | Very low | 100 Ų | 100 | 156.8 Ų | 156.8 | 83% | 0.826 | 82% | 0.824 | S | S | * | * | trans | -74.6 | 109.8 | 165.1 | 0 | 0 | 0 | 0 | 0 | 107.5 | Q287 | Q287-A289 PolarHBondContact O-N 2.98Š| ||
| 290 | T | 31.7 | Very low | 27.6 | Very low | 120 Ų | 120 | 162.3 Ų | 162.3 | 74% | 0.736 | 84% | 0.84 | S | S | * | * | trans | -91.7 | 116 | 157.5 | 45.7 | 0 | 0 | 0 | 0 | 106.9 | R288 | R288-T290 PolarHBondContact O-N 3.05Š| ||
| 291 | E | 31.3 | Very low | 28.1 | Very low | 274 Ų | 274 | 166.4 Ų | 166.4 | 100% | 1.28 | 84% | 0.842 | S | S | * | * | trans | -154.8 | 0 | 143.4 | -105.5 | 179.1 | 138.7 | 0 | 0 | 107.8 |
Retrieved 291 of 291 residues in 65.3 ms
(Link to these results)